A0A077ZJP4_TRITR Loading...

TerC domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZJP4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 321 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

 

Download Structure   PDB   PAE   Table  
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
1M53.2Low75.6Confident124 Ų12472.4 Ų72.461%0.61141%0.414SS*.  01290-70.6174.6147.700108.4I137 T232M1-I137 HydrophobicContact CE-CB 4.35Å; M1-I137 HydrophobicContact CE-CG2 3.67Å; M1-T232 HydrophobicContact CE-CG2 4.44Å
2N59.5Low76.3Confident165 Ų16569.5 Ų69.588%0.88241%0.413SS*.  trans-91.1112.3174.9-69.4-18.2000108.1
3T73.4Confident77.2Confident64 Ų6464.8 Ų64.839%0.39338%0.384SS..  trans-92.8137.8169.5177.70000108.6G5 D233T3-G5 PolarHBondContact O-N 3.18Å; T3-G5 PolarHBondContact OG1-N 3.07Å; T3-D233 WeakPolarHBondContact CA-OD2 3.42Å; T3-D233 WeakPolarHBondContact CB-OD1 3.4Å; T3-D233 PolarHBondContact OG1-OD1 3.42Å; T3-D233 PolarHBondContact OG1-OD2 2.99Å
4V75Confident78Confident21 Ų2164.3 Ų64.313%0.12739%0.39CS..  trans-74.7-9.8168-62.50000111.8T6 L9 F59 L63 V71 Q75 D233 F235 I236V4-T6 VanDerWaalsContact C-N 3.34Å; V4-T6 PolarHBondContact O-N 2.93Å; V4-L9 WeakPolarHBondContact O-CD1 3.46Å; V4-F59 HydrophobicContact CG2-CE2 4.04Å; V4-F59 HydrophobicContact CG2-CZ 3.78Å; V4-L63 HydrophobicContact CB-CD2 4.12Å; V4-L63 HydrophobicContact CG1-CD2 4.34Å; V4-V71 HydrophobicContact CG1-CG1 4.16Å; V4-Q75 HydrophobicContact CG1-CG 4.24Å; V4-D233 WeakPolarHBondContact CG2-OD2 3.26Å; V4-D233 PolarHBondContact N-OD2 2.98Å; V4-F235 HydrophobicContact CG2-CD1 4.32Å; V4-I236 HydrophobicContact CG2-CD1 4.34Å; V4-I236 HydrophobicContact CG2-CG1 4.5Å
5G71.8Confident78.6Confident11 Ų1165.7 Ų65.711%0.11340%0.399CS..  trans-68.185.5-179.800000112.2T3 W10T3-G5 PolarHBondContact O-N 3.18Å; T3-G5 PolarHBondContact OG1-N 3.07Å; G5-W10 PolarHBondContact O-NE1 2.98Å
6T80.6Confident79.1Confident48 Ų4864.8 Ų64.829%0.29439%0.393SS..  trans-66.8155167.365.40000110.1V4 L8 L9 W10V4-T6 VanDerWaalsContact C-N 3.34Å; V4-T6 PolarHBondContact O-N 2.93Å; T6-L8 PolarHBondContact O-N 2.81Å; T6-L9 PolarHBondContact O-N 3.16Å; T6-L9 PolarHBondContact OG1-N 2.96Å; T6-W10 PolarHBondContact O-N 3.19Å
7P79.1Confident79.6Confident119 Ų11961.8 Ų61.877%0.77338%0.375SS*.Hα-helixtrans-53.1-31.1175.2-27.835.3000113.1G11P7-G11 PolarHBondContact O-N 3.45Å
8L82.4Confident80.1Confident121 Ų12161.6 Ų61.663%0.63438%0.381SS*.Hα-helixtrans-68.3-44.9174.7-172.2153.1000112T6 G11 G12T6-L8 PolarHBondContact O-N 2.81Å; L8-G11 PolarHBondContact O-N 3.04Å; L8-G12 PolarHBondContact O-N 2.83Å
9L85.1Confident80.5Confident21 Ų2163.2 Ų63.211%0.1139%0.386CS..Hα-helixtrans-64.6-43176-80.3176.6000112.1V4 T6 G12 F13 F59 Y62 F235V4-L9 WeakPolarHBondContact O-CD1 3.46Å; T6-L9 PolarHBondContact O-N 3.16Å; T6-L9 PolarHBondContact OG1-N 2.96Å; L9-G12 PolarHBondContact O-N 2.98Å; L9-F13 WeakPolarHBondContact O-CB 3.5Å; L9-F13 PolarHBondContact O-N 3.31Å; L9-F59 HydrophobicContact CD1-CE2 4.45Å; L9-Y62 HydrophobicContact CD1-CD1 4.03Å; L9-Y62 HydrophobicContact CD1-CE1 3.53Å; L9-Y62 HydrophobicContact CD2-CD1 3.73Å; L9-Y62 HydrophobicContact CD2-CE1 3.63Å; L9-Y62 HydrophobicContact CD2-CG 4.27Å; L9-Y62 HydrophobicContact CG-CD1 4.21Å; L9-Y62 HydrophobicContact CG-CE1 3.63Å; L9-F235 HydrophobicContact CB-CE2 4.09Å; L9-F235 HydrophobicContact CB-CZ 3.97Å
10W87.7Confident80.8Confident66 Ų6660.2 Ų60.225%0.2537%0.367CS..Hα-helixtrans-60.3-46.4173.7-81.7103.9000112G5 T6 F13 A14 F131 F235 L238G5-W10 PolarHBondContact O-NE1 2.98Å; T6-W10 PolarHBondContact O-N 3.19Å; W10-F13 PolarHBondContact O-N 3.18Å; W10-A14 WeakPolarHBondContact O-CB 3.29Å; W10-A14 PolarHBondContact O-N 3.48Å; W10-F131 AromaticContact CH2-CE1 3.98Å; W10-F131 HydrophobicContact CH2-CE1 3.98Å; W10-F131 AromaticContact CH2-CZ 3.67Å; W10-F131 HydrophobicContact CH2-CZ 3.67Å; W10-F131 AromaticContact CZ3-CZ 3.95Å; W10-F131 HydrophobicContact CZ3-CZ 3.95Å; W10-F235 AromaticContact CD2-CD2 3.76Å; W10-F235 HydrophobicContact CD2-CD2 3.76Å; W10-F235 HydrophobicContact CD2-CE2 4.37Å; W10-F235 AromaticContact CE2-CD2 3.59Å; W10-F235 HydrophobicContact CE3-CD2 4.23Å; W10-F235 HydrophobicContact CG-CD2 4.16Å; W10-F235 HydrophobicContact CH2-CB 4.47Å; W10-F235 HydrophobicContact CH2-CD2 4.35Å; W10-F235 HydrophobicContact CZ2-CB 3.7Å; W10-F235 AromaticContact CZ2-CD2 3.89Å; W10-F235 HydrophobicContact CZ2-CD2 3.89Å; W10-F235 HydrophobicContact CZ2-CG 4.31Å; W10-F235 AromaticContact NE1-CD2 3.88Å; W10-L238 HydrophobicContact CH2-CB 4.34Å; W10-L238 HydrophobicContact CH2-CD2 3.69Å; W10-L238 HydrophobicContact CZ3-CD2 3.35Å
11G84.3Confident81Confident36 Ų3658.8 Ų58.837%0.37136%0.357SS..Hα-helixtrans-63-47.4176.900000112.6P7 L8 F13 A14 V15P7-G11 PolarHBondContact O-N 3.45Å; L8-G11 PolarHBondContact O-N 3.04Å; G11-F13 VanDerWaalsContact C-N 3.34Å; G11-F13 PolarHBondContact O-N 3.01Å; G11-A14 PolarHBondContact O-N 3.09Å; G11-V15 WeakPolarHBondContact O-CG2 3.23Å; G11-V15 PolarHBondContact O-N 2.79Å
12G84Confident82.7Confident38 Ų3854.8 Ų54.839%0.39234%0.344SS..Hα-helixtrans-60.7-43.1176.400000112.1L8 L9 V15 V16L8-G12 PolarHBondContact O-N 2.83Å; L9-G12 PolarHBondContact O-N 2.98Å; G12-V15 PolarHBondContact O-N 3.43Å; G12-V16 WeakPolarHBondContact O-CG2 3.45Å; G12-V16 PolarHBondContact O-N 3.4Å
13F87.5Confident83.9Confident9 Ų949.8 Ų49.84%0.03932%0.317CS..Hα-helixtrans-63.2-45.4175.1174.3-114.2000112.4L9 W10 G11 V15 V16 V17 F55 F235 L238 T239 L242 F243L9-F13 WeakPolarHBondContact O-CB 3.5Å; L9-F13 PolarHBondContact O-N 3.31Å; W10-F13 PolarHBondContact O-N 3.18Å; G11-F13 VanDerWaalsContact C-N 3.34Å; G11-F13 PolarHBondContact O-N 3.01Å; F13-V15 VanDerWaalsContact C-N 3.26Å; F13-V15 PolarHBondContact O-N 2.94Å; F13-V16 PolarHBondContact O-N 3.36Å; F13-V16 VanDerWaalsContact O-N 3.09Å; F13-V17 HydrophobicContact CD1-CG2 4.3Å; F13-V17 HydrophobicContact CD2-CG2 3.9Å; F13-V17 HydrophobicContact CE1-CG2 3.78Å; F13-V17 HydrophobicContact CE2-CG2 3.33Å; F13-V17 HydrophobicContact CG-CG2 4.36Å; F13-V17 HydrophobicContact CZ-CG2 3.27Å; F13-V17 WeakPolarHBondContact O-CG2 3.4Å; F13-V17 PolarHBondContact O-N 3.31Å; F13-F55 HydrophobicContact CD2-CE2 4.05Å; F13-F55 AromaticContact CD2-CZ 3.98Å; F13-F55 HydrophobicContact CD2-CZ 3.98Å; F13-F235 HydrophobicContact CB-CE2 4.01Å; F13-F235 HydrophobicContact CB-CZ 4.36Å; F13-F235 HydrophobicContact CG-CE2 4.37Å; F13-L238 HydrophobicContact CE1-CD2 4.22Å; F13-L238 HydrophobicContact CE1-CG 4.42Å; F13-T239 HydrophobicContact CD1-CG2 3.79Å; F13-T239 HydrophobicContact CD2-CG2 3.61Å; F13-T239 HydrophobicContact CE1-CG2 3.74Å; F13-T239 HydrophobicContact CE2-CG2 3.55Å; F13-T239 HydrophobicContact CG-CG2 3.71Å; F13-T239 HydrophobicContact CZ-CG2 3.61Å; F13-L242 HydrophobicContact CE1-CD1 3.72Å; F13-L242 HydrophobicContact CZ-CB 4.07Å; F13-L242 HydrophobicContact CZ-CD1 3.6Å; F13-L242 HydrophobicContact CZ-CG 4.4Å; F13-F243 HydrophobicContact CD2-CE2 4.19Å; F13-F243 HydrophobicContact CE2-CD2 4.11Å; F13-F243 AromaticContact CE2-CE2 3.68Å; F13-F243 HydrophobicContact CE2-CE2 3.68Å
14A87.8Confident84.3Confident57 Ų5747 Ų4747%0.47130%0.299SS..Hα-helixtrans-58.6-39.6176.800000111.7W10 G11 A18W10-A14 WeakPolarHBondContact O-CB 3.29Å; W10-A14 PolarHBondContact O-N 3.48Å; G11-A14 PolarHBondContact O-N 3.09Å; A14-A18 VanDerWaalsContact O-CB 3.26Å; A14-A18 WeakPolarHBondContact O-CB 3.27Å; A14-A18 PolarHBondContact O-N 3.3Å
15V87.7Confident84.6Confident86 Ų8648.9 Ų48.952%0.52131%0.308SS..Hα-helixtrans-63.8-45.8173.71720000111.2G11 G12 F13 A18 I19G11-V15 WeakPolarHBondContact O-CG2 3.23Å; G11-V15 PolarHBondContact O-N 2.79Å; G12-V15 PolarHBondContact O-N 3.43Å; F13-V15 VanDerWaalsContact C-N 3.26Å; F13-V15 PolarHBondContact O-N 2.94Å; V15-A18 PolarHBondContact O-N 3.01Å; V15-I19 HydrophobicContact CG1-CD1 3.78Å; V15-I19 HydrophobicContact CG1-CG1 4.45Å; V15-I19 VanDerWaalsContact O-CG1 3.27Å; V15-I19 WeakPolarHBondContact O-CG1 3.46Å; V15-I19 PolarHBondContact O-N 3.44Å
16V87.4Confident84.8Confident50 Ų5054 Ų5430%0.30333%0.332SS..Hα-helixtrans-60.2-47.3177.1170.50000111.1G12 F13 A18 I19 M20 F243G12-V16 WeakPolarHBondContact O-CG2 3.45Å; G12-V16 PolarHBondContact O-N 3.4Å; F13-V16 PolarHBondContact O-N 3.36Å; F13-V16 VanDerWaalsContact O-N 3.09Å; V16-A18 PolarHBondContact O-N 3.45Å; V16-I19 PolarHBondContact O-N 2.96Å; V16-M20 HydrophobicContact CG1-CG 4.31Å; V16-M20 HydrophobicContact CG1-SD 3.73Å; V16-M20 WeakPolarHBondContact O-CB 3.35Å; V16-M20 VanDerWaalsContact O-CG 3.25Å; V16-M20 WeakPolarHBondContact O-CG 3.44Å; V16-M20 PolarHBondContact O-N 2.92Å; V16-F243 HydrophobicContact CG1-CZ 4.01Å
17V86.9Confident84.1Confident14 Ų1455.5 Ų55.59%0.08534%0.338CS..Hα-helixtrans-62.3-43.1177.1172.80000111F13 I19 M20 L21 L242F13-V17 HydrophobicContact CD1-CG2 4.3Å; F13-V17 HydrophobicContact CD2-CG2 3.9Å; F13-V17 HydrophobicContact CE1-CG2 3.78Å; F13-V17 HydrophobicContact CE2-CG2 3.33Å; F13-V17 HydrophobicContact CG-CG2 4.36Å; F13-V17 HydrophobicContact CZ-CG2 3.27Å; F13-V17 WeakPolarHBondContact O-CG2 3.4Å; F13-V17 PolarHBondContact O-N 3.31Å; V17-I19 VanDerWaalsContact C-N 3.33Å; V17-I19 PolarHBondContact O-N 3.4Å; V17-M20 PolarHBondContact O-N 3.46Å; V17-L21 HydrophobicContact CG1-CD1 3.87Å; V17-L21 HydrophobicContact CG1-CG 4.21Å; V17-L21 WeakPolarHBondContact O-CB 3.44Å; V17-L21 WeakPolarHBondContact O-CG 3.09Å; V17-L21 PolarHBondContact O-N 3.18Å; V17-L242 HydrophobicContact CG2-CD1 4.34Å
18A87.9Confident83.3Confident59 Ų5950.3 Ų50.349%0.48830%0.304SS..Hα-helixtrans-61.5-41.7176.900000111.8A14 V15 V16 A22A14-A18 VanDerWaalsContact O-CB 3.26Å; A14-A18 WeakPolarHBondContact O-CB 3.27Å; A14-A18 PolarHBondContact O-N 3.3Å; V15-A18 PolarHBondContact O-N 3.01Å; V16-A18 PolarHBondContact O-N 3.45Å; A18-A22 VanDerWaalsContact O-CB 3.25Å; A18-A22 WeakPolarHBondContact O-CB 3.44Å; A18-A22 PolarHBondContact O-N 3.12Å
19I87.9Confident82.1Confident92 Ų9246.6 Ų46.647%0.47230%0.295SS..Hα-helixtrans-64.6-46.1174.6-69.1166.8000110.4V15 V16 V17 L21 A22 I23V15-I19 HydrophobicContact CG1-CD1 3.78Å; V15-I19 HydrophobicContact CG1-CG1 4.45Å; V15-I19 VanDerWaalsContact O-CG1 3.27Å; V15-I19 WeakPolarHBondContact O-CG1 3.46Å; V15-I19 PolarHBondContact O-N 3.44Å; V16-I19 PolarHBondContact O-N 2.96Å; V17-I19 VanDerWaalsContact C-N 3.33Å; V17-I19 PolarHBondContact O-N 3.4Å; I19-L21 PolarHBondContact O-N 3.05Å; I19-A22 PolarHBondContact O-N 3.11Å; I19-I23 HydrophobicContact CG2-CD1 3.72Å; I19-I23 HydrophobicContact CG2-CG1 4.3Å; I19-I23 WeakPolarHBondContact O-CB 3.27Å; I19-I23 WeakPolarHBondContact O-CG1 3.32Å; I19-I23 PolarHBondContact O-N 3.49Å
20M86.6Confident80.6Confident3 Ų356.2 Ų56.22%0.01533%0.33CS..Hα-helixtrans-61.5-44.8178.4-73.2175.173.600111.4V16 V17 I23 D24 W48 L51 F243 L246V16-M20 HydrophobicContact CG1-CG 4.31Å; V16-M20 HydrophobicContact CG1-SD 3.73Å; V16-M20 WeakPolarHBondContact O-CB 3.35Å; V16-M20 VanDerWaalsContact O-CG 3.25Å; V16-M20 WeakPolarHBondContact O-CG 3.44Å; V16-M20 PolarHBondContact O-N 2.92Å; V17-M20 PolarHBondContact O-N 3.46Å; M20-I23 PolarHBondContact O-N 2.89Å; M20-D24 VanDerWaalsContact O-CB 3.32Å; M20-D24 WeakPolarHBondContact O-CB 3.46Å; M20-D24 PolarHBondContact O-N 3.19Å; M20-W48 HydrophobicContact CB-CH2 4.06Å; M20-W48 HydrophobicContact CB-CZ3 3.76Å; M20-W48 HydrophobicContact CE-CE3 3.47Å; M20-W48 VanDerWaalsContact CE-CE3 3.47Å; M20-W48 HydrophobicContact CE-CZ3 3.3Å; M20-W48 HydrophobicContact CG-CZ3 3.83Å; M20-W48 WeakPolarHBondContact O-CH2 3.47Å; M20-W48 HydrophobicContact SD-CZ3 4.37Å; M20-L51 HydrophobicContact CE-CD2 3.74Å; M20-L51 HydrophobicContact CE-CG 4.26Å; M20-L51 HydrophobicContact CG-CD2 3.79Å; M20-L51 HydrophobicContact SD-CD2 3.87Å; M20-L51 HydrophobicContact SD-CG 4.41Å; M20-F243 HydrophobicContact CE-CD1 3.51Å; M20-F243 HydrophobicContact CE-CE1 3.38Å; M20-F243 HydrophobicContact CE-CZ 4.38Å; M20-F243 HydrophobicContact SD-CD1 4.09Å; M20-F243 HydrophobicContact SD-CE1 3.38Å; M20-F243 WeakPolarHBondContact SD-CE1 3.26Å; M20-F243 HydrophobicContact SD-CZ 3.85Å; M20-L246 HydrophobicContact CB-CD1 4.08Å; M20-L246 HydrophobicContact CB-CD2 4.45Å; M20-L246 HydrophobicContact CE-CB 3.92Å; M20-L246 HydrophobicContact CE-CD1 3.34Å; M20-L246 HydrophobicContact CE-CG 4.17Å; M20-L246 HydrophobicContact SD-CD1 3.84Å
21L86Confident79Confident31 Ų3159 Ų5916%0.16234%0.34CS..Hα-helixtrans-62.7-43.2173.9-75.3176.7000111.6V17 I19 I23 D24 L25 L120 I123 L246V17-L21 HydrophobicContact CG1-CD1 3.87Å; V17-L21 HydrophobicContact CG1-CG 4.21Å; V17-L21 WeakPolarHBondContact O-CB 3.44Å; V17-L21 WeakPolarHBondContact O-CG 3.09Å; V17-L21 PolarHBondContact O-N 3.18Å; I19-L21 PolarHBondContact O-N 3.05Å; L21-I23 VanDerWaalsContact C-N 3.35Å; L21-I23 PolarHBondContact O-N 3Å; L21-D24 PolarHBondContact O-N 3.28Å; L21-L25 VanDerWaalsContact O-CB 3.31Å; L21-L25 WeakPolarHBondContact O-CB 3.26Å; L21-L25 WeakPolarHBondContact O-CG 3.43Å; L21-L25 PolarHBondContact O-N 3.28Å; L21-L120 HydrophobicContact CD2-CD2 4.14Å; L21-I123 HydrophobicContact CD1-CD1 4.34Å; L21-I123 HydrophobicContact CD2-CD1 3.62Å; L21-I123 HydrophobicContact CG-CD1 4.44Å; L21-L246 HydrophobicContact CD2-CD2 3.82Å; L21-L246 HydrophobicContact CG-CD2 4.31Å
22A87.6Confident77.4Confident40 Ų4059.6 Ų59.633%0.33135%0.346SS..Hα-helixtrans-61.3-43.8175.400000111.3A18 I19 L25 L26A18-A22 VanDerWaalsContact O-CB 3.25Å; A18-A22 WeakPolarHBondContact O-CB 3.44Å; A18-A22 PolarHBondContact O-N 3.12Å; I19-A22 PolarHBondContact O-N 3.11Å; A22-L25 PolarHBondContact O-N 2.91Å; A22-L26 HydrophobicContact CB-CD1 4.25Å; A22-L26 WeakPolarHBondContact O-CA 3.32Å; A22-L26 WeakPolarHBondContact O-CB 3.25Å; A22-L26 WeakPolarHBondContact O-CD1 3.3Å; A22-L26 WeakPolarHBondContact O-CG 3.38Å; A22-L26 PolarHBondContact O-N 2.7Å
23I84.6Confident75.7Confident60 Ų6061.4 Ų61.431%0.30836%0.358SS..Hα-helixtrans-60-48.5175-72.9171.5000110.2I19 M20 L21 L25 L27 W44 W48I19-I23 HydrophobicContact CG2-CD1 3.72Å; I19-I23 HydrophobicContact CG2-CG1 4.3Å; I19-I23 WeakPolarHBondContact O-CB 3.27Å; I19-I23 WeakPolarHBondContact O-CG1 3.32Å; I19-I23 PolarHBondContact O-N 3.49Å; M20-I23 PolarHBondContact O-N 2.89Å; L21-I23 VanDerWaalsContact C-N 3.35Å; L21-I23 PolarHBondContact O-N 3Å; I23-L25 PolarHBondContact O-N 2.94Å; I23-L27 HydrophobicContact CB-CD1 4.45Å; I23-L27 HydrophobicContact CG2-CD1 3.57Å; I23-L27 HydrophobicContact CG2-CG 4.39Å; I23-L27 WeakPolarHBondContact O-CB 3.38Å; I23-L27 PolarHBondContact O-N 3.42Å; I23-W44 HydrophobicContact CG2-CZ3 4.36Å; I23-W48 HydrophobicContact CG2-CH2 4.35Å
24D82.2Confident73.9Confident5 Ų568.7 Ų68.73%0.02739%0.392CS..Hα-helixtrans-63.5-41.9-179-173.681.9000112.1M20 L21 Q28 W48 R249M20-D24 VanDerWaalsContact O-CB 3.32Å; M20-D24 WeakPolarHBondContact O-CB 3.46Å; M20-D24 PolarHBondContact O-N 3.19Å; L21-D24 PolarHBondContact O-N 3.28Å; D24-Q28 WeakPolarHBondContact O-CB 3.23Å; D24-Q28 VanDerWaalsContact O-CG 3.3Å; D24-Q28 WeakPolarHBondContact O-CG 3.4Å; D24-Q28 PolarHBondContact OD1-NE2 3.22Å; D24-Q28 PolarHBondContact OD1-OE1 3.33Å; D24-W48 HydrophobicContact CB-CH2 4.07Å; D24-W48 HydrophobicContact CB-CZ2 3.78Å; D24-R249 PolarHBondContact O-NH1 2.87Å; D24-R249 VanDerWaalsContact O-NH1 3.14Å; D24-R249 IonicContact OD1-NH1 2.91Å; D24-R249 IonicContact OD2-CZ 3.95Å; D24-R249 IonicContact OD2-NH1 2.63Å; D24-R249 PolarHBondContact OD2-NH1 3.09Å; D24-R249 IonicContact OD2-NH2 3.01Å; D24-R249 PolarHBondContact OD2-NH2 3.32Å
25L81Confident72.7Confident61 Ų6168.2 Ų68.232%0.31939%0.388SS..Hα-helixtrans-74.8-44.9178.3-65.7176.3000112.4L21 A22 I23 G29 V116 L120L21-L25 VanDerWaalsContact O-CB 3.31Å; L21-L25 WeakPolarHBondContact O-CB 3.26Å; L21-L25 WeakPolarHBondContact O-CG 3.43Å; L21-L25 PolarHBondContact O-N 3.28Å; A22-L25 PolarHBondContact O-N 2.91Å; I23-L25 PolarHBondContact O-N 2.94Å; L25-G29 WeakPolarHBondContact O-CA 3.23Å; L25-G29 PolarHBondContact O-N 3.18Å; L25-V116 HydrophobicContact CD2-CG1 3.46Å; L25-V116 VanDerWaalsContact CD2-CG1 3.46Å; L25-L120 HydrophobicContact CD2-CD1 4.4Å
26L75.7Confident71.9Confident117 Ų11765.4 Ų65.461%0.61337%0.369SS*.Hα-helixtrans-79.2-47.2-173.5-64.3172.1000112.6A22 R30A22-L26 HydrophobicContact CB-CD1 4.25Å; A22-L26 WeakPolarHBondContact O-CA 3.32Å; A22-L26 WeakPolarHBondContact O-CB 3.25Å; A22-L26 WeakPolarHBondContact O-CD1 3.3Å; A22-L26 WeakPolarHBondContact O-CG 3.38Å; A22-L26 PolarHBondContact O-N 2.7Å; L26-R30 WeakPolarHBondContact O-CG 3.47Å; L26-R30 PolarHBondContact O-N 2.95Å
27L67Low71.6Confident80 Ų8066.5 Ų66.542%0.41938%0.376SS..Hα-helixtrans-73.1-32.8-177.4-65.5177.6000111.9I23 W44I23-L27 HydrophobicContact CB-CD1 4.45Å; I23-L27 HydrophobicContact CG2-CD1 3.57Å; I23-L27 HydrophobicContact CG2-CG 4.39Å; I23-L27 WeakPolarHBondContact O-CB 3.38Å; I23-L27 PolarHBondContact O-N 3.42Å; L27-W44 HydrophobicContact CB-CH2 4.32Å; L27-W44 HydrophobicContact CB-CZ2 4.42Å; L27-W44 HydrophobicContact CD1-CH2 3.54Å; L27-W44 HydrophobicContact CD1-CZ2 4.25Å; L27-W44 HydrophobicContact CD1-CZ3 4.45Å
28Q61.2Low71.3Confident10 Ų1070.1 Ų70.15%0.04739%0.393CS..Hα-helixtrans-92.4-24.1179.6-49.4175.821.600112.2D24 R112 R249D24-Q28 WeakPolarHBondContact O-CB 3.23Å; D24-Q28 VanDerWaalsContact O-CG 3.3Å; D24-Q28 WeakPolarHBondContact O-CG 3.4Å; D24-Q28 PolarHBondContact OD1-NE2 3.22Å; D24-Q28 PolarHBondContact OD1-OE1 3.33Å; Q28-R112 PolarHBondContact O-NH1 2.84Å; Q28-R249 VanDerWaalsContact OE1-CD 3.32Å
29G58.6Low71.2Confident44 Ų4476 Ų7645%0.45441%0.408SS..Hα-helixtrans-67.7-32.3173.400000113.5L25 R31 R112L25-G29 WeakPolarHBondContact O-CA 3.23Å; L25-G29 PolarHBondContact O-N 3.18Å; G29-R31 PolarHBondContact O-N 3.35Å; G29-R112 PolarHBondContact O-NH1 3.47Å
30R53.2Low71.1Confident222 Ų22275.6 Ų75.684%0.83840%0.404SS*.THydrogen-bonded Turntrans-74-19.3-177.4-80.8179.6147.3176.8-5.5115.7L26 G32L26-R30 WeakPolarHBondContact O-CG 3.47Å; L26-R30 PolarHBondContact O-N 2.95Å; R30-G32 PolarHBondContact O-N 2.94Å
31R54.2Low71.1Confident124 Ų12475.4 Ų75.447%0.46840%0.403SS..SBendtrans-87.998.5-177.1-66.2-172.8177122.2-1.2109.7G29 R112G29-R31 PolarHBondContact O-N 3.35Å; R31-R112 PolarHBondContact O-NH1 3.19Å
32G49.6Very low71.3Confident49 Ų4976 Ų7651%0.50541%0.412SS..  trans-64.6141.3-175.700000114R30 H34R30-G32 PolarHBondContact O-N 2.94Å; G32-H34 PolarHBondContact O-N 2.88Å; G32-H34 PolarHBondContact O-ND1 3.37Å
33A49Very low71.5Confident76 Ų7676.6 Ų76.663%0.62842%0.417SS*.SBendtrans48.5-19.3166.600000120.5A35A33-A35 PolarHBondContact O-N 3.34Å
34H50.3Low71.7Confident163 Ų16375.7 Ų75.776%0.75541%0.41SS*.PPolyproline II helixtrans-85.1118.1-178.1-66.563.4000107.8G32 M36G32-H34 PolarHBondContact O-N 2.88Å; G32-H34 PolarHBondContact O-ND1 3.37Å; H34-M36 PolarHBondContact O-N 3.14Å
35A63.2Low72.1Confident47 Ų4776.3 Ų76.339%0.38842%0.415SS..PPolyproline II helixtrans-47.2135.6161.300000108.6A33 T37 A108 F253A33-A35 PolarHBondContact O-N 3.34Å; A35-T37 PolarHBondContact O-N 3.44Å; A35-A108 HydrophobicContact CB-CB 4.1Å; A35-F253 HydrophobicContact CB-CE1 4.39Å
36M70.7Confident72.7Confident26 Ų2678.8 Ų78.813%0.12843%0.428CS..PPolyproline II helixtrans-58.3126178179.4172.6-87.700108.5H34 Q40 A41 W44 F253H34-M36 PolarHBondContact O-N 3.14Å; M36-Q40 HydrophobicContact CG-CB 3.59Å; M36-Q40 HydrophobicContact SD-CB 4.29Å; M36-A41 HydrophobicContact CG-CB 4.04Å; M36-A41 WeakPolarHBondContact SD-CA 3.36Å; M36-A41 HydrophobicContact SD-CB 3.95Å; M36-W44 HydrophobicContact CE-CG 3.92Å; M36-W44 HydrophobicContact SD-CB 4.46Å; M36-W44 HydrophobicContact SD-CG 4.4Å; M36-F253 HydrophobicContact CB-CB 4.05Å; M36-F253 HydrophobicContact CB-CD2 3.97Å; M36-F253 HydrophobicContact CB-CG 3.94Å
37T79.4Confident73.5Confident74 Ų7476.7 Ų76.745%0.45442%0.42SS..PPolyproline II helixtrans-65.6151.8178.9640000110.1A35 K39 Q40 A41A35-T37 PolarHBondContact O-N 3.44Å; T37-K39 PolarHBondContact O-N 2.87Å; T37-K39 VanDerWaalsContact O-N 3.13Å; T37-Q40 WeakPolarHBondContact O-CA 3.27Å; T37-Q40 WeakPolarHBondContact O-CB 3.3Å; T37-Q40 PolarHBondContact O-N 2.8Å; T37-Q40 VanDerWaalsContact OG1-CG 3.29Å; T37-Q40 WeakPolarHBondContact OG1-CG 3.46Å; T37-A41 PolarHBondContact O-N 2.95Å
38M80.7Confident74.7Confident89 Ų8973.1 Ų73.144%0.43840%0.4SS..Hα-helixtrans-49.8-42.6179.8-174.266.5177.800113Q40 A41 A42 L254 V258M38-Q40 PolarHBondContact O-N 2.87Å; M38-A41 PolarHBondContact O-N 2.95Å; M38-A42 WeakPolarHBondContact O-CB 3.21Å; M38-A42 PolarHBondContact O-N 2.98Å; M38-L254 HydrophobicContact CE-CD1 3.4Å; M38-L254 HydrophobicContact CE-CG 3.87Å; M38-L254 WeakPolarHBondContact CE-O 3.39Å; M38-L254 HydrophobicContact SD-CD1 3.66Å; M38-L254 HydrophobicContact SD-CG 4.26Å; M38-V258 HydrophobicContact CE-CG1 4.16Å; M38-V258 HydrophobicContact CE-CG2 4.33Å
39K87Confident76.3Confident183 Ų18375 Ų7580%0.79641%0.413SS*.Hα-helixtrans-63.7-41.6177.8-67.4-174.9179.6-178.70112.4T37 A42 A43T37-K39 PolarHBondContact O-N 2.87Å; T37-K39 VanDerWaalsContact O-N 3.13Å; K39-A42 PolarHBondContact O-N 3.4Å; K39-A43 WeakPolarHBondContact O-CB 3.29Å; K39-A43 PolarHBondContact O-N 3.38Å
40Q85.9Confident78Confident83 Ų8376 Ų7639%0.38841%0.41SS..Hα-helixtrans-68.4-41.8176.6-70.1172.49.200110.8M36 T37 M38 A42 A43 W44M36-Q40 HydrophobicContact CG-CB 3.59Å; M36-Q40 HydrophobicContact SD-CB 4.29Å; T37-Q40 WeakPolarHBondContact O-CA 3.27Å; T37-Q40 WeakPolarHBondContact O-CB 3.3Å; T37-Q40 PolarHBondContact O-N 2.8Å; T37-Q40 VanDerWaalsContact OG1-CG 3.29Å; T37-Q40 WeakPolarHBondContact OG1-CG 3.46Å; M38-Q40 PolarHBondContact O-N 2.87Å; Q40-A42 VanDerWaalsContact C-N 3.3Å; Q40-A42 PolarHBondContact O-N 2.87Å; Q40-A43 PolarHBondContact O-N 3.07Å; Q40-W44 PolarHBondContact O-N 3.21Å
41A87Confident79.9Confident0 Ų068.1 Ų68.10%038%0.384CS..Hα-helixtrans-59.8-41.6176.200000111.6M36 T37 M38 S45 A250 F253 L254M36-A41 HydrophobicContact CG-CB 4.04Å; M36-A41 WeakPolarHBondContact SD-CA 3.36Å; M36-A41 HydrophobicContact SD-CB 3.95Å; T37-A41 PolarHBondContact O-N 2.95Å; M38-A41 PolarHBondContact O-N 2.95Å; A41-S45 VanDerWaalsContact O-CB 3.29Å; A41-S45 WeakPolarHBondContact O-CB 3.46Å; A41-S45 PolarHBondContact O-N 2.92Å; A41-S45 PolarHBondContact O-OG 3.48Å; A41-A250 WeakPolarHBondContact CB-O 3.28Å; A41-F253 HydrophobicContact CB-CB 3.97Å; A41-L254 HydrophobicContact CB-CB 3.98Å; A41-L254 HydrophobicContact CB-CD1 4.32Å
42A89.8Confident81.9Confident42 Ų4262.2 Ų62.235%0.34736%0.362SS..Hα-helixtrans-64.1-47.3174.700000111.9M38 K39 Q40 W44 S45 L46 L254M38-A42 WeakPolarHBondContact O-CB 3.21Å; M38-A42 PolarHBondContact O-N 2.98Å; K39-A42 PolarHBondContact O-N 3.4Å; Q40-A42 VanDerWaalsContact C-N 3.3Å; Q40-A42 PolarHBondContact O-N 2.87Å; A42-W44 PolarHBondContact O-N 3.3Å; A42-S45 PolarHBondContact O-N 3.45Å; A42-L46 WeakPolarHBondContact O-CB 3.37Å; A42-L46 PolarHBondContact O-N 2.94Å; A42-L254 HydrophobicContact CB-CD1 3.66Å
43A90.9Very high84.1Confident53 Ų5363.8 Ų63.844%0.43836%0.358SS..Hα-helixtrans-60.5-45.4178.100000111.8K39 Q40 L46 V47K39-A43 WeakPolarHBondContact O-CB 3.29Å; K39-A43 PolarHBondContact O-N 3.38Å; Q40-A43 PolarHBondContact O-N 3.07Å; A43-L46 PolarHBondContact O-N 3.26Å; A43-V47 VanDerWaalsContact O-CG2 3.3Å; A43-V47 WeakPolarHBondContact O-CG2 3.47Å; A43-V47 PolarHBondContact O-N 3.16Å
44W89.6Confident86.3Confident41 Ų4165.3 Ų65.316%0.15536%0.355CS..Hα-helixtrans-65.5-41.8176.8-82.5105.8000112.5I23 L27 M36 Q40 A42 L46 V47 W48 A250I23-W44 HydrophobicContact CG2-CZ3 4.36Å; L27-W44 HydrophobicContact CB-CH2 4.32Å; L27-W44 HydrophobicContact CB-CZ2 4.42Å; L27-W44 HydrophobicContact CD1-CH2 3.54Å; L27-W44 HydrophobicContact CD1-CZ2 4.25Å; L27-W44 HydrophobicContact CD1-CZ3 4.45Å; M36-W44 HydrophobicContact CE-CG 3.92Å; M36-W44 HydrophobicContact SD-CB 4.46Å; M36-W44 HydrophobicContact SD-CG 4.4Å; Q40-W44 PolarHBondContact O-N 3.21Å; A42-W44 PolarHBondContact O-N 3.3Å; W44-L46 VanDerWaalsContact C-N 3.29Å; W44-L46 PolarHBondContact O-N 3.48Å; W44-V47 HydrophobicContact CE3-CG1 4.42Å; W44-V47 HydrophobicContact CZ3-CG1 4.36Å; W44-V47 PolarHBondContact O-N 3.36Å; W44-W48 PolarHBondContact O-N 2.85Å; W44-A250 HydrophobicContact CB-CB 3.63Å
45S90.5Very high88.5Confident19 Ų1959 Ų5913%0.13333%0.326CS..Hα-helixtrans-59-43.4175-59.40000111A41 A42 W48 V49A41-S45 VanDerWaalsContact O-CB 3.29Å; A41-S45 WeakPolarHBondContact O-CB 3.46Å; A41-S45 PolarHBondContact O-N 2.92Å; A41-S45 PolarHBondContact O-OG 3.48Å; A42-S45 PolarHBondContact O-N 3.45Å; S45-W48 PolarHBondContact O-N 3.44Å; S45-V49 VanDerWaalsContact O-CG2 3.3Å; S45-V49 WeakPolarHBondContact O-CG2 3.45Å; S45-V49 PolarHBondContact O-N 3.01Å
46L92.8Very high90.1Very high113 Ų11357.7 Ų57.759%0.59231%0.312SS*.Hα-helixtrans-64-40.7176.2-176.964.2000112.4A42 A43 W44 V49 T50A42-L46 WeakPolarHBondContact O-CB 3.37Å; A42-L46 PolarHBondContact O-N 2.94Å; A43-L46 PolarHBondContact O-N 3.26Å; W44-L46 VanDerWaalsContact C-N 3.29Å; W44-L46 PolarHBondContact O-N 3.48Å; L46-V49 PolarHBondContact O-N 3.22Å; L46-T50 WeakPolarHBondContact O-CB 3.33Å; L46-T50 PolarHBondContact O-N 2.92Å; L46-T50 PolarHBondContact O-OG1 2.92Å
47V92.6Very high91.3Very high73 Ų7359.1 Ų59.144%0.44233%0.328SS..Hα-helixtrans-60.2-46.5175.7167.60000110.7A43 W44 T50 L51A43-V47 VanDerWaalsContact O-CG2 3.3Å; A43-V47 WeakPolarHBondContact O-CG2 3.47Å; A43-V47 PolarHBondContact O-N 3.16Å; W44-V47 HydrophobicContact CE3-CG1 4.42Å; W44-V47 HydrophobicContact CZ3-CG1 4.36Å; W44-V47 PolarHBondContact O-N 3.36Å; V47-T50 PolarHBondContact O-N 3.45Å; V47-L51 WeakPolarHBondContact O-CB 3.38Å; V47-L51 PolarHBondContact O-N 2.87Å
48W92.4Very high92Very high4 Ų458 Ų582%0.01533%0.327CS..Hα-helixtrans-64.5-41.9178.8-70.4118.9000112.9M20 I23 D24 W44 S45 L51 S52 L246M20-W48 HydrophobicContact CB-CH2 4.06Å; M20-W48 HydrophobicContact CB-CZ3 3.76Å; M20-W48 HydrophobicContact CE-CE3 3.47Å; M20-W48 VanDerWaalsContact CE-CE3 3.47Å; M20-W48 HydrophobicContact CE-CZ3 3.3Å; M20-W48 HydrophobicContact CG-CZ3 3.83Å; M20-W48 WeakPolarHBondContact O-CH2 3.47Å; M20-W48 HydrophobicContact SD-CZ3 4.37Å; I23-W48 HydrophobicContact CG2-CH2 4.35Å; D24-W48 HydrophobicContact CB-CH2 4.07Å; D24-W48 HydrophobicContact CB-CZ2 3.78Å; W44-W48 PolarHBondContact O-N 2.85Å; S45-W48 PolarHBondContact O-N 3.44Å; W48-L51 HydrophobicContact CE3-CD2 4.23Å; W48-L51 HydrophobicContact CZ3-CD2 4.08Å; W48-L51 PolarHBondContact O-N 3.3Å; W48-S52 PolarHBondContact O-N 2.6Å; W48-S52 PolarHBondContact O-OG 3.38Å; W48-L246 HydrophobicContact CE3-CB 4.26Å; W48-L246 HydrophobicContact CZ3-CB 4.45Å
49V94.4Very high92.7Very high50 Ų5054.2 Ų54.230%0.30331%0.308SS..Hα-helixtrans-62.3-48.6174.8172.70000110.4S45 L46 L51 S52 L53S45-V49 VanDerWaalsContact O-CG2 3.3Å; S45-V49 WeakPolarHBondContact O-CG2 3.45Å; S45-V49 PolarHBondContact O-N 3.01Å; L46-V49 PolarHBondContact O-N 3.22Å; V49-L51 VanDerWaalsContact C-N 3.31Å; V49-L51 PolarHBondContact O-N 2.85Å; V49-S52 WeakPolarHBondContact O-CB 3.32Å; V49-S52 PolarHBondContact O-N 3.49Å; V49-S52 VanDerWaalsContact O-N 3.16Å; V49-L53 HydrophobicContact CG1-CD1 4.25Å; V49-L53 WeakPolarHBondContact O-CG 3.17Å; V49-L53 PolarHBondContact O-N 2.84Å
50T95.1Very high93.1Very high64 Ų6449.5 Ų49.539%0.39329%0.285SS..Hα-helixtrans-58.9-43.8178.7-57.70000111.3L46 V47 S52 L53 L54L46-T50 WeakPolarHBondContact O-CB 3.33Å; L46-T50 PolarHBondContact O-N 2.92Å; L46-T50 PolarHBondContact O-OG1 2.92Å; V47-T50 PolarHBondContact O-N 3.45Å; T50-S52 VanDerWaalsContact C-N 3.31Å; T50-S52 PolarHBondContact O-N 3.09Å; T50-L53 PolarHBondContact O-N 3.06Å; T50-L54 HydrophobicContact CG2-CD1 4.15Å; T50-L54 HydrophobicContact CG2-CG 4.37Å; T50-L54 WeakPolarHBondContact O-CB 3.49Å; T50-L54 WeakPolarHBondContact O-CG 3.27Å; T50-L54 PolarHBondContact O-N 3.28Å
51L93.2Very high93.6Very high57 Ų5753.7 Ų53.730%0.29830%0.297SS..Hα-helixtrans-63.8-38178.6-174.456.9000112M20 V47 W48 V49 L54 F55 F243M20-L51 HydrophobicContact CE-CD2 3.74Å; M20-L51 HydrophobicContact CE-CG 4.26Å; M20-L51 HydrophobicContact CG-CD2 3.79Å; M20-L51 HydrophobicContact SD-CD2 3.87Å; M20-L51 HydrophobicContact SD-CG 4.41Å; V47-L51 WeakPolarHBondContact O-CB 3.38Å; V47-L51 PolarHBondContact O-N 2.87Å; W48-L51 HydrophobicContact CE3-CD2 4.23Å; W48-L51 HydrophobicContact CZ3-CD2 4.08Å; W48-L51 PolarHBondContact O-N 3.3Å; V49-L51 VanDerWaalsContact C-N 3.31Å; V49-L51 PolarHBondContact O-N 2.85Å; L51-L54 PolarHBondContact O-N 3.47Å; L51-F55 WeakPolarHBondContact O-CB 3.12Å; L51-F55 PolarHBondContact O-N 3.39Å; L51-F243 HydrophobicContact CG-CE1 4.48Å
52S95.1Very high93.9Very high1 Ų156.9 Ų56.91%0.00731%0.31CS..Hα-helixtrans-64.6-41174.8-51.90000111.8W48 V49 T50 F55 N56 Y83 F243W48-S52 PolarHBondContact O-N 2.6Å; W48-S52 PolarHBondContact O-OG 3.38Å; V49-S52 WeakPolarHBondContact O-CB 3.32Å; V49-S52 PolarHBondContact O-N 3.49Å; V49-S52 VanDerWaalsContact O-N 3.16Å; T50-S52 VanDerWaalsContact C-N 3.31Å; T50-S52 PolarHBondContact O-N 3.09Å; S52-F55 PolarHBondContact O-N 2.77Å; S52-N56 PolarHBondContact O-N 3.09Å; S52-Y83 WeakPolarHBondContact OG-CE2 3.4Å; S52-F243 WeakPolarHBondContact OG-CD1 3.47Å
53L96.6Very high94Very high82 Ų8255 Ų5543%0.42929%0.294SS..Hα-helixtrans-67.8-40.4175.9-65.7178000112.1V49 T50 F55 N56 A57 L80V49-L53 HydrophobicContact CG1-CD1 4.25Å; V49-L53 WeakPolarHBondContact O-CG 3.17Å; V49-L53 PolarHBondContact O-N 2.84Å; T50-L53 PolarHBondContact O-N 3.06Å; L53-F55 VanDerWaalsContact C-N 3.35Å; L53-N56 PolarHBondContact O-N 3.36Å; L53-A57 WeakPolarHBondContact O-CB 3.48Å; L53-A57 PolarHBondContact O-N 3.45Å; L53-L80 HydrophobicContact CD2-CD1 3.8Å
54L96Very high94.2Very high107 Ų10753.8 Ų53.856%0.5628%0.281SS*.Hα-helixtrans-63.8-41.1174.8-73.3176000111.5T50 L51 N56 A57 A58T50-L54 HydrophobicContact CG2-CD1 4.15Å; T50-L54 HydrophobicContact CG2-CG 4.37Å; T50-L54 WeakPolarHBondContact O-CB 3.49Å; T50-L54 WeakPolarHBondContact O-CG 3.27Å; T50-L54 PolarHBondContact O-N 3.28Å; L51-L54 PolarHBondContact O-N 3.47Å; L54-N56 VanDerWaalsContact C-N 3.35Å; L54-A57 PolarHBondContact O-N 2.91Å; L54-A58 WeakPolarHBondContact O-CB 3.31Å; L54-A58 PolarHBondContact O-N 3.23Å
55F95.2Very high94.4Very high32 Ų3258.4 Ų58.414%0.1430%0.304CS..Hα-helixtrans-59.4-47.1172.8176.4-92.7000111F13 L51 S52 L53 A57 A58 F59 F79 T239 F243F13-F55 HydrophobicContact CD2-CE2 4.05Å; F13-F55 AromaticContact CD2-CZ 3.98Å; F13-F55 HydrophobicContact CD2-CZ 3.98Å; L51-F55 WeakPolarHBondContact O-CB 3.12Å; L51-F55 PolarHBondContact O-N 3.39Å; S52-F55 PolarHBondContact O-N 2.77Å; L53-F55 VanDerWaalsContact C-N 3.35Å; F55-A57 VanDerWaalsContact C-N 3.32Å; F55-A57 PolarHBondContact O-N 3.5Å; F55-A58 PolarHBondContact O-N 3.18Å; F55-F59 HydrophobicContact CE1-CB 4.37Å; F55-F59 VanDerWaalsContact O-CB 3.25Å; F55-F59 WeakPolarHBondContact O-CB 3.38Å; F55-F59 PolarHBondContact O-N 3.26Å; F55-F79 HydrophobicContact CD1-CD2 4.44Å; F55-F79 HydrophobicContact CD1-CE1 4.35Å; F55-F79 AromaticContact CD1-CE2 3.66Å; F55-F79 HydrophobicContact CD1-CE2 3.66Å; F55-F79 AromaticContact CD1-CZ 3.61Å; F55-F79 HydrophobicContact CD1-CZ 3.61Å; F55-F79 HydrophobicContact CE1-CD2 4.17Å; F55-F79 AromaticContact CE1-CE2 3.59Å; F55-F79 HydrophobicContact CE1-CE2 3.59Å; F55-F79 HydrophobicContact CE1-CZ 4.06Å; F55-T239 HydrophobicContact CZ-CG2 4.27Å; F55-F243 HydrophobicContact CB-CE1 3.94Å; F55-F243 HydrophobicContact CB-CE2 3.91Å; F55-F243 HydrophobicContact CB-CZ 3.46Å; F55-F243 VanDerWaalsContact CB-CZ 3.46Å; F55-F243 AromaticContact CD1-CD2 3.99Å; F55-F243 HydrophobicContact CD1-CD2 3.99Å; F55-F243 AromaticContact CD1-CE2 3.38Å; F55-F243 HydrophobicContact CD1-CE2 3.38Å; F55-F243 AromaticContact CD1-CZ 3.88Å; F55-F243 HydrophobicContact CD1-CZ 3.88Å; F55-F243 AromaticContact CD2-CE2 3.62Å; F55-F243 HydrophobicContact CD2-CE2 3.62Å; F55-F243 AromaticContact CD2-CZ 3.52Å; F55-F243 HydrophobicContact CD2-CZ 3.52Å; F55-F243 HydrophobicContact CE1-CD2 4.32Å; F55-F243 AromaticContact CE1-CE2 3.71Å; F55-F243 HydrophobicContact CE1-CE2 3.71Å; F55-F243 AromaticContact CE2-CE2 3.93Å; F55-F243 HydrophobicContact CE2-CE2 3.93Å; F55-F243 HydrophobicContact CE2-CZ 4.21Å; F55-F243 HydrophobicContact CG-CD2 4.29Å; F55-F243 HydrophobicContact CG-CE1 4.25Å; F55-F243 AromaticContact CG-CE2 3.32Å; F55-F243 HydrophobicContact CG-CE2 3.32Å; F55-F243 AromaticContact CG-CZ 3.32Å; F55-F243 HydrophobicContact CG-CZ 3.32Å; F55-F243 AromaticContact CZ-CE2 3.97Å; F55-F243 HydrophobicContact CZ-CE2 3.97Å
56N96.3Very high94.4Very high18 Ų1860.6 Ų60.610%0.09632%0.317CS..Hα-helixtrans-60.5-42.2177.8-166.734.5000112.2S52 L53 L54 F59 W60 A76 F79S52-N56 PolarHBondContact O-N 3.09Å; L53-N56 PolarHBondContact O-N 3.36Å; L54-N56 VanDerWaalsContact C-N 3.35Å; N56-F59 PolarHBondContact O-N 3.08Å; N56-W60 WeakPolarHBondContact O-CB 3.4Å; N56-W60 PolarHBondContact O-N 3.4Å; N56-A76 PolarHBondContact ND2-O 3.19Å; N56-A76 VanDerWaalsContact ND2-O 3.13Å; N56-A76 WeakPolarHBondContact OD1-CA 3.48Å; N56-A76 PolarHBondContact OD1-O 2.93Å; N56-F79 HydrophobicContact CB-CD1 3.58Å; N56-F79 HydrophobicContact CB-CE1 3.72Å; N56-F79 VanDerWaalsContact CG-CD1 3.41Å; N56-F79 WeakPolarHBondContact OD1-CD1 3.5Å
57A97Very high94.2Very high56 Ų5660.7 Ų60.746%0.46332%0.315SS..Hα-helixtrans-64.5-40.917700000112.1L53 L54 F55 W61L53-A57 WeakPolarHBondContact O-CB 3.48Å; L53-A57 PolarHBondContact O-N 3.45Å; L54-A57 PolarHBondContact O-N 2.91Å; F55-A57 VanDerWaalsContact C-N 3.32Å; F55-A57 PolarHBondContact O-N 3.5Å; A57-W61 WeakPolarHBondContact O-CB 3.46Å; A57-W61 PolarHBondContact O-N 3.06Å
58A95Very high94.2Very high52 Ų5258.5 Ų58.543%0.4331%0.306SS..Hα-helixtrans-68.2-40.2175.900000112L54 F55 W61 Y62L54-A58 WeakPolarHBondContact O-CB 3.31Å; L54-A58 PolarHBondContact O-N 3.23Å; F55-A58 PolarHBondContact O-N 3.18Å; A58-W61 PolarHBondContact O-N 3.22Å; A58-Y62 WeakPolarHBondContact O-CB 3.2Å; A58-Y62 PolarHBondContact O-N 3.42Å
59F93.8Very high94.2Very high8 Ų866.1 Ų66.14%0.03534%0.335CS..Hα-helixtrans-62.9-46.3174.7172.6-119.1000111.5V4 L9 F55 N56 Y62 L63 Q75 F235 I236V4-F59 HydrophobicContact CG2-CE2 4.04Å; V4-F59 HydrophobicContact CG2-CZ 3.78Å; L9-F59 HydrophobicContact CD1-CE2 4.45Å; F55-F59 HydrophobicContact CE1-CB 4.37Å; F55-F59 VanDerWaalsContact O-CB 3.25Å; F55-F59 WeakPolarHBondContact O-CB 3.38Å; F55-F59 PolarHBondContact O-N 3.26Å; N56-F59 PolarHBondContact O-N 3.08Å; F59-Y62 PolarHBondContact O-N 3.42Å; F59-L63 HydrophobicContact CD1-CD1 4.38Å; F59-L63 HydrophobicContact CD2-CD1 4.28Å; F59-L63 HydrophobicContact CD2-CG 4.28Å; F59-L63 HydrophobicContact CE1-CD1 3.81Å; F59-L63 HydrophobicContact CE2-CD1 3.68Å; F59-L63 HydrophobicContact CE2-CD2 4.32Å; F59-L63 HydrophobicContact CE2-CG 3.94Å; F59-L63 HydrophobicContact CZ-CD1 3.45Å; F59-L63 VanDerWaalsContact CZ-CD1 3.45Å; F59-L63 HydrophobicContact CZ-CG 4.24Å; F59-L63 WeakPolarHBondContact O-CG 3.45Å; F59-L63 PolarHBondContact O-N 3.44Å; F59-Q75 HydrophobicContact CE1-CB 4.13Å; F59-Q75 HydrophobicContact CZ-CB 4.33Å; F59-F235 HydrophobicContact CD2-CE1 4.12Å; F59-F235 HydrophobicContact CE2-CD1 4.2Å; F59-F235 AromaticContact CE2-CE1 3.6Å; F59-F235 HydrophobicContact CE2-CE1 3.6Å; F59-F235 HydrophobicContact CZ-CD1 4.37Å; F59-F235 HydrophobicContact CZ-CE1 4.12Å; F59-I236 HydrophobicContact CE1-CD1 4.31Å; F59-I236 HydrophobicContact CE1-CG1 4.4Å; F59-I236 HydrophobicContact CZ-CD1 4.15Å; F59-I236 HydrophobicContact CZ-CG1 4.12Å
60W95.6Very high94.1Very high85 Ų8568.2 Ų68.232%0.32236%0.358SS..Hα-helixtrans-57.8-50172.5179.180.2000111.2N56 Y62 L63 V64 A72 D73 A76N56-W60 WeakPolarHBondContact O-CB 3.4Å; N56-W60 PolarHBondContact O-N 3.4Å; W60-Y62 VanDerWaalsContact C-N 3.32Å; W60-Y62 PolarHBondContact O-N 3.44Å; W60-L63 PolarHBondContact O-N 3.45Å; W60-V64 HydrophobicContact CD2-CG2 3.91Å; W60-V64 HydrophobicContact CE3-CG2 4.26Å; W60-V64 HydrophobicContact CG-CG2 4.48Å; W60-V64 HydrophobicContact CH2-CG2 4.1Å; W60-V64 HydrophobicContact CZ2-CG2 3.72Å; W60-V64 HydrophobicContact CZ3-CG2 4.34Å; W60-V64 WeakPolarHBondContact O-CG2 3.39Å; W60-V64 PolarHBondContact O-N 2.64Å; W60-A72 HydrophobicContact CG-CB 4.48Å; W60-D73 PolarHBondContact NE1-OD1 3.23Å; W60-A76 HydrophobicContact CB-CB 3.8Å; W60-A76 HydrophobicContact CG-CB 4.08Å
61W96Very high93.9Very high170 Ų17067.4 Ų67.464%0.64435%0.353SS*.Hα-helixtrans-59.8-42.3179.2179.564.3000112.2A57 A58 V64 Q65A57-W61 WeakPolarHBondContact O-CB 3.46Å; A57-W61 PolarHBondContact O-N 3.06Å; A58-W61 PolarHBondContact O-N 3.22Å; W61-V64 PolarHBondContact O-N 2.89Å; W61-Q65 WeakPolarHBondContact O-CG 3.25Å; W61-Q65 PolarHBondContact O-N 2.97Å
62Y93.9Very high93.9Very high68 Ų6864.7 Ų64.727%0.26734%0.339SS..Hα-helixtrans-58.9-50.2174.3176.4-93.5000111.6L9 A58 F59 W60 V64 Q65 T66L9-Y62 HydrophobicContact CD1-CD1 4.03Å; L9-Y62 HydrophobicContact CD1-CE1 3.53Å; L9-Y62 HydrophobicContact CD2-CD1 3.73Å; L9-Y62 HydrophobicContact CD2-CE1 3.63Å; L9-Y62 HydrophobicContact CD2-CG 4.27Å; L9-Y62 HydrophobicContact CG-CD1 4.21Å; L9-Y62 HydrophobicContact CG-CE1 3.63Å; A58-Y62 WeakPolarHBondContact O-CB 3.2Å; A58-Y62 PolarHBondContact O-N 3.42Å; F59-Y62 PolarHBondContact O-N 3.42Å; W60-Y62 VanDerWaalsContact C-N 3.32Å; W60-Y62 PolarHBondContact O-N 3.44Å; Y62-V64 VanDerWaalsContact C-N 3.32Å; Y62-V64 PolarHBondContact O-N 2.88Å; Y62-Q65 PolarHBondContact O-N 3.08Å; Y62-Q65 VanDerWaalsContact O-N 3.08Å; Y62-T66 HydrophobicContact CD1-CG2 4.46Å; Y62-T66 HydrophobicContact CD2-CG2 4.41Å; Y62-T66 HydrophobicContact CE1-CG2 4.03Å; Y62-T66 HydrophobicContact CE2-CG2 3.99Å; Y62-T66 PolarHBondContact O-N 3.19Å; Y62-T66 PolarHBondContact O-OG1 3.16Å
63L92.9Very high93.9Very high2 Ų268 Ų681%0.0136%0.356CS..Hα-helixtrans-64.6-34.1179.5-71.1-177.6000112.9V4 F59 W60 Q65 T66 E67 G68 A72 Q75V4-L63 HydrophobicContact CB-CD2 4.12Å; V4-L63 HydrophobicContact CG1-CD2 4.34Å; F59-L63 HydrophobicContact CD1-CD1 4.38Å; F59-L63 HydrophobicContact CD2-CD1 4.28Å; F59-L63 HydrophobicContact CD2-CG 4.28Å; F59-L63 HydrophobicContact CE1-CD1 3.81Å; F59-L63 HydrophobicContact CE2-CD1 3.68Å; F59-L63 HydrophobicContact CE2-CD2 4.32Å; F59-L63 HydrophobicContact CE2-CG 3.94Å; F59-L63 HydrophobicContact CZ-CD1 3.45Å; F59-L63 VanDerWaalsContact CZ-CD1 3.45Å; F59-L63 HydrophobicContact CZ-CG 4.24Å; F59-L63 WeakPolarHBondContact O-CG 3.45Å; F59-L63 PolarHBondContact O-N 3.44Å; W60-L63 PolarHBondContact O-N 3.45Å; L63-Q65 PolarHBondContact O-N 2.96Å; L63-T66 PolarHBondContact O-N 3.19Å; L63-E67 HydrophobicContact CD2-CG 4.05Å; L63-E67 CarbonylContact O-C 3.38Å; L63-E67 WeakPolarHBondContact O-CA 3.49Å; L63-E67 PolarHBondContact O-N 3.03Å; L63-G68 PolarHBondContact O-N 3.39Å; L63-A72 HydrophobicContact CB-CB 3.55Å; L63-Q75 HydrophobicContact CD1-CB 3.74Å; L63-Q75 HydrophobicContact CD1-CG 4.21Å
64V95.2Very high93.7Very high27 Ų2766.3 Ų66.316%0.16435%0.35CS..Hα-helixtrans-59.7-37.8173.8169.20000110.9W60 W61 Y62 G68 R69 A72W60-V64 HydrophobicContact CD2-CG2 3.91Å; W60-V64 HydrophobicContact CE3-CG2 4.26Å; W60-V64 HydrophobicContact CG-CG2 4.48Å; W60-V64 HydrophobicContact CH2-CG2 4.1Å; W60-V64 HydrophobicContact CZ2-CG2 3.72Å; W60-V64 HydrophobicContact CZ3-CG2 4.34Å; W60-V64 WeakPolarHBondContact O-CG2 3.39Å; W60-V64 PolarHBondContact O-N 2.64Å; W61-V64 PolarHBondContact O-N 2.89Å; Y62-V64 VanDerWaalsContact C-N 3.32Å; Y62-V64 PolarHBondContact O-N 2.88Å; V64-G68 WeakPolarHBondContact O-CA 3.45Å; V64-G68 PolarHBondContact O-N 2.86Å; V64-R69 HydrophobicContact CG1-CG 4.12Å; V64-R69 HydrophobicContact CG2-CG 3.92Å; V64-A72 HydrophobicContact CB-CB 4.41Å; V64-A72 HydrophobicContact CG2-CB 3.52Å
65Q93.1Very high93.7Very high138 Ų13863.2 Ų63.265%0.64533%0.333SS*.Hα-helixtrans-78.8-32.2-178.7-63-64.4101.200113.1W61 Y62 L63W61-Q65 WeakPolarHBondContact O-CG 3.25Å; W61-Q65 PolarHBondContact O-N 2.97Å; Y62-Q65 PolarHBondContact O-N 3.08Å; Y62-Q65 VanDerWaalsContact O-N 3.08Å; L63-Q65 PolarHBondContact O-N 2.96Å
66T90.7Very high93.7Very high66 Ų6662 Ų6241%0.40533%0.329SS..Hα-helixtrans-97.7-42.2-174.859.30000114Y62 L63Y62-T66 HydrophobicContact CD1-CG2 4.46Å; Y62-T66 HydrophobicContact CD2-CG2 4.41Å; Y62-T66 HydrophobicContact CE1-CG2 4.03Å; Y62-T66 HydrophobicContact CE2-CG2 3.99Å; Y62-T66 PolarHBondContact O-N 3.19Å; Y62-T66 PolarHBondContact O-OG1 3.16Å; L63-T66 PolarHBondContact O-N 3.19Å
67E88.8Confident93.7Very high115 Ų11563.9 Ų63.954%0.53734%0.339SS..THydrogen-bonded Turntrans-115.2-17.2-173-55.7-58.814000112.9L63 V71L63-E67 HydrophobicContact CD2-CG 4.05Å; L63-E67 CarbonylContact O-C 3.38Å; L63-E67 WeakPolarHBondContact O-CA 3.49Å; L63-E67 PolarHBondContact O-N 3.03Å; E67-V71 HydrophobicContact CB-CB 3.87Å; E67-V71 HydrophobicContact CB-CG1 4.07Å; E67-V71 HydrophobicContact CB-CG2 4.17Å; E67-V71 HydrophobicContact CG-CG1 4.48Å
68G92.4Very high93.7Very high26 Ų2661.2 Ų61.227%0.26832%0.317SS..  trans89167.4-177.100000114.4L63 V64 A70 V71 A72L63-G68 PolarHBondContact O-N 3.39Å; V64-G68 WeakPolarHBondContact O-CA 3.45Å; V64-G68 PolarHBondContact O-N 2.86Å; G68-A70 VanDerWaalsContact C-N 3.32Å; G68-A70 PolarHBondContact O-N 3.22Å; G68-V71 PolarHBondContact O-N 3.31Å; G68-A72 PolarHBondContact O-N 3.17Å
69R92.1Very high93.8Very high164 Ų16458.8 Ų58.862%0.61930%0.296SS*.Hα-helixtrans-61.7-34.3-173.6-74.7-171.9-179.6179.21.2114.4V64 V71 A72 D73V64-R69 HydrophobicContact CG1-CG 4.12Å; V64-R69 HydrophobicContact CG2-CG 3.92Å; R69-V71 PolarHBondContact O-N 2.89Å; R69-A72 PolarHBondContact O-N 3.46Å; R69-D73 WeakPolarHBondContact O-CB 3.23Å; R69-D73 VanDerWaalsContact O-CG 3.23Å; R69-D73 PolarHBondContact O-N 3.44Å
70A92.2Very high94Very high94 Ų9460.3 Ų60.378%0.77730%0.304SS*.Hα-helixtrans-59.9-29-179.800000112.8G68 P74G68-A70 VanDerWaalsContact C-N 3.32Å; G68-A70 PolarHBondContact O-N 3.22Å; A70-P74 VanDerWaalsContact O-CD 3.28Å; A70-P74 WeakPolarHBondContact O-CD 3.5Å; A70-P74 VanDerWaalsContact O-CG 3.3Å; A70-P74 WeakPolarHBondContact O-CG 3.01Å
71V90.6Very high94Very high48 Ų4856.2 Ų56.229%0.29129%0.289SS..Hα-helixtrans-93.5-43.6173.8-178.20000110.6V4 E67 G68 R69 D73 P74 Q75V4-V71 HydrophobicContact CG1-CG1 4.16Å; E67-V71 HydrophobicContact CB-CB 3.87Å; E67-V71 HydrophobicContact CB-CG1 4.07Å; E67-V71 HydrophobicContact CB-CG2 4.17Å; E67-V71 HydrophobicContact CG-CG1 4.48Å; G68-V71 PolarHBondContact O-N 3.31Å; R69-V71 PolarHBondContact O-N 2.89Å; V71-D73 PolarHBondContact O-N 3.41Å; V71-P74 VanDerWaalsContact O-CD 3.28Å; V71-P74 WeakPolarHBondContact O-CD 3.26Å; V71-P74 WeakPolarHBondContact O-CG 3.3Å; V71-Q75 HydrophobicContact CG1-CG 4.03Å; V71-Q75 WeakPolarHBondContact O-CB 3.28Å; V71-Q75 WeakPolarHBondContact O-CG 3.06Å; V71-Q75 PolarHBondContact O-N 2.95Å
72A93.3Very high94.1Very high0 Ų048.1 Ų48.10%026%0.258CS..Hα-helixtrans-59.7-45.5-175.500000113.6W60 L63 V64 G68 R69 Q75 A76W60-A72 HydrophobicContact CG-CB 4.48Å; L63-A72 HydrophobicContact CB-CB 3.55Å; V64-A72 HydrophobicContact CB-CB 4.41Å; V64-A72 HydrophobicContact CG2-CB 3.52Å; G68-A72 PolarHBondContact O-N 3.17Å; R69-A72 PolarHBondContact O-N 3.46Å; A72-Q75 PolarHBondContact O-N 2.89Å; A72-A76 WeakPolarHBondContact O-CB 3.44Å; A72-A76 PolarHBondContact O-N 2.74Å
73D94.7Very high94.2Very high69 Ų6945.3 Ų45.337%0.36925%0.247SC..Hα-helixtrans-59.9-55.7-175.5-64.8-13.7000112.4W60 R69 V71 Q75 A76 L77W60-D73 PolarHBondContact NE1-OD1 3.23Å; R69-D73 WeakPolarHBondContact O-CB 3.23Å; R69-D73 VanDerWaalsContact O-CG 3.23Å; R69-D73 PolarHBondContact O-N 3.44Å; V71-D73 PolarHBondContact O-N 3.41Å; D73-Q75 VanDerWaalsContact C-N 3.33Å; D73-Q75 PolarHBondContact O-N 3.47Å; D73-A76 PolarHBondContact O-N 3.06Å; D73-L77 VanDerWaalsContact O-CG 3.3Å; D73-L77 WeakPolarHBondContact O-CG 3.26Å; D73-L77 PolarHBondContact O-N 3.2Å; D73-L77 VanDerWaalsContact O-N 3.09Å
74P93.8Very high94.3Very high48 Ų4846.7 Ų46.731%0.31226%0.255SS..Hα-helixtrans-65.4-33.9179.124.8-34.3000113.1A70 V71 L77 A78 I290A70-P74 VanDerWaalsContact O-CD 3.28Å; A70-P74 WeakPolarHBondContact O-CD 3.5Å; A70-P74 VanDerWaalsContact O-CG 3.3Å; A70-P74 WeakPolarHBondContact O-CG 3.01Å; V71-P74 VanDerWaalsContact O-CD 3.28Å; V71-P74 WeakPolarHBondContact O-CD 3.26Å; V71-P74 WeakPolarHBondContact O-CG 3.3Å; P74-L77 PolarHBondContact O-N 3.27Å; P74-A78 WeakPolarHBondContact O-CB 3.35Å; P74-A78 PolarHBondContact O-N 2.97Å; P74-I290 HydrophobicContact CB-CD1 4.32Å
75Q94.3Very high94.3Very high41 Ų4145.5 Ų45.519%0.19225%0.247CC..Hα-helixtrans-71.4-38.8-179.2-61.5-61.5-1.200112.1V4 F59 L63 V71 A72 D73 L77 A78 F79 I236V4-Q75 HydrophobicContact CG1-CG 4.24Å; F59-Q75 HydrophobicContact CE1-CB 4.13Å; F59-Q75 HydrophobicContact CZ-CB 4.33Å; L63-Q75 HydrophobicContact CD1-CB 3.74Å; L63-Q75 HydrophobicContact CD1-CG 4.21Å; V71-Q75 HydrophobicContact CG1-CG 4.03Å; V71-Q75 WeakPolarHBondContact O-CB 3.28Å; V71-Q75 WeakPolarHBondContact O-CG 3.06Å; V71-Q75 PolarHBondContact O-N 2.95Å; A72-Q75 PolarHBondContact O-N 2.89Å; D73-Q75 VanDerWaalsContact C-N 3.33Å; D73-Q75 PolarHBondContact O-N 3.47Å; Q75-L77 VanDerWaalsContact C-N 3.35Å; Q75-A78 WeakPolarHBondContact O-CB 3.26Å; Q75-A78 PolarHBondContact O-N 3.39Å; Q75-F79 PolarHBondContact O-N 2.67Å; Q75-I236 HydrophobicContact CB-CD1 3.83Å; Q75-I236 HydrophobicContact CG-CD1 4.23Å
76A96.4Very high94.4Very high8 Ų839.2 Ų39.27%0.06622%0.218CC..Hα-helixtrans-68.3-35.2174.100000112.3N56 W60 A72 D73 L80N56-A76 PolarHBondContact ND2-O 3.19Å; N56-A76 VanDerWaalsContact ND2-O 3.13Å; N56-A76 WeakPolarHBondContact OD1-CA 3.48Å; N56-A76 PolarHBondContact OD1-O 2.93Å; W60-A76 HydrophobicContact CB-CB 3.8Å; W60-A76 HydrophobicContact CG-CB 4.08Å; A72-A76 WeakPolarHBondContact O-CB 3.44Å; A72-A76 PolarHBondContact O-N 2.74Å; D73-A76 PolarHBondContact O-N 3.06Å; A76-L80 WeakPolarHBondContact O-CB 3.36Å; A76-L80 PolarHBondContact O-N 3.07Å
77L96.8Very high94.5Very high57 Ų5737.6 Ų37.630%0.29821%0.205SC..Hα-helixtrans-68.3-37.9171.7-70.1174.8000111.7D73 P74 Q75 L80 T81 I290 A291 L294D73-L77 VanDerWaalsContact O-CG 3.3Å; D73-L77 WeakPolarHBondContact O-CG 3.26Å; D73-L77 PolarHBondContact O-N 3.2Å; D73-L77 VanDerWaalsContact O-N 3.09Å; P74-L77 PolarHBondContact O-N 3.27Å; Q75-L77 VanDerWaalsContact C-N 3.35Å; L77-L80 PolarHBondContact O-N 2.94Å; L77-T81 VanDerWaalsContact O-CB 3.31Å; L77-T81 WeakPolarHBondContact O-CB 3.34Å; L77-T81 PolarHBondContact O-N 3.43Å; L77-T81 PolarHBondContact O-OG1 3.36Å; L77-I290 HydrophobicContact CB-CG2 3.87Å; L77-A291 HydrophobicContact CD1-CB 4.09Å; L77-L294 HydrophobicContact CD2-CD2 3.63Å
78A96.3Very high94.6Very high0 Ų032.4 Ų32.40%018%0.182CC..Hα-helixtrans-62.7-46.4175.400000111P74 Q75 L80 T81 G82 V230 T231 I236 I290P74-A78 WeakPolarHBondContact O-CB 3.35Å; P74-A78 PolarHBondContact O-N 2.97Å; Q75-A78 WeakPolarHBondContact O-CB 3.26Å; Q75-A78 PolarHBondContact O-N 3.39Å; A78-L80 PolarHBondContact O-N 3.24Å; A78-T81 PolarHBondContact O-N 3.43Å; A78-G82 PolarHBondContact O-N 2.8Å; A78-V230 HydrophobicContact CB-CG1 4.23Å; A78-T231 HydrophobicContact CB-CG2 4.25Å; A78-I236 HydrophobicContact CB-CG2 4.23Å; A78-I290 HydrophobicContact CB-CD1 4.28Å; A78-I290 HydrophobicContact CB-CG2 4.44Å
79F97.2Very high94.5Very high1 Ų131.9 Ų31.90%0.00417%0.173CC..Hα-helixtrans-56-49.8173.7176.9-84.8000111.2F55 N56 Q75 G82 Y83 I236 S240 F243F55-F79 HydrophobicContact CD1-CD2 4.44Å; F55-F79 HydrophobicContact CD1-CE1 4.35Å; F55-F79 AromaticContact CD1-CE2 3.66Å; F55-F79 HydrophobicContact CD1-CE2 3.66Å; F55-F79 AromaticContact CD1-CZ 3.61Å; F55-F79 HydrophobicContact CD1-CZ 3.61Å; F55-F79 HydrophobicContact CE1-CD2 4.17Å; F55-F79 AromaticContact CE1-CE2 3.59Å; F55-F79 HydrophobicContact CE1-CE2 3.59Å; F55-F79 HydrophobicContact CE1-CZ 4.06Å; N56-F79 HydrophobicContact CB-CD1 3.58Å; N56-F79 HydrophobicContact CB-CE1 3.72Å; N56-F79 VanDerWaalsContact CG-CD1 3.41Å; N56-F79 WeakPolarHBondContact OD1-CD1 3.5Å; Q75-F79 PolarHBondContact O-N 2.67Å; F79-G82 PolarHBondContact O-N 2.83Å; F79-Y83 VanDerWaalsContact O-CB 3.25Å; F79-Y83 WeakPolarHBondContact O-CB 3.39Å; F79-Y83 PolarHBondContact O-N 3.37Å; F79-I236 HydrophobicContact CB-CG2 3.93Å; F79-S240 WeakPolarHBondContact O-CB 3.12Å; F79-F243 HydrophobicContact CE2-CD2 4Å; F79-F243 HydrophobicContact CZ-CB 4.26Å; F79-F243 AromaticContact CZ-CD2 3.78Å; F79-F243 HydrophobicContact CZ-CD2 3.78Å; F79-F243 HydrophobicContact CZ-CE2 4.45Å; F79-F243 HydrophobicContact CZ-CG 4.16Å
80L97.6Very high94.4Very high39 Ų3924.4 Ų24.420%0.20415%0.146CC..Hα-helixtrans-67.6-41.8-176.3-17460.3000112.5L53 A76 L77 A78 G82 Y83 L84 L294L53-L80 HydrophobicContact CD2-CD1 3.8Å; A76-L80 WeakPolarHBondContact O-CB 3.36Å; A76-L80 PolarHBondContact O-N 3.07Å; L77-L80 PolarHBondContact O-N 2.94Å; A78-L80 PolarHBondContact O-N 3.24Å; L80-G82 VanDerWaalsContact C-N 3.34Å; L80-Y83 PolarHBondContact O-N 2.87Å; L80-L84 WeakPolarHBondContact O-CG 3.41Å; L80-L84 PolarHBondContact O-N 3.07Å; L80-L294 HydrophobicContact CD2-CD1 4.26Å; L80-L294 HydrophobicContact CD2-CD2 3.95Å; L80-L294 HydrophobicContact CG-CD1 4.02Å; L80-L294 HydrophobicContact CG-CD2 4.48Å
81T96.8Very high94.3Very high0 Ų020.8 Ų20.80%011%0.114CC..Hα-helixtrans-62.1-46.8176.1-52.70000109.9L77 A78 L84 I85 V230 L294L77-T81 VanDerWaalsContact O-CB 3.31Å; L77-T81 WeakPolarHBondContact O-CB 3.34Å; L77-T81 PolarHBondContact O-N 3.43Å; L77-T81 PolarHBondContact O-OG1 3.36Å; A78-T81 PolarHBondContact O-N 3.43Å; T81-L84 PolarHBondContact O-N 3.26Å; T81-I85 HydrophobicContact CG2-CD1 3.93Å; T81-I85 WeakPolarHBondContact O-CD1 3.31Å; T81-I85 VanDerWaalsContact O-CG1 3.31Å; T81-I85 WeakPolarHBondContact O-CG1 3.21Å; T81-I85 PolarHBondContact O-N 3.1Å; T81-V230 HydrophobicContact CG2-CG1 3.93Å; T81-V230 HydrophobicContact CG2-CG2 3.81Å; T81-L294 WeakPolarHBondContact OG1-CB 3.43Å
82G96.3Very high94.1Very high0 Ų020.4 Ų20.40%011%0.11CC..Hα-helixtrans-60.3-46.8176.600000113A78 F79 L80 L84 I85 E86A78-G82 PolarHBondContact O-N 2.8Å; F79-G82 PolarHBondContact O-N 2.83Å; L80-G82 VanDerWaalsContact C-N 3.34Å; G82-L84 VanDerWaalsContact C-N 3.32Å; G82-L84 PolarHBondContact O-N 3.27Å; G82-I85 PolarHBondContact O-N 3.49Å; G82-E86 WeakPolarHBondContact O-CB 3.36Å; G82-E86 VanDerWaalsContact O-CG 3.29Å; G82-E86 WeakPolarHBondContact O-CG 3.24Å; G82-E86 PolarHBondContact O-N 3.15Å
83Y96.8Very high93.9Very high8 Ų820.7 Ų20.73%0.03111%0.112CC..Hα-helixtrans-58.4-44.1176.6170.6-94.5000111.2S52 F79 L80 K87 F243 A244S52-Y83 WeakPolarHBondContact OG-CE2 3.4Å; F79-Y83 VanDerWaalsContact O-CB 3.25Å; F79-Y83 WeakPolarHBondContact O-CB 3.39Å; F79-Y83 PolarHBondContact O-N 3.37Å; L80-Y83 PolarHBondContact O-N 2.87Å; Y83-K87 HydrophobicContact CE2-CD 4.45Å; Y83-K87 WeakPolarHBondContact O-CB 3.46Å; Y83-K87 PolarHBondContact O-N 3.2Å; Y83-F243 HydrophobicContact CD2-CB 3.98Å; Y83-F243 HydrophobicContact CE2-CB 4.13Å; Y83-A244 HydrophobicContact CD2-CB 4.06Å; Y83-A244 HydrophobicContact CE2-CB 4.24Å
84L95.6Very high93.8Very high32 Ų3217.4 Ų17.417%0.16810%0.095CC..Hα-helixtrans-67.3-41.4178.9-73.8177.4000112.8L80 T81 G82 K87 S88 L294 V297 F298 L301L80-L84 WeakPolarHBondContact O-CG 3.41Å; L80-L84 PolarHBondContact O-N 3.07Å; T81-L84 PolarHBondContact O-N 3.26Å; G82-L84 VanDerWaalsContact C-N 3.32Å; G82-L84 PolarHBondContact O-N 3.27Å; L84-K87 PolarHBondContact O-N 3.48Å; L84-S88 VanDerWaalsContact O-CB 3.32Å; L84-S88 WeakPolarHBondContact O-CB 3.47Å; L84-S88 PolarHBondContact O-N 2.99Å; L84-S88 PolarHBondContact O-OG 3.11Å; L84-L294 HydrophobicContact CD1-CD1 3.58Å; L84-V297 HydrophobicContact CB-CG1 4.28Å; L84-F298 HydrophobicContact CD1-CB 4.35Å; L84-F298 HydrophobicContact CD1-CD2 4.22Å; L84-L301 HydrophobicContact CB-CD1 4.46Å
85I94.5Very high93.5Very high1 Ų116.7 Ų16.71%0.0059%0.087CC..Hα-helixtrans-60.9-53.1175.8-69.4162.5000109.4T81 G82 K87 S88 L89 A226 V230 I276 V297T81-I85 HydrophobicContact CG2-CD1 3.93Å; T81-I85 WeakPolarHBondContact O-CD1 3.31Å; T81-I85 VanDerWaalsContact O-CG1 3.31Å; T81-I85 WeakPolarHBondContact O-CG1 3.21Å; T81-I85 PolarHBondContact O-N 3.1Å; G82-I85 PolarHBondContact O-N 3.49Å; I85-K87 VanDerWaalsContact C-N 3.33Å; I85-K87 PolarHBondContact O-N 3.08Å; I85-S88 PolarHBondContact O-N 3Å; I85-S88 VanDerWaalsContact O-N 3.13Å; I85-S88 PolarHBondContact O-OG 3.18Å; I85-L89 HydrophobicContact CG2-CD1 3.86Å; I85-L89 WeakPolarHBondContact O-CG 3.39Å; I85-L89 PolarHBondContact O-N 2.81Å; I85-A226 HydrophobicContact CG2-CB 4.04Å; I85-V230 HydrophobicContact CD1-CG2 3.43Å; I85-V230 VanDerWaalsContact CD1-CG2 3.43Å; I85-I276 HydrophobicContact CD1-CD1 3.53Å; I85-I276 HydrophobicContact CD1-CG1 4.41Å; I85-I276 HydrophobicContact CG1-CD1 3.79Å; I85-I276 HydrophobicContact CG2-CD1 3.98Å; I85-V297 HydrophobicContact CD1-CG2 4.34Å; I85-V297 HydrophobicContact CG1-CG1 4.01Å; I85-V297 HydrophobicContact CG1-CG2 4.05Å
86E94.3Very high93.2Very high7 Ų715.9 Ų15.93%0.0339%0.085CC..Hα-helixtrans-63.4-40.4-179.3-68-67.9-17400111.5G82 S88 L89 A90 R126 I227 N241 A244G82-E86 WeakPolarHBondContact O-CB 3.36Å; G82-E86 VanDerWaalsContact O-CG 3.29Å; G82-E86 WeakPolarHBondContact O-CG 3.24Å; G82-E86 PolarHBondContact O-N 3.15Å; E86-S88 VanDerWaalsContact C-N 3.28Å; E86-S88 PolarHBondContact O-N 2.82Å; E86-L89 PolarHBondContact O-N 3.31Å; E86-A90 WeakPolarHBondContact O-CB 3.4Å; E86-A90 PolarHBondContact O-N 2.85Å; E86-R126 VanDerWaalsContact CD-NH2 3.34Å; E86-R126 IonicContact OE1-CZ 3.67Å; E86-R126 IonicContact OE1-NH2 3.85Å; E86-R126 PolarHBondContact OE1-NH2 3.03Å; E86-R126 IonicContact OE2-CZ 3.09Å; E86-R126 IonicContact OE2-NH2 2.81Å; E86-R126 PolarHBondContact OE2-NH2 3.01Å; E86-R126 VanDerWaalsContact OE2-NH2 3.09Å; E86-I227 HydrophobicContact CG-CD1 4.49Å; E86-N241 HydrophobicContact CG-CB 4.3Å; E86-N241 WeakPolarHBondContact CG-ND2 3.47Å; E86-N241 PolarHBondContact OE1-ND2 3.36Å; E86-N241 PolarHBondContact OE2-ND2 3.46Å; E86-A244 HydrophobicContact CB-CB 3.63Å
87K93.7Very high93Very high31 Ų3115.6 Ų15.614%0.1358%0.082CC..Hα-helixtrans-62.9-38.1176-161.972.2-179.9-177.40111.7Y83 L84 I85 V91 A244 L246Y83-K87 HydrophobicContact CE2-CD 4.45Å; Y83-K87 WeakPolarHBondContact O-CB 3.46Å; Y83-K87 PolarHBondContact O-N 3.2Å; L84-K87 PolarHBondContact O-N 3.48Å; I85-K87 VanDerWaalsContact C-N 3.33Å; I85-K87 PolarHBondContact O-N 3.08Å; K87-V91 WeakPolarHBondContact O-CG2 3.26Å; K87-V91 PolarHBondContact O-N 2.87Å; K87-A244 HydrophobicContact CB-CB 4.28Å; K87-A244 HydrophobicContact CD-CB 4.18Å; K87-A244 WeakPolarHBondContact CD-O 3.37Å; K87-A244 PolarHBondContact NZ-O 3.42Å; K87-L246 PolarHBondContact NZ-O 2.66Å
88S91.2Very high92.6Very high7 Ų714 Ų145%0.0497%0.073CC..Hα-helixtrans-68.2-46.3178.371.70000112.1L84 I85 E86 A90 V91 L269L84-S88 VanDerWaalsContact O-CB 3.32Å; L84-S88 WeakPolarHBondContact O-CB 3.47Å; L84-S88 PolarHBondContact O-N 2.99Å; L84-S88 PolarHBondContact O-OG 3.11Å; I85-S88 PolarHBondContact O-N 3Å; I85-S88 VanDerWaalsContact O-N 3.13Å; I85-S88 PolarHBondContact O-OG 3.18Å; E86-S88 VanDerWaalsContact C-N 3.28Å; E86-S88 PolarHBondContact O-N 2.82Å; S88-A90 VanDerWaalsContact C-N 3.33Å; S88-A90 PolarHBondContact O-N 2.76Å; S88-V91 VanDerWaalsContact O-CB 3.3Å; S88-V91 WeakPolarHBondContact O-CB 3.5Å; S88-V91 PolarHBondContact O-N 2.94Å; S88-L269 WeakPolarHBondContact O-CD2 3.48Å
89L90.2Very high92.1Very high15 Ų1518.5 Ų18.58%0.07910%0.095CC..Hα-helixtrans-68.9-33.7179-65.1172.2000111.6I85 E86 V91 D92 N93 S223 A226 L269 L273I85-L89 HydrophobicContact CG2-CD1 3.86Å; I85-L89 WeakPolarHBondContact O-CG 3.39Å; I85-L89 PolarHBondContact O-N 2.81Å; E86-L89 PolarHBondContact O-N 3.31Å; L89-V91 PolarHBondContact O-N 2.93Å; L89-D92 VanDerWaalsContact O-CB 3.28Å; L89-D92 WeakPolarHBondContact O-CB 3.35Å; L89-D92 PolarHBondContact O-N 3.11Å; L89-N93 PolarHBondContact O-N 2.75Å; L89-N93 PolarHBondContact O-OD1 2.85Å; L89-S223 VanDerWaalsContact CD1-CB 3.47Å; L89-A226 HydrophobicContact CD1-CB 4.45Å; L89-L269 HydrophobicContact CD2-CD2 4.35Å; L89-L273 HydrophobicContact CD1-CD2 4.45Å; L89-L273 HydrophobicContact CD2-CD2 4.16Å; L89-L273 HydrophobicContact CD2-CG 4.35Å
90A90.8Very high91.8Very high7 Ų718.6 Ų18.66%0.05810%0.096CC..Hα-helixtrans-65.3-18175.200000113.3E86 S88 D92 N93 V94 L248E86-A90 WeakPolarHBondContact O-CB 3.4Å; E86-A90 PolarHBondContact O-N 2.85Å; S88-A90 VanDerWaalsContact C-N 3.33Å; S88-A90 PolarHBondContact O-N 2.76Å; A90-D92 VanDerWaalsContact C-N 3.31Å; A90-N93 PolarHBondContact O-N 3.35Å; A90-V94 PolarHBondContact O-N 2.98Å; A90-L248 HydrophobicContact CB-CD1 4.38Å; A90-L248 HydrophobicContact CB-CD2 3.73Å; A90-L248 HydrophobicContact CB-CG 4.48Å
91V88.9Confident91.4Very high18 Ų1816.8 Ų16.811%0.1099%0.087CC..Hα-helixtrans-65.6-36.6169.3-179.30000111.1K87 S88 L89 V94 F95 M251 L255 L265K87-V91 WeakPolarHBondContact O-CG2 3.26Å; K87-V91 PolarHBondContact O-N 2.87Å; S88-V91 VanDerWaalsContact O-CB 3.3Å; S88-V91 WeakPolarHBondContact O-CB 3.5Å; S88-V91 PolarHBondContact O-N 2.94Å; L89-V91 PolarHBondContact O-N 2.93Å; V91-V94 WeakPolarHBondContact O-CB 3.33Å; V91-V94 PolarHBondContact O-N 3.25Å; V91-F95 HydrophobicContact CG1-CD2 4.05Å; V91-F95 HydrophobicContact CG1-CE2 3.55Å; V91-F95 HydrophobicContact CG1-CZ 4.35Å; V91-F95 VanDerWaalsContact O-CD2 3.26Å; V91-F95 WeakPolarHBondContact O-CD2 3.25Å; V91-F95 PolarHBondContact O-N 3.04Å; V91-F95 VanDerWaalsContact O-N 3.08Å; V91-M251 HydrophobicContact CB-CE 4.21Å; V91-M251 HydrophobicContact CG2-CE 3.71Å; V91-M251 HydrophobicContact CG2-SD 3.92Å; V91-L255 HydrophobicContact CG1-CD1 3.82Å; V91-L265 HydrophobicContact CG1-CD1 3.8Å
92D86.6Confident90.9Very high39 Ų3921.1 Ų21.121%0.20912%0.117CC..Hα-helixtrans-65.3-40.9176.9-152.223.5000111.2L89 A90 V94 F95 V96 F219 L269L89-D92 VanDerWaalsContact O-CB 3.28Å; L89-D92 WeakPolarHBondContact O-CB 3.35Å; L89-D92 PolarHBondContact O-N 3.11Å; A90-D92 VanDerWaalsContact C-N 3.31Å; D92-V94 VanDerWaalsContact C-N 3.27Å; D92-V94 PolarHBondContact O-N 3.14Å; D92-F95 WeakPolarHBondContact O-CB 3.42Å; D92-F95 PolarHBondContact O-N 2.98Å; D92-F95 VanDerWaalsContact O-N 3.1Å; D92-V96 PolarHBondContact O-N 3.39Å; D92-F219 HydrophobicContact CB-CE1 3.96Å; D92-F219 HydrophobicContact CB-CZ 4.18Å; D92-F219 WeakPolarHBondContact OD2-CE1 3.1Å; D92-L269 HydrophobicContact CB-CD1 3.92Å
93N90.1Very high90.3Very high7 Ų725.2 Ų25.24%0.03713%0.133CC..Hα-helixtrans-56-44.4172-6123.5000111L89 A90 F95 V96 W97 D216 F219L89-N93 PolarHBondContact O-N 2.75Å; L89-N93 PolarHBondContact O-OD1 2.85Å; A90-N93 PolarHBondContact O-N 3.35Å; N93-F95 VanDerWaalsContact C-N 3.34Å; N93-F95 PolarHBondContact O-N 3.12Å; N93-V96 PolarHBondContact O-N 3.41Å; N93-W97 PolarHBondContact O-N 2.91Å; N93-W97 PolarHBondContact O-NE1 3.44Å; N93-D216 PolarHBondContact ND2-OD1 3.36Å; N93-F219 HydrophobicContact CB-CD2 4.14Å; N93-F219 HydrophobicContact CB-CE2 4.39Å; N93-F219 WeakPolarHBondContact OD1-CB 3.34Å; N93-F219 WeakPolarHBondContact OD1-CD2 3.17Å; N93-F219 WeakPolarHBondContact OD1-CG 3.24Å
94V91.1Very high89.7Confident0 Ų026 Ų260%014%0.136CC..Hα-helixtrans-63.1-37.7178.2168.40000112.2A90 V91 D92 W97 L98 L248 M251 Y252 L255A90-V94 PolarHBondContact O-N 2.98Å; V91-V94 WeakPolarHBondContact O-CB 3.33Å; V91-V94 PolarHBondContact O-N 3.25Å; D92-V94 VanDerWaalsContact C-N 3.27Å; D92-V94 PolarHBondContact O-N 3.14Å; V94-W97 HydrophobicContact CG2-CE3 3.95Å; V94-W97 HydrophobicContact CG2-CZ3 4.05Å; V94-W97 WeakPolarHBondContact O-CB 3.28Å; V94-W97 PolarHBondContact O-N 3.36Å; V94-L98 HydrophobicContact CG1-CD1 4.22Å; V94-L98 WeakPolarHBondContact O-CG 3.34Å; V94-L98 PolarHBondContact O-N 3.21Å; V94-L248 HydrophobicContact CG2-CD2 3.8Å; V94-M251 HydrophobicContact CB-CE 4.16Å; V94-M251 HydrophobicContact CG2-CE 3.5Å; V94-Y252 HydrophobicContact CG1-CD2 4.09Å; V94-L255 HydrophobicContact CG1-CB 4.27Å; V94-L255 HydrophobicContact CG1-CD1 3.94Å
95F88.8Confident89.2Confident32 Ų3229.1 Ų29.114%0.1416%0.161CC..Hα-helixtrans-63.4-42.2173.5-76.5-63.6000112.3V91 D92 N93 W97 L98 M99 A259 F262 L265V91-F95 HydrophobicContact CG1-CD2 4.05Å; V91-F95 HydrophobicContact CG1-CE2 3.55Å; V91-F95 HydrophobicContact CG1-CZ 4.35Å; V91-F95 VanDerWaalsContact O-CD2 3.26Å; V91-F95 WeakPolarHBondContact O-CD2 3.25Å; V91-F95 PolarHBondContact O-N 3.04Å; V91-F95 VanDerWaalsContact O-N 3.08Å; D92-F95 WeakPolarHBondContact O-CB 3.42Å; D92-F95 PolarHBondContact O-N 2.98Å; D92-F95 VanDerWaalsContact O-N 3.1Å; N93-F95 VanDerWaalsContact C-N 3.34Å; N93-F95 PolarHBondContact O-N 3.12Å; F95-W97 VanDerWaalsContact C-N 3.26Å; F95-W97 PolarHBondContact O-N 3.41Å; F95-L98 HydrophobicContact CD1-CD1 4.21Å; F95-L98 WeakPolarHBondContact O-CB 3.49Å; F95-L98 PolarHBondContact O-N 2.91Å; F95-M99 WeakPolarHBondContact O-CG 3.38Å; F95-M99 PolarHBondContact O-N 3.09Å; F95-A259 HydrophobicContact CE1-CB 4.15Å; F95-F262 HydrophobicContact CE1-CB 4.28Å; F95-F262 HydrophobicContact CZ-CB 3.57Å; F95-L265 HydrophobicContact CE2-CD1 3.93Å; F95-L265 HydrophobicContact CZ-CD1 4.16Å
96V87.6Confident88.9Confident25 Ų2529.3 Ų29.315%0.15216%0.162CC..Hα-helixtrans-61.1-38.8174.61740000111.3D92 N93 M99 L100 I168 F219D92-V96 PolarHBondContact O-N 3.39Å; N93-V96 PolarHBondContact O-N 3.41Å; V96-M99 HydrophobicContact CB-CE 4.45Å; V96-M99 HydrophobicContact CG2-CE 3.91Å; V96-M99 PolarHBondContact O-N 3.07Å; V96-L100 HydrophobicContact CG1-CD1 3.98Å; V96-L100 HydrophobicContact CG1-CG 4.31Å; V96-L100 WeakPolarHBondContact O-CB 3.34Å; V96-L100 VanDerWaalsContact O-CG 3.27Å; V96-L100 WeakPolarHBondContact O-CG 3.32Å; V96-L100 PolarHBondContact O-N 3.34Å; V96-I168 HydrophobicContact CG1-CD1 4.35Å; V96-F219 HydrophobicContact CB-CE2 4.02Å; V96-F219 HydrophobicContact CB-CZ 4.44Å; V96-F219 HydrophobicContact CG2-CE2 3.53Å; V96-F219 HydrophobicContact CG2-CZ 3.49Å; V96-F219 VanDerWaalsContact CG2-CZ 3.49Å
97W91.2Very high88.4Confident1 Ų132.1 Ų32.10%0.00418%0.181CC..Hα-helixtrans-63.4-44.6174.7-58.6-7.9000112.1N93 V94 F95 M99 L100 F101 L115 V119 V212 L248 Y252N93-W97 PolarHBondContact O-N 2.91Å; N93-W97 PolarHBondContact O-NE1 3.44Å; V94-W97 HydrophobicContact CG2-CE3 3.95Å; V94-W97 HydrophobicContact CG2-CZ3 4.05Å; V94-W97 WeakPolarHBondContact O-CB 3.28Å; V94-W97 PolarHBondContact O-N 3.36Å; F95-W97 VanDerWaalsContact C-N 3.26Å; F95-W97 PolarHBondContact O-N 3.41Å; W97-M99 VanDerWaalsContact C-N 3.34Å; W97-M99 PolarHBondContact O-N 3.24Å; W97-L100 PolarHBondContact O-N 2.83Å; W97-F101 HydrophobicContact CB-CD2 4.41Å; W97-F101 HydrophobicContact CB-CE2 4.13Å; W97-F101 WeakPolarHBondContact O-CB 3.16Å; W97-F101 WeakPolarHBondContact O-CD2 3.2Å; W97-F101 VanDerWaalsContact O-CG 3.32Å; W97-F101 WeakPolarHBondContact O-CG 3.44Å; W97-F101 PolarHBondContact O-N 3.2Å; W97-L115 HydrophobicContact CD2-CD2 3.86Å; W97-L115 HydrophobicContact CE3-CD2 3.18Å; W97-L115 HydrophobicContact CG-CD2 4.5Å; W97-L115 HydrophobicContact CH2-CD2 4.37Å; W97-L115 HydrophobicContact CZ3-CD2 3.49Å; W97-L115 VanDerWaalsContact CZ3-CD2 3.49Å; W97-V119 HydrophobicContact CH2-CG2 4.13Å; W97-V212 HydrophobicContact CG-CG2 4.29Å; W97-V212 HydrophobicContact CZ2-CG1 4.26Å; W97-L248 HydrophobicContact CH2-CB 4.07Å; W97-L248 HydrophobicContact CH2-CD1 3.76Å; W97-L248 HydrophobicContact CH2-CG 4.46Å; W97-L248 HydrophobicContact CZ2-CD1 4.46Å; W97-L248 HydrophobicContact CZ3-CB 4.08Å; W97-L248 HydrophobicContact CZ3-CD1 4.46Å; W97-Y252 HydrophobicContact CB-CD2 4.23Å; W97-Y252 HydrophobicContact CB-CE2 4.24Å; W97-Y252 HydrophobicContact CE3-CD2 4.3Å
98L89.1Confident87.8Confident23 Ų2332.8 Ų32.812%0.1219%0.192CC..Hα-helixtrans-59.2-45.7176.3-72.5167.4000111.6V94 F95 F101 S102 Y252 L255 A256 A259V94-L98 HydrophobicContact CG1-CD1 4.22Å; V94-L98 WeakPolarHBondContact O-CG 3.34Å; V94-L98 PolarHBondContact O-N 3.21Å; F95-L98 HydrophobicContact CD1-CD1 4.21Å; F95-L98 WeakPolarHBondContact O-CB 3.49Å; F95-L98 PolarHBondContact O-N 2.91Å; L98-F101 PolarHBondContact O-N 2.77Å; L98-S102 WeakPolarHBondContact O-CB 3.07Å; L98-S102 PolarHBondContact O-N 3.43Å; L98-Y252 HydrophobicContact CB-CE2 4.46Å; L98-Y252 HydrophobicContact CD2-CD2 3.98Å; L98-Y252 HydrophobicContact CD2-CE2 3.26Å; L98-Y252 HydrophobicContact CG-CD2 4.07Å; L98-Y252 HydrophobicContact CG-CE2 3.61Å; L98-L255 HydrophobicContact CD1-CB 4.42Å; L98-A256 HydrophobicContact CD2-CB 3.64Å; L98-A259 HydrophobicContact CD1-CB 3.75Å
99M86.4Confident87.3Confident95 Ų9534.5 Ų34.547%0.46821%0.207SC..Hα-helixtrans-64.3-41.4177.1-71-172.6-74.400112.1F95 V96 W97 Y103 I168F95-M99 WeakPolarHBondContact O-CG 3.38Å; F95-M99 PolarHBondContact O-N 3.09Å; V96-M99 HydrophobicContact CB-CE 4.45Å; V96-M99 HydrophobicContact CG2-CE 3.91Å; V96-M99 PolarHBondContact O-N 3.07Å; W97-M99 VanDerWaalsContact C-N 3.34Å; W97-M99 PolarHBondContact O-N 3.24Å; M99-Y103 VanDerWaalsContact O-CB 3.23Å; M99-Y103 WeakPolarHBondContact O-CB 3.13Å; M99-Y103 PolarHBondContact O-N 3.27Å; M99-I168 HydrophobicContact CB-CD1 3.41Å; M99-I168 VanDerWaalsContact CB-CD1 3.41Å; M99-I168 HydrophobicContact CB-CG1 4.3Å; M99-I168 HydrophobicContact CE-CD1 4.18Å; M99-I168 HydrophobicContact CG-CD1 4.44Å; M99-I168 HydrophobicContact SD-CD1 4.3Å
100L89.2Confident87Confident3 Ų334.6 Ų34.62%0.01621%0.208CC..Hα-helixtrans-62.6-49.8175.3-77.4171.6000111.3V96 W97 S102 Y103 F104 I168 V208 L211 V212V96-L100 HydrophobicContact CG1-CD1 3.98Å; V96-L100 HydrophobicContact CG1-CG 4.31Å; V96-L100 WeakPolarHBondContact O-CB 3.34Å; V96-L100 VanDerWaalsContact O-CG 3.27Å; V96-L100 WeakPolarHBondContact O-CG 3.32Å; V96-L100 PolarHBondContact O-N 3.34Å; W97-L100 PolarHBondContact O-N 2.83Å; L100-S102 VanDerWaalsContact C-N 3.33Å; L100-S102 PolarHBondContact O-N 3.15Å; L100-Y103 PolarHBondContact O-N 3.35Å; L100-F104 HydrophobicContact CD2-CE2 4.16Å; L100-F104 VanDerWaalsContact O-CD2 3.3Å; L100-F104 WeakPolarHBondContact O-CD2 3.43Å; L100-F104 PolarHBondContact O-N 3.22Å; L100-I168 HydrophobicContact CD2-CB 4.42Å; L100-I168 HydrophobicContact CD2-CD1 4.32Å; L100-I168 HydrophobicContact CD2-CG2 3.62Å; L100-I168 HydrophobicContact CG-CD1 4.17Å; L100-V208 HydrophobicContact CB-CG1 4.47Å; L100-L211 HydrophobicContact CD1-CB 3.84Å; L100-L211 HydrophobicContact CD2-CB 3.88Å; L100-L211 HydrophobicContact CD2-CD1 3.72Å; L100-L211 HydrophobicContact CD2-CG 4.41Å; L100-V212 HydrophobicContact CD1-CG2 3.93Å
101F89.9Confident86.9Confident2 Ų235.5 Ų35.51%0.00921%0.211CC..Hα-helixtrans-65.9-36.1179.9-66.1-42.4000112.7W97 L98 S105 V106 Q111 V114 L115 V208 Y252W97-F101 HydrophobicContact CB-CD2 4.41Å; W97-F101 HydrophobicContact CB-CE2 4.13Å; W97-F101 WeakPolarHBondContact O-CB 3.16Å; W97-F101 WeakPolarHBondContact O-CD2 3.2Å; W97-F101 VanDerWaalsContact O-CG 3.32Å; W97-F101 WeakPolarHBondContact O-CG 3.44Å; W97-F101 PolarHBondContact O-N 3.2Å; L98-F101 PolarHBondContact O-N 2.77Å; F101-S105 CarbonylContact O-C 3.57Å; F101-S105 WeakPolarHBondContact O-CA 3.4Å; F101-S105 PolarHBondContact O-N 2.85Å; F101-V106 HydrophobicContact CB-CB 4.28Å; F101-V106 HydrophobicContact CD1-CB 3.86Å; F101-V106 HydrophobicContact CD1-CG1 4.14Å; F101-V106 HydrophobicContact CD1-CG2 3.9Å; F101-V106 HydrophobicContact CG-CB 4.44Å; F101-V106 PolarHBondContact O-N 3.06Å; F101-Q111 HydrophobicContact CB-CG 4.1Å; F101-Q111 HydrophobicContact CD1-CG 4Å; F101-Q111 HydrophobicContact CD2-CB 4.23Å; F101-Q111 HydrophobicContact CD2-CG 3.93Å; F101-Q111 HydrophobicContact CE1-CB 4.47Å; F101-Q111 HydrophobicContact CE1-CG 4.38Å; F101-Q111 HydrophobicContact CE2-CB 4.1Å; F101-Q111 HydrophobicContact CE2-CG 4.29Å; F101-Q111 HydrophobicContact CG-CB 4.45Å; F101-Q111 HydrophobicContact CG-CG 3.76Å; F101-Q111 HydrophobicContact CZ-CB 4.25Å; F101-V114 HydrophobicContact CE1-CB 3.8Å; F101-V114 HydrophobicContact CE1-CG1 3.76Å; F101-V114 HydrophobicContact CE1-CG2 4.18Å; F101-V114 HydrophobicContact CZ-CB 3.87Å; F101-V114 HydrophobicContact CZ-CG1 3.88Å; F101-L115 HydrophobicContact CE2-CD1 4.3Å; F101-L115 HydrophobicContact CE2-CD2 3.82Å; F101-L115 HydrophobicContact CE2-CG 3.93Å; F101-L115 HydrophobicContact CZ-CD2 4.07Å; F101-L115 HydrophobicContact CZ-CG 4.01Å; F101-V208 HydrophobicContact CD1-CG1 3.65Å; F101-V208 HydrophobicContact CE1-CG1 3.44Å; F101-V208 VanDerWaalsContact CE1-CG1 3.44Å; F101-Y252 AromaticContact CD2-CE2 3.59Å; F101-Y252 HydrophobicContact CD2-CE2 3.59Å; F101-Y252 AromaticContact CD2-CZ 3.54Å; F101-Y252 WeakPolarHBondContact CD2-OH 3.39Å; F101-Y252 HydrophobicContact CE2-CD2 4.49Å; F101-Y252 AromaticContact CE2-CE2 3.79Å; F101-Y252 HydrophobicContact CE2-CE2 3.79Å; F101-Y252 AromaticContact CE2-CZ 3.86Å
102S85.8Confident86.6Confident90 Ų9037.5 Ų37.563%0.62922%0.216SC*.Hα-helixtrans-63.3-51.4172.5-177.80000111L98 L100 F104 S105L98-S102 WeakPolarHBondContact O-CB 3.07Å; L98-S102 PolarHBondContact O-N 3.43Å; L100-S102 VanDerWaalsContact C-N 3.33Å; L100-S102 PolarHBondContact O-N 3.15Å; S102-F104 PolarHBondContact O-N 3.43Å; S102-S105 WeakPolarHBondContact O-CA 3.28Å; S102-S105 PolarHBondContact O-N 2.68Å
103Y84.2Confident86.5Confident86 Ų8638.9 Ų38.934%0.33722%0.218SC..Hα-helixtrans-60.3-43.5-179179-92.2000112.7M99 L100 S105 G169M99-Y103 VanDerWaalsContact O-CB 3.23Å; M99-Y103 WeakPolarHBondContact O-CB 3.13Å; M99-Y103 PolarHBondContact O-N 3.27Å; L100-Y103 PolarHBondContact O-N 3.35Å; Y103-S105 PolarHBondContact O-N 3.39Å; Y103-G169 VanDerWaalsContact CE1-CA 3.47Å; Y103-G169 WeakPolarHBondContact OH-CA 3.3Å
104F85.1Confident86.5Confident24 Ų2438.6 Ų38.611%0.10522%0.217CC..THydrogen-bonded Turntrans-84.33.4176.5-73.6-81000113.4L100 S102 V106 V174 L207 V208 L211L100-F104 HydrophobicContact CD2-CE2 4.16Å; L100-F104 VanDerWaalsContact O-CD2 3.3Å; L100-F104 WeakPolarHBondContact O-CD2 3.43Å; L100-F104 PolarHBondContact O-N 3.22Å; S102-F104 PolarHBondContact O-N 3.43Å; F104-V106 HydrophobicContact CB-CG2 3.74Å; F104-V106 PolarHBondContact O-N 3.35Å; F104-V106 VanDerWaalsContact O-N 3.14Å; F104-V174 HydrophobicContact CZ-CG1 4.1Å; F104-L207 HydrophobicContact CE1-CD2 3.6Å; F104-L207 HydrophobicContact CE1-CG 4.45Å; F104-L207 HydrophobicContact CZ-CD2 3.51Å; F104-L207 HydrophobicContact CZ-CG 4.13Å; F104-V208 HydrophobicContact CB-CG2 3.69Å; F104-V208 HydrophobicContact CD1-CG2 4.11Å; F104-V208 HydrophobicContact CD2-CG2 3.43Å; F104-V208 VanDerWaalsContact CD2-CG2 3.43Å; F104-V208 HydrophobicContact CE2-CG2 4.05Å; F104-V208 HydrophobicContact CG-CG2 3.47Å; F104-V208 VanDerWaalsContact CG-CG2 3.47Å; F104-L211 HydrophobicContact CE2-CD1 3.69Å; F104-L211 HydrophobicContact CZ-CD1 3.96Å
105S84.8Confident86.5Confident99 Ų9938.6 Ų38.669%0.69222%0.217SC*.THydrogen-bonded Turntrans48.340.6-178.8-62.70000112.8F101 S102 Y103 P107F101-S105 CarbonylContact O-C 3.57Å; F101-S105 WeakPolarHBondContact O-CA 3.4Å; F101-S105 PolarHBondContact O-N 2.85Å; S102-S105 WeakPolarHBondContact O-CA 3.28Å; S102-S105 PolarHBondContact O-N 2.68Å; Y103-S105 PolarHBondContact O-N 3.39Å; S105-P107 VanDerWaalsContact O-CD 3.27Å; S105-P107 WeakPolarHBondContact O-CD 3.41Å
106V87.1Confident86.4Confident5 Ų538.4 Ų38.43%0.0322%0.218CC..  trans-70119.8-175.3-178.80000108.9F101 F104 L110 Q111 L205 V208F101-V106 HydrophobicContact CB-CB 4.28Å; F101-V106 HydrophobicContact CD1-CB 3.86Å; F101-V106 HydrophobicContact CD1-CG1 4.14Å; F101-V106 HydrophobicContact CD1-CG2 3.9Å; F101-V106 HydrophobicContact CG-CB 4.44Å; F101-V106 PolarHBondContact O-N 3.06Å; F104-V106 HydrophobicContact CB-CG2 3.74Å; F104-V106 PolarHBondContact O-N 3.35Å; F104-V106 VanDerWaalsContact O-N 3.14Å; V106-L110 HydrophobicContact CG1-CB 3.97Å; V106-Q111 HydrophobicContact CB-CG 4.11Å; V106-Q111 HydrophobicContact CG1-CG 3.79Å; V106-Q111 PolarHBondContact O-NE2 3.3Å; V106-L205 HydrophobicContact CG1-CD2 3.7Å; V106-L205 HydrophobicContact CG2-CD2 4.39Å; V106-V208 HydrophobicContact CG2-CG2 4.09Å
107P84.6Confident86.6Confident66 Ų6642.3 Ų42.343%0.42923%0.231SC..  trans-55.8140.3177-24.732.5000112S105 A109 L110 Q111S105-P107 VanDerWaalsContact O-CD 3.27Å; S105-P107 WeakPolarHBondContact O-CD 3.41Å; P107-A109 PolarHBondContact O-N 3.49Å; P107-L110 HydrophobicContact CB-CD1 4.45Å; P107-L110 HydrophobicContact CB-CG 4.42Å; P107-L110 HydrophobicContact CG-CD1 4.11Å; P107-L110 WeakPolarHBondContact O-CA 3.2Å; P107-L110 PolarHBondContact O-N 3.01Å; P107-Q111 PolarHBondContact O-N 2.88Å; P107-Q111 VanDerWaalsContact O-N 3.09Å
108A81.1Confident86.6Confident44 Ų4442.3 Ų42.336%0.36423%0.231SC..Hα-helixtrans-54.9-32.3-176.300000113.9A35 L110 Q111A35-A108 HydrophobicContact CB-CB 4.1Å; A108-L110 VanDerWaalsContact C-N 3.27Å; A108-L110 PolarHBondContact O-N 2.96Å; A108-Q111 PolarHBondContact O-N 3.35Å
109A80Confident86.7Confident43 Ų4341.4 Ų41.436%0.35523%0.227SC..Hα-helixtrans-61.7-34.3175.100000112.9P107P107-A109 PolarHBondContact O-N 3.49Å
110L84.2Confident86.9Confident18 Ų1839.5 Ų39.59%0.09422%0.218CC..Hα-helixtrans-89-29.7-178.3-58.5-178.7000112.6V106 P107 A108 R112 R113 V114 I187 N189 E190 L205V106-L110 HydrophobicContact CG1-CB 3.97Å; P107-L110 HydrophobicContact CB-CD1 4.45Å; P107-L110 HydrophobicContact CB-CG 4.42Å; P107-L110 HydrophobicContact CG-CD1 4.11Å; P107-L110 WeakPolarHBondContact O-CA 3.2Å; P107-L110 PolarHBondContact O-N 3.01Å; A108-L110 VanDerWaalsContact C-N 3.27Å; A108-L110 PolarHBondContact O-N 2.96Å; L110-R112 PolarHBondContact O-N 2.63Å; L110-R113 WeakPolarHBondContact O-CB 3.41Å; L110-R113 PolarHBondContact O-N 2.91Å; L110-V114 PolarHBondContact O-N 3.14Å; L110-I187 HydrophobicContact CD1-CG2 3.56Å; L110-N189 VanDerWaalsContact CD1-O 3.26Å; L110-N189 WeakPolarHBondContact CD1-O 3.49Å; L110-E190 HydrophobicContact CD2-CB 4.02Å; L110-E190 HydrophobicContact CD2-CG 3.62Å; L110-L205 HydrophobicContact CB-CD2 4.13Å; L110-L205 HydrophobicContact CD1-CD1 4.21Å; L110-L205 HydrophobicContact CD1-CD2 4.35Å
111Q88.6Confident87.1Confident26 Ų2640.2 Ų40.212%0.12123%0.226CC..Hα-helixtrans-52.8-42.1176-66.1174.34.400111.2F101 V106 P107 A108 R113 V114 L115 Y252F101-Q111 HydrophobicContact CB-CG 4.1Å; F101-Q111 HydrophobicContact CD1-CG 4Å; F101-Q111 HydrophobicContact CD2-CB 4.23Å; F101-Q111 HydrophobicContact CD2-CG 3.93Å; F101-Q111 HydrophobicContact CE1-CB 4.47Å; F101-Q111 HydrophobicContact CE1-CG 4.38Å; F101-Q111 HydrophobicContact CE2-CB 4.1Å; F101-Q111 HydrophobicContact CE2-CG 4.29Å; F101-Q111 HydrophobicContact CG-CB 4.45Å; F101-Q111 HydrophobicContact CG-CG 3.76Å; F101-Q111 HydrophobicContact CZ-CB 4.25Å; V106-Q111 HydrophobicContact CB-CG 4.11Å; V106-Q111 HydrophobicContact CG1-CG 3.79Å; V106-Q111 PolarHBondContact O-NE2 3.3Å; P107-Q111 PolarHBondContact O-N 2.88Å; P107-Q111 VanDerWaalsContact O-N 3.09Å; A108-Q111 PolarHBondContact O-N 3.35Å; Q111-R113 VanDerWaalsContact C-N 3.28Å; Q111-R113 PolarHBondContact O-N 2.96Å; Q111-V114 PolarHBondContact O-N 3.41Å; Q111-V114 VanDerWaalsContact O-N 3.17Å; Q111-L115 VanDerWaalsContact O-CG 3.28Å; Q111-L115 WeakPolarHBondContact O-CG 3.45Å; Q111-L115 PolarHBondContact O-N 3.38Å; Q111-Y252 PolarHBondContact OE1-OH 3.46Å
112R82.6Confident87.3Confident59 Ų5940.1 Ų40.122%0.22323%0.226CC..Hα-helixtrans-52.6-46.1176.7-176.8-177.366.9166.2-6.3112.4Q28 G29 R31 L110 L115 V116 F253Q28-R112 PolarHBondContact O-NH1 2.84Å; G29-R112 PolarHBondContact O-NH1 3.47Å; R31-R112 PolarHBondContact O-NH1 3.19Å; L110-R112 PolarHBondContact O-N 2.63Å; R112-L115 PolarHBondContact O-N 3.43Å; R112-V116 VanDerWaalsContact O-CG2 3.26Å; R112-V116 WeakPolarHBondContact O-CG2 3.45Å; R112-V116 PolarHBondContact O-N 3.29Å; R112-F253 HydrophobicContact CB-CZ 4.2Å
113R85.7Confident87.6Confident69 Ų6936.7 Ų36.726%0.2620%0.2SC..Hα-helixtrans-64.6-45.2-177.9-175.1175.8179.2151.6-3.6110.4L110 Q111 L115 V116 Y117 E190 F192L110-R113 WeakPolarHBondContact O-CB 3.41Å; L110-R113 PolarHBondContact O-N 2.91Å; Q111-R113 VanDerWaalsContact C-N 3.28Å; Q111-R113 PolarHBondContact O-N 2.96Å; R113-L115 VanDerWaalsContact C-N 3.31Å; R113-L115 PolarHBondContact O-N 3.5Å; R113-V116 WeakPolarHBondContact O-CB 3.48Å; R113-V116 PolarHBondContact O-N 3.45Å; R113-Y117 HydrophobicContact CG-CD2 4.19Å; R113-Y117 HydrophobicContact CG-CE2 3.92Å; R113-Y117 VanDerWaalsContact O-CD2 3.23Å; R113-Y117 WeakPolarHBondContact O-CD2 2.92Å; R113-Y117 PolarHBondContact O-N 3.47Å; R113-E190 PolarHBondContact NE-O 3.27Å; R113-E190 PolarHBondContact NH1-O 2.91Å; R113-E190 VanDerWaalsContact NH1-O 3.16Å; R113-E190 IonicContact NH1-OE2 3.84Å; R113-E190 PolarHBondContact NH1-OE2 2.94Å; R113-F192 HydrophobicContact CG-CE2 4.13Å; R113-F192 HydrophobicContact CG-CZ 4.07Å
114V89.6Confident88.1Confident0 Ų036.5 Ų36.50%021%0.208CC..Hα-helixtrans-60.3-43.5175.9-177.30000110.8F101 L110 Q111 V116 Y117 G118 F192 L205 V208 L209 V212F101-V114 HydrophobicContact CE1-CB 3.8Å; F101-V114 HydrophobicContact CE1-CG1 3.76Å; F101-V114 HydrophobicContact CE1-CG2 4.18Å; F101-V114 HydrophobicContact CZ-CB 3.87Å; F101-V114 HydrophobicContact CZ-CG1 3.88Å; L110-V114 PolarHBondContact O-N 3.14Å; Q111-V114 PolarHBondContact O-N 3.41Å; Q111-V114 VanDerWaalsContact O-N 3.17Å; V114-V116 VanDerWaalsContact C-N 3.33Å; V114-V116 PolarHBondContact O-N 2.8Å; V114-Y117 PolarHBondContact O-N 2.95Å; V114-G118 WeakPolarHBondContact O-CA 2.88Å; V114-G118 PolarHBondContact O-N 3.2Å; V114-F192 HydrophobicContact CG2-CE1 4.21Å; V114-L205 HydrophobicContact CG2-CD2 4.21Å; V114-V208 HydrophobicContact CG1-CG1 4.15Å; V114-L209 HydrophobicContact CG1-CB 4.11Å; V114-L209 HydrophobicContact CG1-CD1 4.16Å; V114-V212 HydrophobicContact CG1-CG2 4.38Å
115L90.1Very high88.6Confident0 Ų038.1 Ų38.10%022%0.217CC..Hα-helixtrans-65.1-32.4177.6-68.2171.5000113.6W97 F101 Q111 R112 R113 V119 R249 Y252 F253W97-L115 HydrophobicContact CD2-CD2 3.86Å; W97-L115 HydrophobicContact CE3-CD2 3.18Å; W97-L115 HydrophobicContact CG-CD2 4.5Å; W97-L115 HydrophobicContact CH2-CD2 4.37Å; W97-L115 HydrophobicContact CZ3-CD2 3.49Å; W97-L115 VanDerWaalsContact CZ3-CD2 3.49Å; F101-L115 HydrophobicContact CE2-CD1 4.3Å; F101-L115 HydrophobicContact CE2-CD2 3.82Å; F101-L115 HydrophobicContact CE2-CG 3.93Å; F101-L115 HydrophobicContact CZ-CD2 4.07Å; F101-L115 HydrophobicContact CZ-CG 4.01Å; Q111-L115 VanDerWaalsContact O-CG 3.28Å; Q111-L115 WeakPolarHBondContact O-CG 3.45Å; Q111-L115 PolarHBondContact O-N 3.38Å; R112-L115 PolarHBondContact O-N 3.43Å; R113-L115 VanDerWaalsContact C-N 3.31Å; R113-L115 PolarHBondContact O-N 3.5Å; L115-V119 WeakPolarHBondContact O-CB 3.47Å; L115-V119 VanDerWaalsContact O-CG2 3.28Å; L115-V119 WeakPolarHBondContact O-CG2 3.19Å; L115-V119 PolarHBondContact O-N 3.18Å; L115-R249 HydrophobicContact CB-CG 4.16Å; L115-R249 HydrophobicContact CD1-CG 4.17Å; L115-Y252 HydrophobicContact CD1-CD1 3.34Å; L115-Y252 HydrophobicContact CD1-CD2 4.25Å; L115-Y252 HydrophobicContact CD1-CE1 3.8Å; L115-Y252 HydrophobicContact CD1-CG 3.61Å; L115-Y252 HydrophobicContact CD2-CD2 4.34Å; L115-Y252 HydrophobicContact CD2-CG 4.33Å; L115-F253 HydrophobicContact CD1-CE2 4.3Å; L115-F253 HydrophobicContact CD1-CZ 4.35Å
116V88.3Confident89Confident29 Ų2933.6 Ų33.618%0.17619%0.185CC..Hα-helixtrans-61.8-52.8174.5170.20000110.2L25 R112 R113 V114 L120 R249L25-V116 HydrophobicContact CD2-CG1 3.46Å; L25-V116 VanDerWaalsContact CD2-CG1 3.46Å; R112-V116 VanDerWaalsContact O-CG2 3.26Å; R112-V116 WeakPolarHBondContact O-CG2 3.45Å; R112-V116 PolarHBondContact O-N 3.29Å; R113-V116 WeakPolarHBondContact O-CB 3.48Å; R113-V116 PolarHBondContact O-N 3.45Å; V114-V116 VanDerWaalsContact C-N 3.33Å; V114-V116 PolarHBondContact O-N 2.8Å; V116-L120 HydrophobicContact CG1-CD1 4.29Å; V116-L120 WeakPolarHBondContact O-CG 3.12Å; V116-L120 PolarHBondContact O-N 3.32Å; V116-R249 VanDerWaalsContact CG2-NH2 3.31Å
117Y90.2Very high89.4Confident107 Ų10735 Ų3542%0.4219%0.194SC..Hα-helixtrans-67.9-39.6178.6-69.7-74.1000111.6R113 V114 V119 L120 G121 F192R113-Y117 HydrophobicContact CG-CD2 4.19Å; R113-Y117 HydrophobicContact CG-CE2 3.92Å; R113-Y117 VanDerWaalsContact O-CD2 3.23Å; R113-Y117 WeakPolarHBondContact O-CD2 2.92Å; R113-Y117 PolarHBondContact O-N 3.47Å; V114-Y117 PolarHBondContact O-N 2.95Å; Y117-V119 PolarHBondContact O-N 3.18Å; Y117-L120 PolarHBondContact O-N 3.2Å; Y117-L120 VanDerWaalsContact O-N 3.15Å; Y117-G121 PolarHBondContact O-N 2.79Å; Y117-F192 AromaticContact CD2-CE2 3.59Å; Y117-F192 HydrophobicContact CD2-CE2 3.59Å; Y117-F192 AromaticContact CD2-CZ 3.76Å; Y117-F192 HydrophobicContact CD2-CZ 3.76Å; Y117-F192 AromaticContact CE2-CE2 3.58Å; Y117-F192 HydrophobicContact CE2-CE2 3.58Å; Y117-F192 HydrophobicContact CE2-CZ 4.19Å; Y117-F192 HydrophobicContact CG-CE2 4.48Å
118G91.8Very high89.9Confident1 Ų136.5 Ų36.51%0.0120%0.197CC..Hα-helixtrans-54.6-47.4175.700000113.3V114 A122 E213V114-G118 WeakPolarHBondContact O-CA 2.88Å; V114-G118 PolarHBondContact O-N 3.2Å; G118-A122 WeakPolarHBondContact O-CB 3.28Å; G118-A122 PolarHBondContact O-N 3.24Å; G118-E213 WeakPolarHBondContact CA-OE1 3.44Å
119V91.2Very high90.6Very high4 Ų436.4 Ų36.42%0.02419%0.189CC..Hα-helixtrans-68.9-38.7177.5168.60000111.3W97 L115 Y117 I123 I245 L248W97-V119 HydrophobicContact CH2-CG2 4.13Å; L115-V119 WeakPolarHBondContact O-CB 3.47Å; L115-V119 VanDerWaalsContact O-CG2 3.28Å; L115-V119 WeakPolarHBondContact O-CG2 3.19Å; L115-V119 PolarHBondContact O-N 3.18Å; Y117-V119 PolarHBondContact O-N 3.18Å; V119-I123 HydrophobicContact CG1-CD1 4.04Å; V119-I123 VanDerWaalsContact O-CG1 3.25Å; V119-I123 WeakPolarHBondContact O-CG1 3.45Å; V119-I123 PolarHBondContact O-N 3.39Å; V119-I245 HydrophobicContact CG1-CG2 4.06Å; V119-L248 HydrophobicContact CG2-CB 4.23Å
120L91.5Very high91.3Very high55 Ų5534.3 Ų34.329%0.28817%0.173SC..Hα-helixtrans-66-43.5177.8-71.5173.1000111.9L21 L25 V116 Y117 I123 V124L21-L120 HydrophobicContact CD2-CD2 4.14Å; L25-L120 HydrophobicContact CD2-CD1 4.4Å; V116-L120 HydrophobicContact CG1-CD1 4.29Å; V116-L120 WeakPolarHBondContact O-CG 3.12Å; V116-L120 PolarHBondContact O-N 3.32Å; Y117-L120 PolarHBondContact O-N 3.2Å; Y117-L120 VanDerWaalsContact O-N 3.15Å; L120-I123 PolarHBondContact O-N 3.42Å; L120-V124 WeakPolarHBondContact O-CG2 3.37Å; L120-V124 PolarHBondContact O-N 2.85Å
121G93.1Very high91.8Very high18 Ų1837.8 Ų37.819%0.18619%0.187CC..Hα-helixtrans-67-43.317600000111.7Y117 I123 V124 L125 E213Y117-G121 PolarHBondContact O-N 2.79Å; G121-I123 VanDerWaalsContact C-N 3.33Å; G121-I123 PolarHBondContact O-N 3.28Å; G121-V124 PolarHBondContact O-N 3.08Å; G121-V124 VanDerWaalsContact O-N 3.09Å; G121-L125 WeakPolarHBondContact O-CB 3.24Å; G121-L125 WeakPolarHBondContact O-CG 3.47Å; G121-L125 PolarHBondContact O-N 3.25Å; G121-E213 VanDerWaalsContact CA-OE1 3.28Å; G121-E213 WeakPolarHBondContact CA-OE1 3.16Å; G121-E213 VanDerWaalsContact CA-OE2 3.25Å; G121-E213 WeakPolarHBondContact CA-OE2 3.31Å
122A93.2Very high92.1Very high0 Ų039.8 Ų39.80%020%0.201CC..Hα-helixtrans-53.6-48171.900000111.6G118 V124 L125 R126 E213 D216G118-A122 WeakPolarHBondContact O-CB 3.28Å; G118-A122 PolarHBondContact O-N 3.24Å; A122-V124 VanDerWaalsContact C-N 3.34Å; A122-V124 PolarHBondContact O-N 3.17Å; A122-L125 PolarHBondContact O-N 3.35Å; A122-R126 WeakPolarHBondContact O-CA 3.3Å; A122-R126 WeakPolarHBondContact O-CB 3.46Å; A122-R126 PolarHBondContact O-N 2.96Å; A122-E213 PolarHBondContact N-OE2 3.3Å; A122-D216 WeakPolarHBondContact CA-OD2 3.24Å; A122-D216 HydrophobicContact CB-CB 4.34Å; A122-D216 WeakPolarHBondContact CB-OD2 3.25Å
123I92.5Very high92.5Very high17 Ų1737.1 Ų37.19%0.08719%0.192CC..Hα-helixtrans-56.6-46.5176.7-74.8170.9000112L21 V119 L120 G121 T127 L242 I245 L246L21-I123 HydrophobicContact CD1-CD1 4.34Å; L21-I123 HydrophobicContact CD2-CD1 3.62Å; L21-I123 HydrophobicContact CG-CD1 4.44Å; V119-I123 HydrophobicContact CG1-CD1 4.04Å; V119-I123 VanDerWaalsContact O-CG1 3.25Å; V119-I123 WeakPolarHBondContact O-CG1 3.45Å; V119-I123 PolarHBondContact O-N 3.39Å; L120-I123 PolarHBondContact O-N 3.42Å; G121-I123 VanDerWaalsContact C-N 3.33Å; G121-I123 PolarHBondContact O-N 3.28Å; I123-T127 WeakPolarHBondContact O-CB 3.39Å; I123-T127 PolarHBondContact O-N 3.02Å; I123-T127 PolarHBondContact O-OG1 3.05Å; I123-L242 HydrophobicContact CB-CD2 4.04Å; I123-L242 HydrophobicContact CG1-CD2 3.75Å; I123-L242 HydrophobicContact CG2-CD2 3.67Å; I123-I245 HydrophobicContact CD1-CG2 4.46Å; I123-I245 HydrophobicContact CG1-CG2 3.89Å; I123-L246 HydrophobicContact CD1-CD2 4.41Å
124V94.8Very high92.8Very high83 Ų8334.6 Ų34.650%0.50319%0.185SC..Hα-helixtrans-66.8-53.2-178.9172.40000110.9L120 G121 A122 R126 T127 I128L120-V124 WeakPolarHBondContact O-CG2 3.37Å; L120-V124 PolarHBondContact O-N 2.85Å; G121-V124 PolarHBondContact O-N 3.08Å; G121-V124 VanDerWaalsContact O-N 3.09Å; A122-V124 VanDerWaalsContact C-N 3.34Å; A122-V124 PolarHBondContact O-N 3.17Å; V124-R126 VanDerWaalsContact C-N 3.31Å; V124-R126 PolarHBondContact O-N 3.48Å; V124-T127 PolarHBondContact O-N 3.48Å; V124-I128 HydrophobicContact CG1-CD1 3.95Å; V124-I128 WeakPolarHBondContact O-CG1 3.49Å; V124-I128 PolarHBondContact O-N 2.85Å
125L95.5Very high92.9Very high57 Ų5742 Ų4230%0.29821%0.213SC..Hα-helixtrans-60.7-43.5-179-68.1174.3000110.7G121 A122 I128 M129 E213 V217G121-L125 WeakPolarHBondContact O-CB 3.24Å; G121-L125 WeakPolarHBondContact O-CG 3.47Å; G121-L125 PolarHBondContact O-N 3.25Å; A122-L125 PolarHBondContact O-N 3.35Å; L125-I128 PolarHBondContact O-N 3.18Å; L125-M129 HydrophobicContact CB-CE 4.11Å; L125-M129 WeakPolarHBondContact O-CB 3.4Å; L125-M129 WeakPolarHBondContact O-CE 3.29Å; L125-M129 VanDerWaalsContact O-CG 3.32Å; L125-M129 WeakPolarHBondContact O-CG 3.45Å; L125-M129 PolarHBondContact O-N 3.34Å; L125-E213 HydrophobicContact CD1-CB 4.38Å; L125-E213 WeakPolarHBondContact CD1-OE2 3.46Å; L125-V217 HydrophobicContact CB-CG2 4.48Å; L125-V217 HydrophobicContact CD1-CG2 3.73Å
126R93.7Very high93Very high5 Ų544.4 Ų44.42%0.01923%0.226CC..Hα-helixtrans-60.8-46.5176.3-166.185-166.8-171.6-0.7112.1E86 A122 V124 I128 M129 I130 S223 I224 N241 I245E86-R126 VanDerWaalsContact CD-NH2 3.34Å; E86-R126 IonicContact OE1-CZ 3.67Å; E86-R126 IonicContact OE1-NH2 3.85Å; E86-R126 PolarHBondContact OE1-NH2 3.03Å; E86-R126 IonicContact OE2-CZ 3.09Å; E86-R126 IonicContact OE2-NH2 2.81Å; E86-R126 PolarHBondContact OE2-NH2 3.01Å; E86-R126 VanDerWaalsContact OE2-NH2 3.09Å; A122-R126 WeakPolarHBondContact O-CA 3.3Å; A122-R126 WeakPolarHBondContact O-CB 3.46Å; A122-R126 PolarHBondContact O-N 2.96Å; V124-R126 VanDerWaalsContact C-N 3.31Å; V124-R126 PolarHBondContact O-N 3.48Å; R126-I128 VanDerWaalsContact C-N 3.28Å; R126-I128 PolarHBondContact O-N 3Å; R126-M129 PolarHBondContact O-N 3.5Å; R126-I130 HydrophobicContact CG-CD1 3.73Å; R126-I130 HydrophobicContact CG-CG1 4.28Å; R126-I130 WeakPolarHBondContact O-CB 3.36Å; R126-I130 VanDerWaalsContact O-CG1 3.26Å; R126-I130 WeakPolarHBondContact O-CG1 3.2Å; R126-I130 PolarHBondContact O-N 2.86Å; R126-S223 VanDerWaalsContact CZ-OG 3.22Å; R126-S223 PolarHBondContact NH1-OG 3.28Å; R126-S223 PolarHBondContact NH2-OG 3.38Å; R126-I224 VanDerWaalsContact NE-CD1 3.34Å; R126-N241 VanDerWaalsContact CG-OD1 3.25Å; R126-N241 WeakPolarHBondContact CG-OD1 3.38Å; R126-N241 PolarHBondContact NE-ND2 3.42Å; R126-N241 PolarHBondContact NE-OD1 2.92Å; R126-N241 PolarHBondContact NH2-ND2 3.17Å; R126-I245 HydrophobicContact CB-CD1 4.09Å; R126-I245 HydrophobicContact CG-CD1 3.99Å
127T94.4Very high93Very high35 Ų3543.1 Ų43.122%0.21522%0.218CC..Hα-helixtrans-57.7-45.6177.3-59.30000110.5I123 V124 I130 F131 L238I123-T127 WeakPolarHBondContact O-CB 3.39Å; I123-T127 PolarHBondContact O-N 3.02Å; I123-T127 PolarHBondContact O-OG1 3.05Å; V124-T127 PolarHBondContact O-N 3.48Å; T127-I130 PolarHBondContact O-N 3.1Å; T127-F131 HydrophobicContact CG2-CD2 3.72Å; T127-F131 HydrophobicContact CG2-CE2 3.48Å; T127-F131 VanDerWaalsContact CG2-CE2 3.48Å; T127-F131 WeakPolarHBondContact O-CD2 3.29Å; T127-F131 PolarHBondContact O-N 2.94Å; T127-F131 VanDerWaalsContact O-N 3.07Å; T127-L238 HydrophobicContact CG2-CD1 4Å; T127-L238 HydrophobicContact CG2-CD2 4.42Å
128I96.2Very high92.9Very high96 Ų9640.4 Ų40.449%0.49221%0.214SC..Hα-helixtrans-60.9-48.1176.1-66165.6000111.1V124 L125 R126 I130 F131 T132V124-I128 HydrophobicContact CG1-CD1 3.95Å; V124-I128 WeakPolarHBondContact O-CG1 3.49Å; V124-I128 PolarHBondContact O-N 2.85Å; L125-I128 PolarHBondContact O-N 3.18Å; R126-I128 VanDerWaalsContact C-N 3.28Å; R126-I128 PolarHBondContact O-N 3Å; I128-I130 PolarHBondContact O-N 2.9Å; I128-F131 PolarHBondContact O-N 3.13Å; I128-T132 WeakPolarHBondContact O-CB 3.46Å; I128-T132 PolarHBondContact O-N 3.48Å; I128-T132 PolarHBondContact O-OG1 3.42Å
129M95.1Very high92.9Very high42 Ų4245.9 Ų45.921%0.20724%0.24CC..Hα-helixtrans-65.3-37.6-179.1-72.2-175.9-69.100112.6L125 R126 T132 G133 V217 A220 I224L125-M129 HydrophobicContact CB-CE 4.11Å; L125-M129 WeakPolarHBondContact O-CB 3.4Å; L125-M129 WeakPolarHBondContact O-CE 3.29Å; L125-M129 VanDerWaalsContact O-CG 3.32Å; L125-M129 WeakPolarHBondContact O-CG 3.45Å; L125-M129 PolarHBondContact O-N 3.34Å; R126-M129 PolarHBondContact O-N 3.5Å; M129-T132 PolarHBondContact O-N 3.34Å; M129-G133 PolarHBondContact O-N 3.45Å; M129-V217 HydrophobicContact CE-CG2 4.38Å; M129-V217 HydrophobicContact SD-CG1 4.24Å; M129-A220 HydrophobicContact CE-CB 3.21Å; M129-A220 HydrophobicContact SD-CB 3.43Å; M129-A220 WeakPolarHBondContact SD-CB 3.29Å; M129-I224 HydrophobicContact CB-CD1 4.29Å; M129-I224 HydrophobicContact CB-CG1 4.37Å
130I94.5Very high92.8Very high0 Ų050.3 Ų50.30%026%0.259CS..Hα-helixtrans-64.7-48.1176-72.9170.3000110.7R126 T127 I128 T132 G133 S134 I224 V237 L238 N241R126-I130 HydrophobicContact CG-CD1 3.73Å; R126-I130 HydrophobicContact CG-CG1 4.28Å; R126-I130 WeakPolarHBondContact O-CB 3.36Å; R126-I130 VanDerWaalsContact O-CG1 3.26Å; R126-I130 WeakPolarHBondContact O-CG1 3.2Å; R126-I130 PolarHBondContact O-N 2.86Å; T127-I130 PolarHBondContact O-N 3.1Å; I128-I130 PolarHBondContact O-N 2.9Å; I130-T132 VanDerWaalsContact C-N 3.32Å; I130-T132 PolarHBondContact O-N 2.92Å; I130-G133 PolarHBondContact O-N 3.47Å; I130-S134 WeakPolarHBondContact O-CB 3.44Å; I130-S134 PolarHBondContact O-N 2.87Å; I130-I224 HydrophobicContact CB-CD1 4.42Å; I130-I224 HydrophobicContact CD1-CD1 4.28Å; I130-I224 HydrophobicContact CG1-CD1 3.33Å; I130-V237 HydrophobicContact CB-CG1 4.34Å; I130-V237 HydrophobicContact CD1-CG1 4.03Å; I130-V237 HydrophobicContact CG1-CG1 3.92Å; I130-V237 HydrophobicContact CG2-CB 4.14Å; I130-V237 HydrophobicContact CG2-CG1 3.55Å; I130-L238 HydrophobicContact CD1-CD1 3.86Å; I130-L238 HydrophobicContact CG2-CB 4.34Å; I130-N241 HydrophobicContact CD1-CB 3.89Å
131F94.6Very high92.4Very high91 Ų9153 Ų5340%0.39927%0.274SS..Hα-helixtrans-65.9-37.8177.5-76-58.6000112W10 T127 I128 S134 W135 L238W10-F131 AromaticContact CH2-CE1 3.98Å; W10-F131 HydrophobicContact CH2-CE1 3.98Å; W10-F131 AromaticContact CH2-CZ 3.67Å; W10-F131 HydrophobicContact CH2-CZ 3.67Å; W10-F131 AromaticContact CZ3-CZ 3.95Å; W10-F131 HydrophobicContact CZ3-CZ 3.95Å; T127-F131 HydrophobicContact CG2-CD2 3.72Å; T127-F131 HydrophobicContact CG2-CE2 3.48Å; T127-F131 VanDerWaalsContact CG2-CE2 3.48Å; T127-F131 WeakPolarHBondContact O-CD2 3.29Å; T127-F131 PolarHBondContact O-N 2.94Å; T127-F131 VanDerWaalsContact O-N 3.07Å; I128-F131 PolarHBondContact O-N 3.13Å; F131-S134 PolarHBondContact O-N 3.47Å; F131-W135 WeakPolarHBondContact O-CB 3.43Å; F131-W135 PolarHBondContact O-N 2.91Å; F131-L238 HydrophobicContact CE2-CD2 4.37Å; F131-L238 HydrophobicContact CZ-CD2 4.26Å
132T94.5Very high92.3Very high67 Ų6759.8 Ų59.841%0.41129%0.294SS..Hα-helixtrans-62.5-46174.3-55.60000111I128 M129 I130 W135 L136I128-T132 WeakPolarHBondContact O-CB 3.46Å; I128-T132 PolarHBondContact O-N 3.48Å; I128-T132 PolarHBondContact O-OG1 3.42Å; M129-T132 PolarHBondContact O-N 3.34Å; I130-T132 VanDerWaalsContact C-N 3.32Å; I130-T132 PolarHBondContact O-N 2.92Å; T132-W135 PolarHBondContact O-N 3.44Å; T132-L136 HydrophobicContact CG2-CD1 4.15Å; T132-L136 WeakPolarHBondContact O-CB 3.17Å; T132-L136 WeakPolarHBondContact O-CG 3.47Å; T132-L136 PolarHBondContact O-N 3.23Å
133G92.2Very high92.2Very high4 Ų460.7 Ų60.74%0.04130%0.298CS..Hα-helixtrans-63.9-41.6176.700000112.7M129 I130 L136 I137M129-G133 PolarHBondContact O-N 3.45Å; I130-G133 PolarHBondContact O-N 3.47Å; G133-L136 PolarHBondContact O-N 2.72Å; G133-I137 VanDerWaalsContact O-CG1 3.31Å; G133-I137 WeakPolarHBondContact O-CG1 3.48Å; G133-I137 PolarHBondContact O-N 2.85Å
134S92.2Very high92.1Very high15 Ų1561.1 Ų61.111%0.10530%0.301CS..Hα-helixtrans-62.7-43.9175.8177.60000111.3I130 F131 I137 S138 F228I130-S134 WeakPolarHBondContact O-CB 3.44Å; I130-S134 PolarHBondContact O-N 2.87Å; F131-S134 PolarHBondContact O-N 3.47Å; S134-I137 PolarHBondContact O-N 3.46Å; S134-S138 WeakPolarHBondContact O-CB 3.34Å; S134-S138 PolarHBondContact O-N 3.24Å; S134-F228 VanDerWaalsContact N-CZ 3.33Å
135W92.2Very high92Very high156 Ų15660.4 Ų60.459%0.59129%0.289SS*.Hα-helixtrans-61.4-46.9174.5174.673.9000111.6F131 T132 I137 S138 Q139F131-W135 WeakPolarHBondContact O-CB 3.43Å; F131-W135 PolarHBondContact O-N 2.91Å; T132-W135 PolarHBondContact O-N 3.44Å; W135-I137 PolarHBondContact O-N 2.82Å; W135-S138 PolarHBondContact O-N 3.42Å; W135-S138 PolarHBondContact O-OG 2.78Å; W135-Q139 HydrophobicContact CZ2-CG 4.46Å; W135-Q139 WeakPolarHBondContact O-CG 3.36Å; W135-Q139 PolarHBondContact O-N 3.35Å
136L91.1Very high92Very high51 Ų5161.5 Ų61.527%0.26730%0.295SS..Hα-helixtrans-58-48.9177.5-78.3164000112.3T132 G133 S138 Q139 F140 I143T132-L136 HydrophobicContact CG2-CD1 4.15Å; T132-L136 WeakPolarHBondContact O-CB 3.17Å; T132-L136 WeakPolarHBondContact O-CG 3.47Å; T132-L136 PolarHBondContact O-N 3.23Å; G133-L136 PolarHBondContact O-N 2.72Å; L136-S138 VanDerWaalsContact C-N 3.3Å; L136-S138 PolarHBondContact O-N 3.2Å; L136-Q139 PolarHBondContact O-N 3.18Å; L136-F140 PolarHBondContact O-N 2.99Å; L136-I143 HydrophobicContact CB-CD1 3.92Å; L136-I143 HydrophobicContact CD1-CD1 4.42Å; L136-I143 HydrophobicContact CD2-CD1 4.41Å; L136-I143 HydrophobicContact CG-CD1 4.49Å
137I89.2Confident92.1Very high1 Ų162.8 Ų62.81%0.00530%0.301CS..Hα-helixtrans-63.2-39.4179-65.5162000110.5M1 G133 S134 W135 Q139 F140 D141 I143 L144 F147 F228 T232M1-I137 HydrophobicContact CE-CB 4.35Å; M1-I137 HydrophobicContact CE-CG2 3.67Å; G133-I137 VanDerWaalsContact O-CG1 3.31Å; G133-I137 WeakPolarHBondContact O-CG1 3.48Å; G133-I137 PolarHBondContact O-N 2.85Å; S134-I137 PolarHBondContact O-N 3.46Å; W135-I137 PolarHBondContact O-N 2.82Å; I137-Q139 PolarHBondContact O-N 2.67Å; I137-F140 CarbonylContact O-C 3.46Å; I137-F140 PolarHBondContact O-N 3.42Å; I137-D141 PolarHBondContact O-N 3.03Å; I137-I143 HydrophobicContact CB-CG2 4.21Å; I137-I143 HydrophobicContact CG1-CG2 3.5Å; I137-I143 VanDerWaalsContact CG1-CG2 3.5Å; I137-L144 HydrophobicContact CD1-CD2 3.85Å; I137-L144 HydrophobicContact CG1-CD2 3.99Å; I137-L144 HydrophobicContact CG2-CD2 3.99Å; I137-L144 HydrophobicContact CG2-CG 4.28Å; I137-F147 HydrophobicContact CD1-CE2 4.11Å; I137-F147 HydrophobicContact CG1-CE2 4.24Å; I137-F228 HydrophobicContact CD1-CB 3.59Å; I137-F228 HydrophobicContact CD1-CD1 3.38Å; I137-F228 HydrophobicContact CD1-CD2 3.46Å; I137-F228 VanDerWaalsContact CD1-CD2 3.46Å; I137-F228 HydrophobicContact CD1-CE1 3.86Å; I137-F228 HydrophobicContact CD1-CE2 3.93Å; I137-F228 HydrophobicContact CD1-CG 3.18Å; I137-F228 HydrophobicContact CD1-CZ 4.13Å; I137-T232 HydrophobicContact CG2-CG2 4.48Å
138S87.7Confident92.1Very high50 Ų5061.1 Ų61.135%0.3529%0.29SS..Hα-helixtrans-62.3-25.4178.180.30000114.2S134 W135 L136S134-S138 WeakPolarHBondContact O-CB 3.34Å; S134-S138 PolarHBondContact O-N 3.24Å; W135-S138 PolarHBondContact O-N 3.42Å; W135-S138 PolarHBondContact O-OG 2.78Å; L136-S138 VanDerWaalsContact C-N 3.3Å; L136-S138 PolarHBondContact O-N 3.2Å
139Q90.6Very high92.1Very high117 Ų11759 Ų5955%0.54729%0.287SS..Hα-helixtrans-93.9-30.4177.3-61.6-55-63.500112W135 L136 I137W135-Q139 HydrophobicContact CZ2-CG 4.46Å; W135-Q139 WeakPolarHBondContact O-CG 3.36Å; W135-Q139 PolarHBondContact O-N 3.35Å; L136-Q139 PolarHBondContact O-N 3.18Å; I137-Q139 PolarHBondContact O-N 2.67Å
140F90.4Very high92.2Very high96 Ų9660.1 Ų60.142%0.42129%0.291SS..  trans-138.180.3-169.2-56-64.9000110.8L136 I137 W142 I143L136-F140 PolarHBondContact O-N 2.99Å; I137-F140 CarbonylContact O-C 3.46Å; I137-F140 PolarHBondContact O-N 3.42Å; F140-W142 AromaticContact CD1-NE1 3.58Å; F140-W142 AromaticContact CG-NE1 3.92Å; F140-W142 PolarHBondContact O-N 2.96Å; F140-W142 VanDerWaalsContact O-N 3.12Å; F140-I143 HydrophobicContact CB-CB 4.26Å; F140-I143 WeakPolarHBondContact O-CB 3.43Å; F140-I143 WeakPolarHBondContact O-CG2 3.47Å; F140-I143 PolarHBondContact O-N 3.43Å
141D82.4Confident92.1Very high113 Ų11360.1 Ų60.160%0.60429%0.291SS*.THydrogen-bonded Turntrans-57.4-32.1179.4-66.2-42.5000112.4I137 I143 L144I137-D141 PolarHBondContact O-N 3.03Å; D141-I143 PolarHBondContact O-N 3.5Å; D141-I143 VanDerWaalsContact O-N 3.11Å; D141-L144 WeakPolarHBondContact O-CB 3.35Å; D141-L144 WeakPolarHBondContact O-CG 3.43Å; D141-L144 PolarHBondContact O-N 3.26Å; D141-L144 VanDerWaalsContact O-N 3.09Å
142W90.9Very high92.2Very high159 Ų15958.3 Ų58.360%0.60229%0.285SS*.THydrogen-bonded Turntrans-63-16.9176.471.1-89.3000113.6F140 L144 Y145 I146F140-W142 AromaticContact CD1-NE1 3.58Å; F140-W142 AromaticContact CG-NE1 3.92Å; F140-W142 PolarHBondContact O-N 2.96Å; F140-W142 VanDerWaalsContact O-N 3.12Å; W142-L144 PolarHBondContact O-N 2.96Å; W142-Y145 WeakPolarHBondContact O-CB 3.46Å; W142-Y145 PolarHBondContact O-N 3.37Å; W142-I146 HydrophobicContact CE3-CD1 3.9Å; W142-I146 HydrophobicContact CE3-CG1 4.22Å; W142-I146 HydrophobicContact CH2-CD1 3.54Å; W142-I146 HydrophobicContact CZ3-CD1 3.11Å; W142-I146 HydrophobicContact CZ3-CG1 3.78Å
143I91.9Very high92.3Very high19 Ų1961.2 Ų61.210%0.09729%0.292CS..Hα-helixtrans-60.2-25.6174.4-154173.9000111.4L136 I137 F140 D141 Y145 I146 F147L136-I143 HydrophobicContact CB-CD1 3.92Å; L136-I143 HydrophobicContact CD1-CD1 4.42Å; L136-I143 HydrophobicContact CD2-CD1 4.41Å; L136-I143 HydrophobicContact CG-CD1 4.49Å; I137-I143 HydrophobicContact CB-CG2 4.21Å; I137-I143 HydrophobicContact CG1-CG2 3.5Å; I137-I143 VanDerWaalsContact CG1-CG2 3.5Å; F140-I143 HydrophobicContact CB-CB 4.26Å; F140-I143 WeakPolarHBondContact O-CB 3.43Å; F140-I143 WeakPolarHBondContact O-CG2 3.47Å; F140-I143 PolarHBondContact O-N 3.43Å; D141-I143 PolarHBondContact O-N 3.5Å; D141-I143 VanDerWaalsContact O-N 3.11Å; I143-Y145 PolarHBondContact O-N 3.45Å; I143-I146 WeakPolarHBondContact O-CB 3.31Å; I143-I146 PolarHBondContact O-N 2.82Å; I143-I146 VanDerWaalsContact O-N 3.09Å; I143-F147 HydrophobicContact CD1-CE1 3.99Å; I143-F147 HydrophobicContact CD1-CZ 3.88Å; I143-F147 HydrophobicContact CG1-CD1 4.26Å; I143-F147 HydrophobicContact CG1-CE1 3.94Å; I143-F147 HydrophobicContact CG1-CZ 4.14Å; I143-F147 HydrophobicContact CG2-CE2 4.42Å; I143-F147 WeakPolarHBondContact O-CB 3.32Å; I143-F147 WeakPolarHBondContact O-CG 3.47Å; I143-F147 PolarHBondContact O-N 3.32Å
144L90.1Very high92.3Very high27 Ų2761.9 Ų61.914%0.14130%0.295CS..Hα-helixtrans-60.5-32.3176.2-62.3175.9000111.4I137 D141 W142 F147 G148 F228 M280I137-L144 HydrophobicContact CD1-CD2 3.85Å; I137-L144 HydrophobicContact CG1-CD2 3.99Å; I137-L144 HydrophobicContact CG2-CD2 3.99Å; I137-L144 HydrophobicContact CG2-CG 4.28Å; D141-L144 WeakPolarHBondContact O-CB 3.35Å; D141-L144 WeakPolarHBondContact O-CG 3.43Å; D141-L144 PolarHBondContact O-N 3.26Å; D141-L144 VanDerWaalsContact O-N 3.09Å; W142-L144 PolarHBondContact O-N 2.96Å; L144-F147 PolarHBondContact O-N 3.09Å; L144-G148 PolarHBondContact O-N 3.46Å; L144-F228 HydrophobicContact CD2-CB 4.49Å; L144-M280 HydrophobicContact CB-CE 3.85Å; L144-M280 HydrophobicContact CB-CG 4.26Å; L144-M280 HydrophobicContact CD2-CE 3.26Å; L144-M280 HydrophobicContact CG-CE 4.13Å; L144-M280 VanDerWaalsContact O-CG 3.24Å; L144-M280 WeakPolarHBondContact O-CG 3.25Å
145Y93.3Very high92.3Very high67 Ų6761.1 Ų61.126%0.26329%0.29SS..Hα-helixtrans-70.1-40.1174.3-69.2-82.6000112.7W142 I143 F147 G148 A149 L281 D284W142-Y145 WeakPolarHBondContact O-CB 3.46Å; W142-Y145 PolarHBondContact O-N 3.37Å; I143-Y145 PolarHBondContact O-N 3.45Å; Y145-F147 VanDerWaalsContact C-N 3.29Å; Y145-F147 PolarHBondContact O-N 3.47Å; Y145-G148 PolarHBondContact O-N 2.99Å; Y145-A149 WeakPolarHBondContact O-CB 2.95Å; Y145-A149 PolarHBondContact O-N 3.42Å; Y145-L281 HydrophobicContact CD1-CD2 4.16Å; Y145-L281 VanDerWaalsContact CE1-O 3.23Å; Y145-L281 WeakPolarHBondContact CE1-O 3.25Å; Y145-L281 WeakPolarHBondContact O-CD2 3.46Å; Y145-D284 VanDerWaalsContact OH-CB 3.28Å; Y145-D284 WeakPolarHBondContact OH-CB 3.18Å; Y145-D284 PolarHBondContact OH-OD2 2.81Å
146I95Very high92.5Very high81 Ų8157 Ų5742%0.41528%0.282SS..Hα-helixtrans-59.6-48.6173.1-67.9174.8000109W142 I143 G148 A149 F150W142-I146 HydrophobicContact CE3-CD1 3.9Å; W142-I146 HydrophobicContact CE3-CG1 4.22Å; W142-I146 HydrophobicContact CH2-CD1 3.54Å; W142-I146 HydrophobicContact CZ3-CD1 3.11Å; W142-I146 HydrophobicContact CZ3-CG1 3.78Å; I143-I146 WeakPolarHBondContact O-CB 3.31Å; I143-I146 PolarHBondContact O-N 2.82Å; I143-I146 VanDerWaalsContact O-N 3.09Å; I146-G148 VanDerWaalsContact C-N 3.33Å; I146-G148 PolarHBondContact O-N 2.75Å; I146-A149 PolarHBondContact O-N 2.81Å; I146-F150 WeakPolarHBondContact O-CB 3.06Å; I146-F150 PolarHBondContact O-N 3.07Å
147F94.9Very high92.5Very high32 Ų3260.8 Ų60.814%0.1430%0.296CS..Hα-helixtrans-58.3-45.1178.4-79.97.5000111.3I137 I143 L144 Y145 F150 L151 P225 M280I137-F147 HydrophobicContact CD1-CE2 4.11Å; I137-F147 HydrophobicContact CG1-CE2 4.24Å; I143-F147 HydrophobicContact CD1-CE1 3.99Å; I143-F147 HydrophobicContact CD1-CZ 3.88Å; I143-F147 HydrophobicContact CG1-CD1 4.26Å; I143-F147 HydrophobicContact CG1-CE1 3.94Å; I143-F147 HydrophobicContact CG1-CZ 4.14Å; I143-F147 HydrophobicContact CG2-CE2 4.42Å; I143-F147 WeakPolarHBondContact O-CB 3.32Å; I143-F147 WeakPolarHBondContact O-CG 3.47Å; I143-F147 PolarHBondContact O-N 3.32Å; L144-F147 PolarHBondContact O-N 3.09Å; Y145-F147 VanDerWaalsContact C-N 3.29Å; Y145-F147 PolarHBondContact O-N 3.47Å; F147-F150 PolarHBondContact O-N 2.81Å; F147-L151 VanDerWaalsContact O-CG 3.3Å; F147-L151 WeakPolarHBondContact O-CG 3.09Å; F147-L151 PolarHBondContact O-N 3.28Å; F147-P225 HydrophobicContact CB-CB 3.73Å; F147-P225 HydrophobicContact CB-CG 4.17Å; F147-P225 HydrophobicContact CD1-CB 4.41Å; F147-P225 HydrophobicContact CD1-CG 3.9Å; F147-P225 HydrophobicContact CD2-CB 3.97Å; F147-P225 HydrophobicContact CD2-CG 3.96Å; F147-P225 HydrophobicContact CE1-CG 4.26Å; F147-P225 HydrophobicContact CE2-CG 4.33Å; F147-P225 HydrophobicContact CG-CB 3.78Å; F147-P225 HydrophobicContact CG-CG 3.73Å; F147-P225 HydrophobicContact CZ-CG 4.47Å; F147-M280 HydrophobicContact CB-CE 3.49Å; F147-M280 VanDerWaalsContact CB-CE 3.49Å; F147-M280 HydrophobicContact CB-SD 3.57Å; F147-M280 VanDerWaalsContact CB-SD 3.57Å; F147-M280 HydrophobicContact CD2-CE 3.97Å; F147-M280 HydrophobicContact CG-CE 4.26Å
148G95.2Very high92.4Very high0 Ų062.5 Ų62.50%031%0.305CS..Hα-helixtrans-63.5-45.6176.500000113.3L144 Y145 I146 F150 L151 L152 G277 M280L144-G148 PolarHBondContact O-N 3.46Å; Y145-G148 PolarHBondContact O-N 2.99Å; I146-G148 VanDerWaalsContact C-N 3.33Å; I146-G148 PolarHBondContact O-N 2.75Å; G148-F150 VanDerWaalsContact C-N 3.32Å; G148-F150 PolarHBondContact O-N 2.78Å; G148-L151 PolarHBondContact O-N 2.91Å; G148-L152 WeakPolarHBondContact O-CB 3.18Å; G148-L152 PolarHBondContact O-N 3.45Å; G148-G277 VanDerWaalsContact O-CA 3.3Å; G148-G277 WeakPolarHBondContact O-CA 3.3Å; G148-M280 PolarHBondContact N-SD 3.02Å
149A96.8Very high92.5Very high50 Ų5062.1 Ų62.141%0.41331%0.305SS..Hα-helixtrans-63.5-40.3176.800000111.7Y145 I146 L152 F153 L281Y145-A149 WeakPolarHBondContact O-CB 2.95Å; Y145-A149 PolarHBondContact O-N 3.42Å; I146-A149 PolarHBondContact O-N 2.81Å; A149-L152 PolarHBondContact O-N 2.83Å; A149-F153 WeakPolarHBondContact O-CB 3.2Å; A149-F153 PolarHBondContact O-N 2.99Å; A149-L281 HydrophobicContact CB-CD2 4.13Å
150F96.1Very high92.5Very high67 Ų6762.6 Ų62.629%0.29431%0.31SS..Hα-helixtrans-63.3-47.6177.4178-100.1000111.3I146 F147 G148 L152 F153 T154 V221 D222I146-F150 WeakPolarHBondContact O-CB 3.06Å; I146-F150 PolarHBondContact O-N 3.07Å; F147-F150 PolarHBondContact O-N 2.81Å; G148-F150 VanDerWaalsContact C-N 3.32Å; G148-F150 PolarHBondContact O-N 2.78Å; F150-L152 VanDerWaalsContact C-N 3.35Å; F150-L152 PolarHBondContact O-N 3.5Å; F150-F153 WeakPolarHBondContact O-CB 3.31Å; F150-F153 PolarHBondContact O-N 3.41Å; F150-T154 HydrophobicContact CD1-CG2 4.33Å; F150-T154 HydrophobicContact CD2-CG2 4.32Å; F150-T154 HydrophobicContact CE1-CG2 3.83Å; F150-T154 HydrophobicContact CE2-CG2 3.83Å; F150-T154 HydrophobicContact CZ-CG2 3.55Å; F150-T154 WeakPolarHBondContact O-CG2 3.43Å; F150-T154 PolarHBondContact O-N 3.48Å; F150-T154 PolarHBondContact O-OG1 3.47Å; F150-V221 HydrophobicContact CE1-CB 4.42Å; F150-V221 HydrophobicContact CE1-CG1 3.61Å; F150-V221 WeakPolarHBondContact CE1-O 3.43Å; F150-V221 HydrophobicContact CE2-CG1 4.32Å; F150-V221 HydrophobicContact CZ-CB 4.38Å; F150-V221 HydrophobicContact CZ-CG1 3.41Å; F150-V221 VanDerWaalsContact CZ-CG1 3.41Å; F150-D222 WeakPolarHBondContact CE1-OD1 3.16Å; F150-D222 WeakPolarHBondContact CZ-OD1 3.12Å
151L93.7Very high92Very high0 Ų060.3 Ų60.30%031%0.309CS..Hα-helixtrans-64.3-38.4176.8-67174.2000113.4F147 G148 F153 T154 G155 D222 P225 A226 L273 I276 M280F147-L151 VanDerWaalsContact O-CG 3.3Å; F147-L151 WeakPolarHBondContact O-CG 3.09Å; F147-L151 PolarHBondContact O-N 3.28Å; G148-L151 PolarHBondContact O-N 2.91Å; L151-F153 VanDerWaalsContact C-N 3.31Å; L151-T154 PolarHBondContact O-N 3.18Å; L151-T154 PolarHBondContact O-OG1 2.86Å; L151-G155 PolarHBondContact O-N 3.48Å; L151-D222 HydrophobicContact CD2-CB 4.08Å; L151-D222 WeakPolarHBondContact CD2-O 3.16Å; L151-P225 HydrophobicContact CD1-CB 3.82Å; L151-P225 HydrophobicContact CD2-CB 4.03Å; L151-P225 HydrophobicContact CG-CB 3.91Å; L151-A226 HydrophobicContact CD1-CB 3.99Å; L151-A226 HydrophobicContact CD2-CB 4.32Å; L151-L273 HydrophobicContact CD2-CD2 3.71Å; L151-I276 HydrophobicContact CD1-CG2 3.9Å; L151-M280 HydrophobicContact CD1-SD 4.46Å
152L96.1Very high91.2Very high53 Ų5363 Ų6328%0.27732%0.317SS..Hα-helixtrans-60.7-46.1174.4-178.559.5000110.2G148 A149 F150 V156 V274 I278 L281G148-L152 WeakPolarHBondContact O-CB 3.18Å; G148-L152 PolarHBondContact O-N 3.45Å; A149-L152 PolarHBondContact O-N 2.83Å; F150-L152 VanDerWaalsContact C-N 3.35Å; F150-L152 PolarHBondContact O-N 3.5Å; L152-V156 HydrophobicContact CD1-CG2 4.35Å; L152-V156 WeakPolarHBondContact O-CB 3.17Å; L152-V156 VanDerWaalsContact O-CG2 3.24Å; L152-V156 WeakPolarHBondContact O-CG2 3.4Å; L152-V156 PolarHBondContact O-N 3.38Å; L152-V274 HydrophobicContact CD1-CB 4.28Å; L152-V274 HydrophobicContact CD1-CG1 3.74Å; L152-V274 HydrophobicContact CD1-CG2 4.24Å; L152-I278 HydrophobicContact CD1-CD1 4.34Å; L152-I278 HydrophobicContact CD1-CG1 4Å; L152-L281 HydrophobicContact CB-CD1 4.49Å; L152-L281 HydrophobicContact CD2-CD1 3.87Å
153F95.8Very high89.7Confident128 Ų12861.6 Ų61.656%0.56132%0.318SS*.Hα-helixtrans-62.5-48.8176.7171.8-100000112.4A149 F150 L151 V156 K157A149-F153 WeakPolarHBondContact O-CB 3.2Å; A149-F153 PolarHBondContact O-N 2.99Å; F150-F153 WeakPolarHBondContact O-CB 3.31Å; F150-F153 PolarHBondContact O-N 3.41Å; L151-F153 VanDerWaalsContact C-N 3.31Å; F153-V156 PolarHBondContact O-N 2.83Å; F153-K157 HydrophobicContact CE1-CD 4.19Å; F153-K157 HydrophobicContact CZ-CD 4.2Å; F153-K157 VanDerWaalsContact O-CB 3.26Å; F153-K157 WeakPolarHBondContact O-CB 3.08Å; F153-K157 PolarHBondContact O-N 3.32Å
154T92.5Very high87.9Confident17 Ų1767.4 Ų67.410%0.10435%0.349CS..Hα-helixtrans-68.3-39-178.3620000111.9F150 L151 K157 M158 D222F150-T154 HydrophobicContact CD1-CG2 4.33Å; F150-T154 HydrophobicContact CD2-CG2 4.32Å; F150-T154 HydrophobicContact CE1-CG2 3.83Å; F150-T154 HydrophobicContact CE2-CG2 3.83Å; F150-T154 HydrophobicContact CZ-CG2 3.55Å; F150-T154 WeakPolarHBondContact O-CG2 3.43Å; F150-T154 PolarHBondContact O-N 3.48Å; F150-T154 PolarHBondContact O-OG1 3.47Å; L151-T154 PolarHBondContact O-N 3.18Å; L151-T154 PolarHBondContact O-OG1 2.86Å; T154-K157 PolarHBondContact O-N 3.46Å; T154-M158 VanDerWaalsContact O-CB 3.24Å; T154-M158 WeakPolarHBondContact O-CB 3.06Å; T154-M158 PolarHBondContact O-N 2.81Å; T154-D222 WeakPolarHBondContact CB-OD2 3.41Å; T154-D222 WeakPolarHBondContact CG2-OD2 3.32Å; T154-D222 PolarHBondContact OG1-OD2 3.49Å
155G93.1Very high85.8Confident0 Ų075.4 Ų75.40%039%0.386CS..Hα-helixtrans-60.3-47.3173.400000112.6L151 M158 A159 A270L151-G155 PolarHBondContact O-N 3.48Å; G155-M158 PolarHBondContact O-N 3.39Å; G155-A159 PolarHBondContact O-N 3.4Å; G155-A270 WeakPolarHBondContact O-CB 3.3Å
156V95.2Very high83.7Confident69 Ų6975.1 Ų75.142%0.41839%0.394SS..Hα-helixtrans-64.4-44.5176.5172.20000111.2L152 F153 M158 A159 L160 V274L152-V156 HydrophobicContact CD1-CG2 4.35Å; L152-V156 WeakPolarHBondContact O-CB 3.17Å; L152-V156 VanDerWaalsContact O-CG2 3.24Å; L152-V156 WeakPolarHBondContact O-CG2 3.4Å; L152-V156 PolarHBondContact O-N 3.38Å; F153-V156 PolarHBondContact O-N 2.83Å; V156-M158 VanDerWaalsContact C-N 3.32Å; V156-M158 PolarHBondContact O-N 3.49Å; V156-A159 PolarHBondContact O-N 3.02Å; V156-L160 HydrophobicContact CG1-CD1 3.83Å; V156-L160 HydrophobicContact CG1-CG 4.45Å; V156-L160 WeakPolarHBondContact O-CG 3.2Å; V156-L160 PolarHBondContact O-N 2.98Å; V156-L160 VanDerWaalsContact O-N 3.07Å; V156-V274 HydrophobicContact CG2-CG2 3.93Å
157K91.7Very high81.9Confident131 Ų13172.7 Ų72.757%0.5739%0.389SS*.Hα-helixtrans-60.4-42.6176.9-178.1-177.1175-174.10111.5F153 T154 A159 L160 A161F153-K157 HydrophobicContact CE1-CD 4.19Å; F153-K157 HydrophobicContact CZ-CD 4.2Å; F153-K157 VanDerWaalsContact O-CB 3.26Å; F153-K157 WeakPolarHBondContact O-CB 3.08Å; F153-K157 PolarHBondContact O-N 3.32Å; T154-K157 PolarHBondContact O-N 3.46Å; K157-A159 VanDerWaalsContact C-N 3.33Å; K157-A159 PolarHBondContact O-N 2.7Å; K157-L160 CarbonylContact O-C 3.55Å; K157-L160 PolarHBondContact O-N 3.49Å; K157-A161 VanDerWaalsContact O-CB 3.31Å; K157-A161 WeakPolarHBondContact O-CB 3.49Å; K157-A161 PolarHBondContact O-N 2.94Å
158M87.8Confident80.4Confident37 Ų3772.1 Ų72.118%0.18239%0.387CS..Hα-helixtrans-63.7-38.8178.5-172.8-176.8-158.900111.7T154 G155 V156 L160 K266 L269 A270 L273T154-M158 VanDerWaalsContact O-CB 3.24Å; T154-M158 WeakPolarHBondContact O-CB 3.06Å; T154-M158 PolarHBondContact O-N 2.81Å; G155-M158 PolarHBondContact O-N 3.39Å; V156-M158 VanDerWaalsContact C-N 3.32Å; V156-M158 PolarHBondContact O-N 3.49Å; M158-L160 VanDerWaalsContact C-N 3.34Å; M158-K266 HydrophobicContact CE-CB 3.96Å; M158-L269 HydrophobicContact CE-CB 4.05Å; M158-L269 HydrophobicContact CE-CD1 4.17Å; M158-L269 HydrophobicContact SD-CB 4.09Å; M158-A270 HydrophobicContact CB-CB 4.09Å; M158-A270 HydrophobicContact CG-CB 4.19Å; M158-A270 HydrophobicContact SD-CB 4.17Å; M158-L273 HydrophobicContact SD-CD1 4.23Å
159A89.3Confident78.6Confident42 Ų4272.5 Ų72.535%0.34739%0.39SS..Hα-helixtrans-67.6-33.917600000113G155 V156 K157 A270G155-A159 PolarHBondContact O-N 3.4Å; V156-A159 PolarHBondContact O-N 3.02Å; K157-A159 VanDerWaalsContact C-N 3.33Å; K157-A159 PolarHBondContact O-N 2.7Å; A159-A270 HydrophobicContact CB-CB 3.96Å
160L89.8Confident76.9Confident126 Ų12674.9 Ų74.966%0.6640%0.396SS*.Hα-helixtrans-91.2-13-178.9-62.6176.6000113.5V156 K157 M158 H162V156-L160 HydrophobicContact CG1-CD1 3.83Å; V156-L160 HydrophobicContact CG1-CG 4.45Å; V156-L160 WeakPolarHBondContact O-CG 3.2Å; V156-L160 PolarHBondContact O-N 2.98Å; V156-L160 VanDerWaalsContact O-N 3.07Å; K157-L160 CarbonylContact O-C 3.55Å; K157-L160 PolarHBondContact O-N 3.49Å; M158-L160 VanDerWaalsContact C-N 3.34Å; L160-H162 PolarHBondContact O-N 2.9Å
161A80.8Confident75.7Confident48 Ų4876.8 Ų76.840%0.39740%0.404SS..  trans-64.3120.7-178.900000110.3K157K157-A161 VanDerWaalsContact O-CB 3.31Å; K157-A161 WeakPolarHBondContact O-CB 3.49Å; K157-A161 PolarHBondContact O-N 2.94Å
162H64.2Low74.7Confident169 Ų16981.5 Ų81.578%0.78244%0.435SS*.  trans-67.6150.1166.1-66-62.2000109.6L160 D164L160-H162 PolarHBondContact O-N 2.9Å; H162-D164 VanDerWaalsContact C-N 3.32Å; H162-D164 PolarHBondContact O-N 3.32Å
163E60.9Low73.7Confident131 Ų13182.3 Ų82.361%0.61244%0.439SS*.  trans-6795.8175.1-66.5-177.3177.400107.8E165 K266E163-E165 PolarHBondContact O-N 3.19Å; E163-K266 IonicContact OE1-NZ 2.92Å; E163-K266 PolarHBondContact OE1-NZ 3.46Å
164D53.1Low72.8Confident140 Ų14076.3 Ų76.375%0.74941%0.413SS*.  trans-61.7104.4169.2-85.6-23.7000107.2H162 S166H162-D164 VanDerWaalsContact C-N 3.32Å; H162-D164 PolarHBondContact O-N 3.32Å; D164-S166 PolarHBondContact O-N 3.3Å; D164-S166 VanDerWaalsContact O-N 3.07Å
165E47.5Very low71.9Confident195 Ų19582.7 Ų82.791%0.91144%0.435SS*.  trans-65.2-5.3174.1-64-164169.100112.6E163 G167E163-E165 PolarHBondContact O-N 3.19Å; E165-G167 PolarHBondContact O-N 3.41Å; E165-G167 VanDerWaalsContact O-N 3.12Å
166S48.4Very low71.4Confident62 Ų6290.3 Ų90.343%0.43446%0.464SS..  trans-60.3118.4176.367.90000110.3D164D164-S166 PolarHBondContact O-N 3.3Å; D164-S166 VanDerWaalsContact O-N 3.07Å
167G57.8Low70.6Confident30 Ų3087.8 Ų87.831%0.30945%0.448SS..  trans-57.7141.917300000110.7E165 G169 D170E165-G167 PolarHBondContact O-N 3.41Å; E165-G167 VanDerWaalsContact O-N 3.12Å; G167-G169 PolarHBondContact O-N 2.96Å; G167-D170 PolarHBondContact O-N 3.13Å
168I62.7Low69.8Low20 Ų2086.9 Ų86.910%0.10344%0.441CS..G310 helixtrans-51.9-30.5-175.7-66.7-180000112.9V96 M99 L100 D170 K171 V174V96-I168 HydrophobicContact CG1-CD1 4.35Å; M99-I168 HydrophobicContact CB-CD1 3.41Å; M99-I168 VanDerWaalsContact CB-CD1 3.41Å; M99-I168 HydrophobicContact CB-CG1 4.3Å; M99-I168 HydrophobicContact CE-CD1 4.18Å; M99-I168 HydrophobicContact CG-CD1 4.44Å; M99-I168 HydrophobicContact SD-CD1 4.3Å; L100-I168 HydrophobicContact CD2-CB 4.42Å; L100-I168 HydrophobicContact CD2-CD1 4.32Å; L100-I168 HydrophobicContact CD2-CG2 3.62Å; L100-I168 HydrophobicContact CG-CD1 4.17Å; I168-D170 VanDerWaalsContact C-N 3.3Å; I168-D170 PolarHBondContact O-N 2.66Å; I168-K171 HydrophobicContact CG2-CD 4.47Å; I168-K171 VanDerWaalsContact O-CB 3.25Å; I168-K171 WeakPolarHBondContact O-CB 3.42Å; I168-K171 VanDerWaalsContact O-CG 3.32Å; I168-K171 WeakPolarHBondContact O-CG 3.07Å; I168-K171 PolarHBondContact O-N 2.91Å; I168-V174 HydrophobicContact CG2-CG2 4.31Å; I168-V174 WeakPolarHBondContact O-CG2 3.47Å
169G57.9Low69.2Low7 Ų788.5 Ų88.57%0.07247%0.467CS..G310 helixtrans-74.6-10.3-178.700000116.8Y103 G167Y103-G169 VanDerWaalsContact CE1-CA 3.47Å; Y103-G169 WeakPolarHBondContact OH-CA 3.3Å; G167-G169 PolarHBondContact O-N 2.96Å
170D60.6Low68.7Low101 Ų10193.2 Ų93.254%0.5448%0.482SS..G310 helixtrans-80.7-8.5170.2-71.3-30.6000112.6G167 I168 R175G167-D170 PolarHBondContact O-N 3.13Å; I168-D170 VanDerWaalsContact C-N 3.3Å; I168-D170 PolarHBondContact O-N 2.66Å; D170-R175 PolarHBondContact O-NH2 3.47Å
171K71.2Confident68Low106 Ų10689.8 Ų89.846%0.46146%0.464SS..SBendtrans-63.4138.9178.4-66.4-173178.6-179.10110.6I168 L173 V174 R175I168-K171 HydrophobicContact CG2-CD 4.47Å; I168-K171 VanDerWaalsContact O-CB 3.25Å; I168-K171 WeakPolarHBondContact O-CB 3.42Å; I168-K171 VanDerWaalsContact O-CG 3.32Å; I168-K171 WeakPolarHBondContact O-CG 3.07Å; I168-K171 PolarHBondContact O-N 2.91Å; K171-L173 PolarHBondContact O-N 3.41Å; K171-V174 PolarHBondContact O-N 2.72Å; K171-R175 PolarHBondContact O-N 3.31Å
172P71.5Confident67.7Low99 Ų9994.6 Ų94.664%0.64347%0.472SS*.Hα-helixtrans-53.6-34.6-178.5-14.516.6000112.8R175 W176P172-R175 PolarHBondContact O-N 2.89Å; P172-W176 VanDerWaalsContact O-CB 3.26Å; P172-W176 WeakPolarHBondContact O-CB 3.46Å; P172-W176 PolarHBondContact O-N 2.87Å
173L76.9Confident68.1Low70 Ų7088.5 Ų88.537%0.36644%0.444SS..Hα-helixtrans-62.1-43.7179.1-176.959.8000112.7K171 W176 L177 L214K171-L173 PolarHBondContact O-N 3.41Å; L173-W176 PolarHBondContact O-N 3.25Å; L173-L177 HydrophobicContact CD1-CD1 4.47Å; L173-L177 HydrophobicContact CG-CD1 4.38Å; L173-L177 WeakPolarHBondContact O-CB 3.14Å; L173-L177 VanDerWaalsContact O-CG 3.32Å; L173-L177 WeakPolarHBondContact O-CG 3.47Å; L173-L177 PolarHBondContact O-N 3.49Å; L173-L214 HydrophobicContact CD1-CD2 3.86Å; L173-L214 HydrophobicContact CD2-CD2 3.32Å; L173-L214 HydrophobicContact CD2-CG 4.23Å; L173-L214 HydrophobicContact CG-CD2 3.9Å
174V75.2Confident68.8Low2 Ų282.6 Ų82.61%0.01242%0.417CS..Hα-helixtrans-67.3-41.8178.3-178.10000110.1F104 I168 K171 L177 R178 L207 L211F104-V174 HydrophobicContact CZ-CG1 4.1Å; I168-V174 HydrophobicContact CG2-CG2 4.31Å; I168-V174 WeakPolarHBondContact O-CG2 3.47Å; K171-V174 PolarHBondContact O-N 2.72Å; V174-L177 PolarHBondContact O-N 3.03Å; V174-R178 WeakPolarHBondContact O-CB 3.23Å; V174-R178 WeakPolarHBondContact O-CG 3.34Å; V174-R178 PolarHBondContact O-N 3.32Å; V174-L207 HydrophobicContact CG1-CD2 4.37Å; V174-L211 HydrophobicContact CG1-CD1 4.38Å; V174-L211 HydrophobicContact CG2-CD1 3.9Å; V174-L211 HydrophobicContact CG2-CD2 3.93Å
175R75.4Confident69.6Low152 Ų15283.6 Ų83.657%0.57442%0.422SS*.Hα-helixtrans-64.1-41.9176.9-165.8-179.3-60127.58.4112D170 K171 P172 R178 G179D170-R175 PolarHBondContact O-NH2 3.47Å; K171-R175 PolarHBondContact O-N 3.31Å; P172-R175 PolarHBondContact O-N 2.89Å; R175-R178 PolarHBondContact O-N 3.01Å; R175-G179 PolarHBondContact O-N 2.9Å
176W81.2Confident70.7Confident160 Ų16078.5 Ų78.561%0.60641%0.405SS*.Hα-helixtrans-63.5-46.6176.7-179.982.6000111.6P172 L173 R178 G179 H180P172-W176 VanDerWaalsContact O-CB 3.26Å; P172-W176 WeakPolarHBondContact O-CB 3.46Å; P172-W176 PolarHBondContact O-N 2.87Å; L173-W176 PolarHBondContact O-N 3.25Å; W176-R178 PolarHBondContact O-N 3.43Å; W176-G179 PolarHBondContact O-N 3.5Å; W176-H180 PolarHBondContact O-N 2.83Å
177L79.6Confident71.6Confident16 Ų1677.8 Ų77.88%0.08440%0.396CS..Hα-helixtrans-62.4-40.4175.9-73171.4000112.4L173 V174 G179 H180 L181 L207 I210 L211L173-L177 HydrophobicContact CD1-CD1 4.47Å; L173-L177 HydrophobicContact CG-CD1 4.38Å; L173-L177 WeakPolarHBondContact O-CB 3.14Å; L173-L177 VanDerWaalsContact O-CG 3.32Å; L173-L177 WeakPolarHBondContact O-CG 3.47Å; L173-L177 PolarHBondContact O-N 3.49Å; V174-L177 PolarHBondContact O-N 3.03Å; L177-G179 VanDerWaalsContact C-N 3.32Å; L177-G179 PolarHBondContact O-N 2.68Å; L177-H180 PolarHBondContact O-N 3.44Å; L177-L181 WeakPolarHBondContact O-CB 3.21Å; L177-L181 PolarHBondContact O-N 3.27Å; L177-L207 HydrophobicContact CB-CD1 3.75Å; L177-L207 HydrophobicContact CD1-CD1 4.08Å; L177-I210 HydrophobicContact CD1-CG2 4.09Å; L177-I210 HydrophobicContact CD2-CG2 4.43Å; L177-L211 HydrophobicContact CD1-CD2 3.72Å; L177-L211 HydrophobicContact CD1-CG 4.42Å
178R74Confident71.9Confident111 Ų11178.9 Ų78.942%0.41939%0.394SS..Hα-helixtrans-63-35.6174-76.4-176.4-176.4-172.45.4113.1V174 R175 W176 M183 L207V174-R178 WeakPolarHBondContact O-CB 3.23Å; V174-R178 WeakPolarHBondContact O-CG 3.34Å; V174-R178 PolarHBondContact O-N 3.32Å; R175-R178 PolarHBondContact O-N 3.01Å; W176-R178 PolarHBondContact O-N 3.43Å; R178-M183 HydrophobicContact CB-CE 4.26Å; R178-M183 HydrophobicContact CG-CE 3.82Å; R178-M183 HydrophobicContact CG-SD 3.93Å; R178-L207 HydrophobicContact CG-CD2 3.8Å
179G74.7Confident72.2Confident71 Ų7183.3 Ų83.373%0.73242%0.418SS*.Hα-helixtrans-73.9-31175.700000113.6R175 W176 L177R175-G179 PolarHBondContact O-N 2.9Å; W176-G179 PolarHBondContact O-N 3.5Å; L177-G179 VanDerWaalsContact C-N 3.32Å; L177-G179 PolarHBondContact O-N 2.68Å
180H79.3Confident72.8Confident141 Ų14187.4 Ų87.465%0.65344%0.436SS*.Hα-helixtrans-87.6-26.8-176.3-157.678.8000113.8W176 L177W176-H180 PolarHBondContact O-N 2.83Å; L177-H180 PolarHBondContact O-N 3.44Å
181L75.5Confident73.4Confident54 Ų5487.5 Ų87.528%0.28343%0.433SS..SBendtrans-101135.8179.9-62.7171.7000111L177 M183 I210L177-L181 WeakPolarHBondContact O-CB 3.21Å; L177-L181 PolarHBondContact O-N 3.27Å; L181-M183 HydrophobicContact CB-CE 3.87Å; L181-M183 HydrophobicContact CB-CG 4.27Å; L181-M183 HydrophobicContact CD1-CE 3.96Å; L181-M183 HydrophobicContact CG-CE 4.49Å; L181-M183 PolarHBondContact O-N 3.36Å; L181-I210 HydrophobicContact CD1-CD1 3.83Å
182R74.7Confident73.7Confident149 Ų14983.5 Ų83.556%0.56242%0.415SS*.  trans-69.6101.3169.8-66.1179.2178.8-178.3-1.5108.7L199 Y201 A202R182-L199 VanDerWaalsContact NH1-CD2 3.3Å; R182-Y201 HydrophobicContact CB-CD1 3.96Å; R182-Y201 HydrophobicContact CB-CE1 4.2Å; R182-Y201 CarbonylContact O-C 3.47Å; R182-Y201 VanDerWaalsContact O-CA 3.23Å; R182-Y201 WeakPolarHBondContact O-CA 3.36Å; R182-A202 PolarHBondContact O-N 2.93Å
183M73Confident74.1Confident41 Ų4183.7 Ų83.720%0.20241%0.406CS..BIsolated β-bridgetrans-102.3152.2-176.7-74.5-168.3-152.400114R178 L181 Y201 A202 L207R178-M183 HydrophobicContact CB-CE 4.26Å; R178-M183 HydrophobicContact CG-CE 3.82Å; R178-M183 HydrophobicContact CG-SD 3.93Å; L181-M183 HydrophobicContact CB-CE 3.87Å; L181-M183 HydrophobicContact CB-CG 4.27Å; L181-M183 HydrophobicContact CD1-CE 3.96Å; L181-M183 HydrophobicContact CG-CE 4.49Å; L181-M183 PolarHBondContact O-N 3.36Å; M183-Y201 WeakPolarHBondContact O-CD1 3.43Å; M183-A202 VanDerWaalsContact CA-O 3.27Å; M183-A202 WeakPolarHBondContact CA-O 3.34Å; M183-A202 HydrophobicContact CG-CB 4.41Å; M183-L207 HydrophobicContact CE-CB 3.84Å; M183-L207 HydrophobicContact CE-CD1 3.57Å; M183-L207 HydrophobicContact CE-CD2 3.61Å; M183-L207 HydrophobicContact CE-CG 3.84Å; M183-L207 HydrophobicContact SD-CB 4.1Å; M183-L207 HydrophobicContact SD-CD2 3.75Å; M183-L207 HydrophobicContact SD-CG 4.37Å
184T74.9Confident74.2Confident7 Ų781.2 Ų81.24%0.04339%0.394CS..  trans-94.2145.6162.4168.90000109.8T186 K196 A202 T203 P204T184-T186 VanDerWaalsContact C-N 3.35Å; T184-T186 PolarHBondContact OG1-O 3.3Å; T184-K196 PolarHBondContact OG1-NZ 3.37Å; T184-A202 PolarHBondContact N-O 3.07Å; T184-A202 VanDerWaalsContact N-O 3.09Å; T184-T203 HydrophobicContact CG2-CG2 3.74Å; T184-P204 WeakPolarHBondContact O-CD 3.28Å
185D69Low74.1Confident161 Ų16190.3 Ų90.386%0.86143%0.428SS*.SBendtrans-72.4-29.8-177.5-55.7-53.9000112.7
186T70.3Confident73.8Confident88 Ų8887.1 Ų87.154%0.5442%0.418SS..SBendtrans-109.2149.3-176.757.20000112.4T184 D188T184-T186 VanDerWaalsContact C-N 3.35Å; T184-T186 PolarHBondContact OG1-O 3.3Å; T186-D188 PolarHBondContact O-N 3.45Å
187I67.5Low73.4Confident48 Ų4887.2 Ų87.225%0.24643%0.43CS..  trans-70.3113.2167.6-61.5174.1000107.5L110 N189 P204 L205L110-I187 HydrophobicContact CD1-CG2 3.56Å; I187-N189 WeakPolarHBondContact CG2-O 3.38Å; I187-N189 PolarHBondContact O-N 3.49Å; I187-P204 HydrophobicContact CG1-CB 4.04Å; I187-P204 HydrophobicContact CG1-CG 4.15Å; I187-L205 HydrophobicContact CD1-CD2 4.44Å; I187-L205 HydrophobicContact CG2-CD1 4Å; I187-L205 HydrophobicContact CG2-CD2 4.34Å; I187-L205 HydrophobicContact CG2-CG 4Å
188D65.8Low73.2Confident52 Ų5288.7 Ų88.728%0.27845%0.45SS..  trans-95.291176.7-169-2.9000109.8T186 E190 H191 V194T186-D188 PolarHBondContact O-N 3.45Å; D188-E190 PolarHBondContact O-N 2.89Å; D188-H191 PolarHBondContact O-N 2.91Å; D188-V194 HydrophobicContact CB-CG2 3.62Å; D188-V194 WeakPolarHBondContact OD2-CG1 3.29Å; D188-V194 WeakPolarHBondContact OD2-CG2 3.39Å
189N68.8Low73.2Confident113 Ų11387 Ų8760%0.60445%0.449SS*.THydrogen-bonded Turntrans54.2-127.1-178.9-62.7-72.9000112L110 I187L110-N189 VanDerWaalsContact CD1-O 3.26Å; L110-N189 WeakPolarHBondContact CD1-O 3.49Å; I187-N189 WeakPolarHBondContact CG2-O 3.38Å; I187-N189 PolarHBondContact O-N 3.49Å
190E69Low73.5Confident94 Ų9488.4 Ų88.444%0.43944%0.439SS..THydrogen-bonded Turntrans-102.34.8179.8-44.9-165.5160.700113.8L110 R113 D188L110-E190 HydrophobicContact CD2-CB 4.02Å; L110-E190 HydrophobicContact CD2-CG 3.62Å; R113-E190 PolarHBondContact NE-O 3.27Å; R113-E190 PolarHBondContact NH1-O 2.91Å; R113-E190 VanDerWaalsContact NH1-O 3.16Å; R113-E190 IonicContact NH1-OE2 3.84Å; R113-E190 PolarHBondContact NH1-OE2 2.94Å; D188-E190 PolarHBondContact O-N 2.89Å
191H74.6Confident73.5Confident103 Ų10384.5 Ų84.548%0.47742%0.419SS..  trans-80.4135.3-172.1-63.4-64.2000111.4D188 V194 T203D188-H191 PolarHBondContact O-N 2.91Å; H191-V194 HydrophobicContact CB-CG2 4.34Å; H191-T203 WeakPolarHBondContact O-CB 3.05Å; H191-T203 WeakPolarHBondContact O-CG2 3.46Å; H191-T203 PolarHBondContact O-OG1 3.27Å
192F77.6Confident73.8Confident21 Ų2182.3 Ų82.39%0.09241%0.408CS..SBendtrans-80-26.9172.3-71.2-64.9000112.8R113 V114 Y117 T203 L205 M206 L209R113-F192 HydrophobicContact CG-CE2 4.13Å; R113-F192 HydrophobicContact CG-CZ 4.07Å; V114-F192 HydrophobicContact CG2-CE1 4.21Å; Y117-F192 AromaticContact CD2-CE2 3.59Å; Y117-F192 HydrophobicContact CD2-CE2 3.59Å; Y117-F192 AromaticContact CD2-CZ 3.76Å; Y117-F192 HydrophobicContact CD2-CZ 3.76Å; Y117-F192 AromaticContact CE2-CE2 3.58Å; Y117-F192 HydrophobicContact CE2-CE2 3.58Å; Y117-F192 HydrophobicContact CE2-CZ 4.19Å; Y117-F192 HydrophobicContact CG-CE2 4.48Å; F192-T203 WeakPolarHBondContact CA-OG1 3.32Å; F192-T203 PolarHBondContact O-N 3.48Å; F192-T203 PolarHBondContact O-OG1 3.3Å; F192-L205 HydrophobicContact CD1-CB 3.8Å; F192-L205 HydrophobicContact CE1-CB 3.89Å; F192-M206 HydrophobicContact CB-CB 4.19Å; F192-M206 HydrophobicContact CB-CE 3.58Å; F192-M206 HydrophobicContact CD1-CB 4.18Å; F192-M206 HydrophobicContact CD1-CE 4.41Å; F192-M206 HydrophobicContact CG-CE 4.08Å; F192-M206 WeakPolarHBondContact O-CB 3.45Å; F192-L209 HydrophobicContact CE1-CB 4.26Å; F192-L209 HydrophobicContact CE1-CD2 4.05Å; F192-L209 HydrophobicContact CZ-CD2 4.12Å
193F79.8Confident74.4Confident104 Ų10475.2 Ų75.246%0.45638%0.382SS..EExtended strand (participates in β ladder)trans-131.3139176.2-63-76.6000109.9L200 Y201 A202 M206F193-L200 HydrophobicContact CB-CD1 3.7Å; F193-L200 HydrophobicContact CB-CD2 4.47Å; F193-L200 HydrophobicContact CB-CG 4.1Å; F193-L200 HydrophobicContact CD1-CD1 4.46Å; F193-L200 HydrophobicContact CD1-CD2 3.85Å; F193-L200 HydrophobicContact CD1-CG 3.94Å; F193-L200 HydrophobicContact CE1-CD2 4.26Å; F193-L200 HydrophobicContact CG-CD1 4.3Å; F193-L200 HydrophobicContact CG-CD2 4.18Å; F193-L200 HydrophobicContact CG-CG 4.26Å; F193-Y201 CarbonylContact C-O 3.57Å; F193-Y201 VanDerWaalsContact CA-O 3.27Å; F193-Y201 WeakPolarHBondContact CA-O 3.27Å; F193-A202 HydrophobicContact CD1-CB 4.37Å; F193-A202 HydrophobicContact CE1-CB 4.27Å; F193-M206 HydrophobicContact CD2-CE 3.95Å; F193-M206 HydrophobicContact CE1-CE 4.16Å; F193-M206 HydrophobicContact CE1-CG 4.29Å; F193-M206 HydrophobicContact CE2-CE 3.14Å; F193-M206 HydrophobicContact CZ-CE 3.27Å; F193-M206 HydrophobicContact CZ-CG 4.21Å; F193-M206 HydrophobicContact CZ-SD 4.28Å
194V77.7Confident74.8Confident18 Ų1874 Ų7411%0.10938%0.377CS..EExtended strand (participates in β ladder)trans-125136.8175.5179.70000108D188 H191 K196 Y201 T203D188-V194 HydrophobicContact CB-CG2 3.62Å; D188-V194 WeakPolarHBondContact OD2-CG1 3.29Å; D188-V194 WeakPolarHBondContact OD2-CG2 3.39Å; H191-V194 HydrophobicContact CB-CG2 4.34Å; V194-K196 HydrophobicContact CG1-CG 4.08Å; V194-Y201 PolarHBondContact N-O 3.41Å; V194-Y201 PolarHBondContact O-N 3.42Å; V194-T203 HydrophobicContact CB-CG2 4.46Å; V194-T203 HydrophobicContact CG2-CG2 3.53Å
195R73.7Confident75.4Confident192 Ų19273.7 Ų73.773%0.72538%0.375SS*.EExtended strand (participates in β ladder)trans-94.1111.4174.9-157.4171.7-170.1168.2-0.4109.3G198 L199R195-G198 PolarHBondContact NE-O 2.89Å; R195-G198 PolarHBondContact NH2-O 3.48Å; R195-G198 VanDerWaalsContact NH2-O 3.16Å; R195-L199 CarbonylContact C-O 3.55Å; R195-L199 VanDerWaalsContact CA-O 3.29Å; R195-L199 WeakPolarHBondContact CA-O 3.46Å; R195-L199 WeakPolarHBondContact CG-O 3.35Å
196K68.6Low76.4Confident85 Ų8567.3 Ų67.337%0.3734%0.34SS..EExtended strand (participates in β ladder)trans-114.2128173.6-67.8-178.3175.2174.20108.4T184 V194 G198 L199 Y201T184-K196 PolarHBondContact OG1-NZ 3.37Å; V194-K196 HydrophobicContact CG1-CG 4.08Å; K196-G198 VanDerWaalsContact C-N 3.26Å; K196-G198 PolarHBondContact O-N 2.8Å; K196-L199 PolarHBondContact N-O 2.9Å; K196-L199 PolarHBondContact O-N 3.44Å; K196-Y201 HydrophobicContact CB-CD2 3.79Å; K196-Y201 HydrophobicContact CB-CE2 3.75Å; K196-Y201 HydrophobicContact CG-CD2 4.42Å
197N73.3Confident77.1Confident162 Ų16263.1 Ų63.187%0.86632%0.315SS*.THydrogen-bonded Turntrans51.440.6179-58.6-19.8000114.2L199N197-L199 PolarHBondContact O-N 3.32Å
198G74.5Confident78.2Confident48 Ų4860.9 Ų60.950%0.49530%0.303SS..THydrogen-bonded Turntrans78.9-12.2-179.300000115.3R195 K196R195-G198 PolarHBondContact NE-O 2.89Å; R195-G198 PolarHBondContact NH2-O 3.48Å; R195-G198 VanDerWaalsContact NH2-O 3.16Å; K196-G198 VanDerWaalsContact C-N 3.26Å; K196-G198 PolarHBondContact O-N 2.8Å
199L75.4Confident79.5Confident75 Ų7559.3 Ų59.339%0.39330%0.295SS..EExtended strand (participates in β ladder)trans-95.6144.5178.9-62.6175.9000111.6R182 R195 K196 N197 Y201R182-L199 VanDerWaalsContact NH1-CD2 3.3Å; R195-L199 CarbonylContact C-O 3.55Å; R195-L199 VanDerWaalsContact CA-O 3.29Å; R195-L199 WeakPolarHBondContact CA-O 3.46Å; R195-L199 WeakPolarHBondContact CG-O 3.35Å; K196-L199 PolarHBondContact N-O 2.9Å; K196-L199 PolarHBondContact O-N 3.44Å; N197-L199 PolarHBondContact O-N 3.32Å; L199-Y201 HydrophobicContact CB-CD2 4.39Å; L199-Y201 HydrophobicContact CB-CE2 3.76Å; L199-Y201 WeakPolarHBondContact O-CD2 3.47Å
200L80Confident80.6Confident100 Ų10056.5 Ų56.552%0.52428%0.279SS..EExtended strand (participates in β ladder)trans-85.1124.9175.9-16571.8000109.8F193F193-L200 HydrophobicContact CB-CD1 3.7Å; F193-L200 HydrophobicContact CB-CD2 4.47Å; F193-L200 HydrophobicContact CB-CG 4.1Å; F193-L200 HydrophobicContact CD1-CD1 4.46Å; F193-L200 HydrophobicContact CD1-CD2 3.85Å; F193-L200 HydrophobicContact CD1-CG 3.94Å; F193-L200 HydrophobicContact CE1-CD2 4.26Å; F193-L200 HydrophobicContact CG-CD1 4.3Å; F193-L200 HydrophobicContact CG-CD2 4.18Å; F193-L200 HydrophobicContact CG-CG 4.26Å
201Y78.9Confident81.7Confident60 Ų6052.5 Ų52.524%0.23526%0.261CS..EExtended strand (participates in β ladder)trans-113.3133.9174.7-70.7-98.4000109.8R182 M183 F193 V194 K196 L199R182-Y201 HydrophobicContact CB-CD1 3.96Å; R182-Y201 HydrophobicContact CB-CE1 4.2Å; R182-Y201 CarbonylContact O-C 3.47Å; R182-Y201 VanDerWaalsContact O-CA 3.23Å; R182-Y201 WeakPolarHBondContact O-CA 3.36Å; M183-Y201 WeakPolarHBondContact O-CD1 3.43Å; F193-Y201 CarbonylContact C-O 3.57Å; F193-Y201 VanDerWaalsContact CA-O 3.27Å; F193-Y201 WeakPolarHBondContact CA-O 3.27Å; V194-Y201 PolarHBondContact N-O 3.41Å; V194-Y201 PolarHBondContact O-N 3.42Å; K196-Y201 HydrophobicContact CB-CD2 3.79Å; K196-Y201 HydrophobicContact CB-CE2 3.75Å; K196-Y201 HydrophobicContact CG-CD2 4.42Å; L199-Y201 HydrophobicContact CB-CD2 4.39Å; L199-Y201 HydrophobicContact CB-CE2 3.76Å; L199-Y201 WeakPolarHBondContact O-CD2 3.47Å
202A83.3Confident82.6Confident7 Ų747.7 Ų47.76%0.05824%0.238CC..EExtended strand (participates in β ladder)trans-75.8133.7169.400000109.5R182 M183 T184 F193 M206R182-A202 PolarHBondContact O-N 2.93Å; M183-A202 VanDerWaalsContact CA-O 3.27Å; M183-A202 WeakPolarHBondContact CA-O 3.34Å; M183-A202 HydrophobicContact CG-CB 4.41Å; T184-A202 PolarHBondContact N-O 3.07Å; T184-A202 VanDerWaalsContact N-O 3.09Å; F193-A202 HydrophobicContact CD1-CB 4.37Å; F193-A202 HydrophobicContact CE1-CB 4.27Å; A202-M206 HydrophobicContact CB-CB 4.25Å; A202-M206 HydrophobicContact CB-CG 4.2Å
203T86Confident83.4Confident0 Ų048.2 Ų48.20%024%0.241CC..  trans-82163.5173.867.20000111T184 H191 F192 V194 L205 M206 L207T184-T203 HydrophobicContact CG2-CG2 3.74Å; H191-T203 WeakPolarHBondContact O-CB 3.05Å; H191-T203 WeakPolarHBondContact O-CG2 3.46Å; H191-T203 PolarHBondContact O-OG1 3.27Å; F192-T203 WeakPolarHBondContact CA-OG1 3.32Å; F192-T203 PolarHBondContact O-N 3.48Å; F192-T203 PolarHBondContact O-OG1 3.3Å; V194-T203 HydrophobicContact CB-CG2 4.46Å; V194-T203 HydrophobicContact CG2-CG2 3.53Å; T203-L205 PolarHBondContact O-N 2.89Å; T203-L205 VanDerWaalsContact O-N 3.11Å; T203-L205 PolarHBondContact OG1-N 3.03Å; T203-M206 WeakPolarHBondContact O-CB 3.35Å; T203-M206 PolarHBondContact O-N 3.38Å; T203-L207 PolarHBondContact O-N 3.18Å
204P83.1Confident84Confident15 Ų1546 Ų4610%0.09723%0.233CC..Hα-helixtrans-54-30172.1-27.335.4000112.7T184 I187 M206 L207 V208T184-P204 WeakPolarHBondContact O-CD 3.28Å; I187-P204 HydrophobicContact CG1-CB 4.04Å; I187-P204 HydrophobicContact CG1-CG 4.15Å; P204-M206 VanDerWaalsContact C-N 3.32Å; P204-M206 PolarHBondContact O-N 3.45Å; P204-L207 PolarHBondContact O-N 3.09Å; P204-V208 VanDerWaalsContact O-CG2 3.23Å; P204-V208 WeakPolarHBondContact O-CG2 3.26Å; P204-V208 PolarHBondContact O-N 3.11Å
205L86.7Confident84.6Confident1 Ų145.5 Ų45.51%0.00523%0.231CC..Hα-helixtrans-62.6-37.3175-63177000112.8V106 L110 V114 I187 F192 T203 V208 L209V106-L205 HydrophobicContact CG1-CD2 3.7Å; V106-L205 HydrophobicContact CG2-CD2 4.39Å; L110-L205 HydrophobicContact CB-CD2 4.13Å; L110-L205 HydrophobicContact CD1-CD1 4.21Å; L110-L205 HydrophobicContact CD1-CD2 4.35Å; V114-L205 HydrophobicContact CG2-CD2 4.21Å; I187-L205 HydrophobicContact CD1-CD2 4.44Å; I187-L205 HydrophobicContact CG2-CD1 4Å; I187-L205 HydrophobicContact CG2-CD2 4.34Å; I187-L205 HydrophobicContact CG2-CG 4Å; F192-L205 HydrophobicContact CD1-CB 3.8Å; F192-L205 HydrophobicContact CE1-CB 3.89Å; T203-L205 PolarHBondContact O-N 2.89Å; T203-L205 VanDerWaalsContact O-N 3.11Å; T203-L205 PolarHBondContact OG1-N 3.03Å; L205-V208 PolarHBondContact O-N 3.09Å; L205-L209 WeakPolarHBondContact O-CB 3.37Å; L205-L209 PolarHBondContact O-N 2.81Å
206M88.9Confident85.6Confident27 Ų2736.6 Ų36.613%0.13320%0.198CC..Hα-helixtrans-69.5-41.4177176.756.279.300110.5F192 F193 A202 T203 P204 V208 L209 I210F192-M206 HydrophobicContact CB-CB 4.19Å; F192-M206 HydrophobicContact CB-CE 3.58Å; F192-M206 HydrophobicContact CD1-CB 4.18Å; F192-M206 HydrophobicContact CD1-CE 4.41Å; F192-M206 HydrophobicContact CG-CE 4.08Å; F192-M206 WeakPolarHBondContact O-CB 3.45Å; F193-M206 HydrophobicContact CD2-CE 3.95Å; F193-M206 HydrophobicContact CE1-CE 4.16Å; F193-M206 HydrophobicContact CE1-CG 4.29Å; F193-M206 HydrophobicContact CE2-CE 3.14Å; F193-M206 HydrophobicContact CZ-CE 3.27Å; F193-M206 HydrophobicContact CZ-CG 4.21Å; F193-M206 HydrophobicContact CZ-SD 4.28Å; A202-M206 HydrophobicContact CB-CB 4.25Å; A202-M206 HydrophobicContact CB-CG 4.2Å; T203-M206 WeakPolarHBondContact O-CB 3.35Å; T203-M206 PolarHBondContact O-N 3.38Å; P204-M206 VanDerWaalsContact C-N 3.32Å; P204-M206 PolarHBondContact O-N 3.45Å; M206-V208 VanDerWaalsContact C-N 3.31Å; M206-V208 PolarHBondContact O-N 3.27Å; M206-L209 PolarHBondContact O-N 2.84Å; M206-L209 HydrophobicContact SD-CD2 4.37Å; M206-I210 HydrophobicContact CG-CD1 4.02Å; M206-I210 VanDerWaalsContact O-CG1 3.3Å; M206-I210 WeakPolarHBondContact O-CG1 3.32Å; M206-I210 PolarHBondContact O-N 3.25Å; M206-I210 HydrophobicContact SD-CD1 4.15Å; M206-I210 HydrophobicContact SD-CG1 4.17Å
207L87Confident86.8Confident1 Ų134.8 Ų34.81%0.00519%0.194CC..Hα-helixtrans-59.5-45173.617961.6000111.2F104 V174 L177 R178 M183 T203 P204 L209 I210 L211F104-L207 HydrophobicContact CE1-CD2 3.6Å; F104-L207 HydrophobicContact CE1-CG 4.45Å; F104-L207 HydrophobicContact CZ-CD2 3.51Å; F104-L207 HydrophobicContact CZ-CG 4.13Å; V174-L207 HydrophobicContact CG1-CD2 4.37Å; L177-L207 HydrophobicContact CB-CD1 3.75Å; L177-L207 HydrophobicContact CD1-CD1 4.08Å; R178-L207 HydrophobicContact CG-CD2 3.8Å; M183-L207 HydrophobicContact CE-CB 3.84Å; M183-L207 HydrophobicContact CE-CD1 3.57Å; M183-L207 HydrophobicContact CE-CD2 3.61Å; M183-L207 HydrophobicContact CE-CG 3.84Å; M183-L207 HydrophobicContact SD-CB 4.1Å; M183-L207 HydrophobicContact SD-CD2 3.75Å; M183-L207 HydrophobicContact SD-CG 4.37Å; T203-L207 PolarHBondContact O-N 3.18Å; P204-L207 PolarHBondContact O-N 3.09Å; L207-L209 VanDerWaalsContact C-N 3.34Å; L207-L209 PolarHBondContact O-N 2.9Å; L207-I210 PolarHBondContact O-N 2.78Å; L207-L211 HydrophobicContact CD1-CD1 4.27Å; L207-L211 HydrophobicContact CD1-CG 4.31Å; L207-L211 HydrophobicContact CG-CD1 4.05Å; L207-L211 HydrophobicContact CG-CG 4.5Å; L207-L211 VanDerWaalsContact O-CG 3.29Å; L207-L211 WeakPolarHBondContact O-CG 3.35Å; L207-L211 PolarHBondContact O-N 2.87Å
208V90.4Very high87.6Confident0 Ų031.6 Ų31.60%018%0.176CC..Hα-helixtrans-61.8-43.5177.1177.10000110.9L100 F101 F104 V106 V114 P204 L205 M206 I210 L211 V212L100-V208 HydrophobicContact CB-CG1 4.47Å; F101-V208 HydrophobicContact CD1-CG1 3.65Å; F101-V208 HydrophobicContact CE1-CG1 3.44Å; F101-V208 VanDerWaalsContact CE1-CG1 3.44Å; F104-V208 HydrophobicContact CB-CG2 3.69Å; F104-V208 HydrophobicContact CD1-CG2 4.11Å; F104-V208 HydrophobicContact CD2-CG2 3.43Å; F104-V208 VanDerWaalsContact CD2-CG2 3.43Å; F104-V208 HydrophobicContact CE2-CG2 4.05Å; F104-V208 HydrophobicContact CG-CG2 3.47Å; F104-V208 VanDerWaalsContact CG-CG2 3.47Å; V106-V208 HydrophobicContact CG2-CG2 4.09Å; V114-V208 HydrophobicContact CG1-CG1 4.15Å; P204-V208 VanDerWaalsContact O-CG2 3.23Å; P204-V208 WeakPolarHBondContact O-CG2 3.26Å; P204-V208 PolarHBondContact O-N 3.11Å; L205-V208 PolarHBondContact O-N 3.09Å; M206-V208 VanDerWaalsContact C-N 3.31Å; M206-V208 PolarHBondContact O-N 3.27Å; V208-I210 PolarHBondContact O-N 3.22Å; V208-L211 PolarHBondContact O-N 3.34Å; V208-V212 HydrophobicContact CG1-CG2 4.35Å; V208-V212 WeakPolarHBondContact O-CB 3.49Å; V208-V212 WeakPolarHBondContact O-CG2 3.33Å; V208-V212 PolarHBondContact O-N 2.81Å
209L92.6Very high88.4Confident20 Ų2031.1 Ų31.111%0.10516%0.16CC..Hα-helixtrans-58.8-47.2175.7178.660000111.6V114 F192 L205 M206 L207 L211 V212 E213V114-L209 HydrophobicContact CG1-CB 4.11Å; V114-L209 HydrophobicContact CG1-CD1 4.16Å; F192-L209 HydrophobicContact CE1-CB 4.26Å; F192-L209 HydrophobicContact CE1-CD2 4.05Å; F192-L209 HydrophobicContact CZ-CD2 4.12Å; L205-L209 WeakPolarHBondContact O-CB 3.37Å; L205-L209 PolarHBondContact O-N 2.81Å; M206-L209 PolarHBondContact O-N 2.84Å; M206-L209 HydrophobicContact SD-CD2 4.37Å; L207-L209 VanDerWaalsContact C-N 3.34Å; L207-L209 PolarHBondContact O-N 2.9Å; L209-L211 VanDerWaalsContact C-N 3.3Å; L209-L211 PolarHBondContact O-N 3.34Å; L209-V212 WeakPolarHBondContact O-CB 3.14Å; L209-V212 PolarHBondContact O-N 3.44Å; L209-E213 HydrophobicContact CD1-CG 4.37Å; L209-E213 WeakPolarHBondContact O-CG 3.46Å; L209-E213 PolarHBondContact O-N 2.81Å
210I92.2Very high89.2Confident53 Ų5327.7 Ų27.727%0.27214%0.142SC..Hα-helixtrans-59.1-42.7176.6-68.1165.2000110.9L177 L181 M206 L207 V208 E213 L214L177-I210 HydrophobicContact CD1-CG2 4.09Å; L177-I210 HydrophobicContact CD2-CG2 4.43Å; L181-I210 HydrophobicContact CD1-CD1 3.83Å; M206-I210 HydrophobicContact CG-CD1 4.02Å; M206-I210 VanDerWaalsContact O-CG1 3.3Å; M206-I210 WeakPolarHBondContact O-CG1 3.32Å; M206-I210 PolarHBondContact O-N 3.25Å; M206-I210 HydrophobicContact SD-CD1 4.15Å; M206-I210 HydrophobicContact SD-CG1 4.17Å; L207-I210 PolarHBondContact O-N 2.78Å; V208-I210 PolarHBondContact O-N 3.22Å; I210-E213 PolarHBondContact O-N 3.23Å; I210-L214 WeakPolarHBondContact O-CB 3.26Å; I210-L214 PolarHBondContact O-N 3.41Å
211L91.9Very high89.8Confident11 Ų1126.5 Ų26.56%0.05814%0.139CC..Hα-helixtrans-67.9-34.8178.6-69.5172.3000112.6L100 F104 V174 L177 L207 V208 L209 S215L100-L211 HydrophobicContact CD1-CB 3.84Å; L100-L211 HydrophobicContact CD2-CB 3.88Å; L100-L211 HydrophobicContact CD2-CD1 3.72Å; L100-L211 HydrophobicContact CD2-CG 4.41Å; F104-L211 HydrophobicContact CE2-CD1 3.69Å; F104-L211 HydrophobicContact CZ-CD1 3.96Å; V174-L211 HydrophobicContact CG1-CD1 4.38Å; V174-L211 HydrophobicContact CG2-CD1 3.9Å; V174-L211 HydrophobicContact CG2-CD2 3.93Å; L177-L211 HydrophobicContact CD1-CD2 3.72Å; L177-L211 HydrophobicContact CD1-CG 4.42Å; L207-L211 HydrophobicContact CD1-CD1 4.27Å; L207-L211 HydrophobicContact CD1-CG 4.31Å; L207-L211 HydrophobicContact CG-CD1 4.05Å; L207-L211 HydrophobicContact CG-CG 4.5Å; L207-L211 VanDerWaalsContact O-CG 3.29Å; L207-L211 WeakPolarHBondContact O-CG 3.35Å; L207-L211 PolarHBondContact O-N 2.87Å; V208-L211 PolarHBondContact O-N 3.34Å; L209-L211 VanDerWaalsContact C-N 3.3Å; L209-L211 PolarHBondContact O-N 3.34Å; L211-S215 VanDerWaalsContact O-CB 3.3Å; L211-S215 WeakPolarHBondContact O-CB 3.32Å; L211-S215 PolarHBondContact O-N 2.95Å; L211-S215 PolarHBondContact O-OG 3.38Å
212V93.1Very high90.3Very high1 Ų125.3 Ų25.31%0.00614%0.137CC..Hα-helixtrans-62.9-51.5173160.50000110.5W97 L100 V114 V208 L209 L214 S215 D216W97-V212 HydrophobicContact CG-CG2 4.29Å; W97-V212 HydrophobicContact CZ2-CG1 4.26Å; L100-V212 HydrophobicContact CD1-CG2 3.93Å; V114-V212 HydrophobicContact CG1-CG2 4.38Å; V208-V212 HydrophobicContact CG1-CG2 4.35Å; V208-V212 WeakPolarHBondContact O-CB 3.49Å; V208-V212 WeakPolarHBondContact O-CG2 3.33Å; V208-V212 PolarHBondContact O-N 2.81Å; L209-V212 WeakPolarHBondContact O-CB 3.14Å; L209-V212 PolarHBondContact O-N 3.44Å; V212-L214 VanDerWaalsContact C-N 3.34Å; V212-L214 PolarHBondContact O-N 3.04Å; V212-S215 PolarHBondContact O-N 3.19Å; V212-S215 PolarHBondContact O-OG 2.96Å; V212-D216 PolarHBondContact O-N 3.31Å
213E93.7Very high90.8Very high32 Ų3225.1 Ų25.115%0.1514%0.135CC..Hα-helixtrans-61-43.3177.4-66.6-64.3160.500111.8G118 G121 A122 L125 L209 I210 S215 D216 V217G118-E213 WeakPolarHBondContact CA-OE1 3.44Å; G121-E213 VanDerWaalsContact CA-OE1 3.28Å; G121-E213 WeakPolarHBondContact CA-OE1 3.16Å; G121-E213 VanDerWaalsContact CA-OE2 3.25Å; G121-E213 WeakPolarHBondContact CA-OE2 3.31Å; A122-E213 PolarHBondContact N-OE2 3.3Å; L125-E213 HydrophobicContact CD1-CB 4.38Å; L125-E213 WeakPolarHBondContact CD1-OE2 3.46Å; L209-E213 HydrophobicContact CD1-CG 4.37Å; L209-E213 WeakPolarHBondContact O-CG 3.46Å; L209-E213 PolarHBondContact O-N 2.81Å; I210-E213 PolarHBondContact O-N 3.23Å; E213-S215 VanDerWaalsContact C-N 3.31Å; E213-S215 PolarHBondContact O-N 3.19Å; E213-D216 WeakPolarHBondContact O-CB 3.41Å; E213-D216 PolarHBondContact O-N 3.07Å; E213-V217 WeakPolarHBondContact O-CG2 3.02Å; E213-V217 PolarHBondContact O-N 3.45Å; E213-V217 VanDerWaalsContact O-N 3.08Å
214L92.7Very high91.1Very high57 Ų5725.7 Ų25.730%0.29814%0.138SC..Hα-helixtrans-66.2-36.3178.6-171.657.8000111.8L173 I210 V212 D216 V217 I218L173-L214 HydrophobicContact CD1-CD2 3.86Å; L173-L214 HydrophobicContact CD2-CD2 3.32Å; L173-L214 HydrophobicContact CD2-CG 4.23Å; L173-L214 HydrophobicContact CG-CD2 3.9Å; I210-L214 WeakPolarHBondContact O-CB 3.26Å; I210-L214 PolarHBondContact O-N 3.41Å; V212-L214 VanDerWaalsContact C-N 3.34Å; V212-L214 PolarHBondContact O-N 3.04Å; L214-D216 VanDerWaalsContact C-N 3.34Å; L214-V217 PolarHBondContact O-N 3.24Å; L214-I218 HydrophobicContact CG-CD1 4.28Å; L214-I218 VanDerWaalsContact O-CG1 3.25Å; L214-I218 WeakPolarHBondContact O-CG1 3.4Å; L214-I218 PolarHBondContact O-N 2.78Å
215S91.1Very high91.7Very high9 Ų925.2 Ų25.26%0.06314%0.135CC..Hα-helixtrans-63.3-41.2173.272.60000111.6L211 V212 E213 V217 I218 F219L211-S215 VanDerWaalsContact O-CB 3.3Å; L211-S215 WeakPolarHBondContact O-CB 3.32Å; L211-S215 PolarHBondContact O-N 2.95Å; L211-S215 PolarHBondContact O-OG 3.38Å; V212-S215 PolarHBondContact O-N 3.19Å; V212-S215 PolarHBondContact O-OG 2.96Å; E213-S215 VanDerWaalsContact C-N 3.31Å; E213-S215 PolarHBondContact O-N 3.19Å; S215-V217 VanDerWaalsContact C-N 3.34Å; S215-V217 PolarHBondContact O-N 2.84Å; S215-I218 PolarHBondContact O-N 3.31Å; S215-I218 VanDerWaalsContact O-N 3.16Å; S215-F219 WeakPolarHBondContact O-CD2 3.33Å; S215-F219 PolarHBondContact O-N 3.42Å
216D93.5Very high92Very high4 Ų425.1 Ų25.12%0.02114%0.135CC..Hα-helixtrans-60.8-43.1176.8-169.973.2000111.7N93 A122 V212 E213 L214 I218 F219 A220N93-D216 PolarHBondContact ND2-OD1 3.36Å; A122-D216 WeakPolarHBondContact CA-OD2 3.24Å; A122-D216 HydrophobicContact CB-CB 4.34Å; A122-D216 WeakPolarHBondContact CB-OD2 3.25Å; V212-D216 PolarHBondContact O-N 3.31Å; E213-D216 WeakPolarHBondContact O-CB 3.41Å; E213-D216 PolarHBondContact O-N 3.07Å; L214-D216 VanDerWaalsContact C-N 3.34Å; D216-I218 PolarHBondContact O-N 2.9Å; D216-F219 PolarHBondContact O-N 2.99Å; D216-A220 WeakPolarHBondContact O-CB 3.33Å; D216-A220 PolarHBondContact O-N 2.8Å
217V94Very high92.3Very high48 Ų4823.9 Ų23.929%0.29113%0.128SC..Hα-helixtrans-62.1-42.7173.91760000111.7L125 M129 E213 L214 S215 A220 V221L125-V217 HydrophobicContact CB-CG2 4.48Å; L125-V217 HydrophobicContact CD1-CG2 3.73Å; M129-V217 HydrophobicContact CE-CG2 4.38Å; M129-V217 HydrophobicContact SD-CG1 4.24Å; E213-V217 WeakPolarHBondContact O-CG2 3.02Å; E213-V217 PolarHBondContact O-N 3.45Å; E213-V217 VanDerWaalsContact O-N 3.08Å; L214-V217 PolarHBondContact O-N 3.24Å; S215-V217 VanDerWaalsContact C-N 3.34Å; S215-V217 PolarHBondContact O-N 2.84Å; V217-A220 WeakPolarHBondContact O-CB 3.5Å; V217-A220 PolarHBondContact O-N 3.33Å; V217-V221 WeakPolarHBondContact O-CG2 3.34Å; V217-V221 PolarHBondContact O-N 2.89Å
218I91.2Very high92.6Very high94 Ų9424.1 Ų24.148%0.48213%0.129SC..Hα-helixtrans-61.6-45177-69.9164.4000110.4L214 S215 D216 A220 V221L214-I218 HydrophobicContact CG-CD1 4.28Å; L214-I218 VanDerWaalsContact O-CG1 3.25Å; L214-I218 WeakPolarHBondContact O-CG1 3.4Å; L214-I218 PolarHBondContact O-N 2.78Å; S215-I218 PolarHBondContact O-N 3.31Å; S215-I218 VanDerWaalsContact O-N 3.16Å; D216-I218 PolarHBondContact O-N 2.9Å; I218-A220 VanDerWaalsContact C-N 3.29Å; I218-A220 PolarHBondContact O-N 3.13Å; I218-V221 WeakPolarHBondContact O-CB 3.45Å; I218-V221 WeakPolarHBondContact O-CG2 3.45Å; I218-V221 PolarHBondContact O-N 2.98Å
219F90.9Very high92.7Very high39 Ų3924.8 Ų24.817%0.17114%0.135CC..Hα-helixtrans-69.9-25.4177.6-73.4-62.4000113.5D92 N93 V96 S215 D216 V221 D222 S223D92-F219 HydrophobicContact CB-CE1 3.96Å; D92-F219 HydrophobicContact CB-CZ 4.18Å; D92-F219 WeakPolarHBondContact OD2-CE1 3.1Å; N93-F219 HydrophobicContact CB-CD2 4.14Å; N93-F219 HydrophobicContact CB-CE2 4.39Å; N93-F219 WeakPolarHBondContact OD1-CB 3.34Å; N93-F219 WeakPolarHBondContact OD1-CD2 3.17Å; N93-F219 WeakPolarHBondContact OD1-CG 3.24Å; V96-F219 HydrophobicContact CB-CE2 4.02Å; V96-F219 HydrophobicContact CB-CZ 4.44Å; V96-F219 HydrophobicContact CG2-CE2 3.53Å; V96-F219 HydrophobicContact CG2-CZ 3.49Å; V96-F219 VanDerWaalsContact CG2-CZ 3.49Å; S215-F219 WeakPolarHBondContact O-CD2 3.33Å; S215-F219 PolarHBondContact O-N 3.42Å; D216-F219 PolarHBondContact O-N 2.99Å; F219-V221 PolarHBondContact O-N 3.29Å; F219-D222 PolarHBondContact O-N 3.49Å; F219-S223 PolarHBondContact O-N 2.83Å; F219-S223 PolarHBondContact O-OG 3.3Å
220A92.3Very high92.6Very high2 Ų224.4 Ų24.42%0.01713%0.134CC..Hα-helixtrans-64.3-27.2172.500000113M129 D216 V217 I218 D222 S223 I224M129-A220 HydrophobicContact CE-CB 3.21Å; M129-A220 HydrophobicContact SD-CB 3.43Å; M129-A220 WeakPolarHBondContact SD-CB 3.29Å; D216-A220 WeakPolarHBondContact O-CB 3.33Å; D216-A220 PolarHBondContact O-N 2.8Å; V217-A220 WeakPolarHBondContact O-CB 3.5Å; V217-A220 PolarHBondContact O-N 3.33Å; I218-A220 VanDerWaalsContact C-N 3.29Å; I218-A220 PolarHBondContact O-N 3.13Å; A220-D222 PolarHBondContact O-N 2.95Å; A220-S223 VanDerWaalsContact CA-OG 3.31Å; A220-S223 WeakPolarHBondContact CA-OG 3.1Å; A220-I224 HydrophobicContact CB-CG1 4.08Å; A220-I224 WeakPolarHBondContact O-CB 3.4Å; A220-I224 WeakPolarHBondContact O-CG1 3.46Å; A220-I224 PolarHBondContact O-N 3.08Å
221V91.5Very high92.6Very high75 Ų7522.6 Ų22.646%0.45513%0.125SC..Hα-helixtrans-59.2-34.5177.5-171.80000111.5F150 V217 I218 F219 P225F150-V221 HydrophobicContact CE1-CB 4.42Å; F150-V221 HydrophobicContact CE1-CG1 3.61Å; F150-V221 WeakPolarHBondContact CE1-O 3.43Å; F150-V221 HydrophobicContact CE2-CG1 4.32Å; F150-V221 HydrophobicContact CZ-CB 4.38Å; F150-V221 HydrophobicContact CZ-CG1 3.41Å; F150-V221 VanDerWaalsContact CZ-CG1 3.41Å; V217-V221 WeakPolarHBondContact O-CG2 3.34Å; V217-V221 PolarHBondContact O-N 2.89Å; I218-V221 WeakPolarHBondContact O-CB 3.45Å; I218-V221 WeakPolarHBondContact O-CG2 3.45Å; I218-V221 PolarHBondContact O-N 2.98Å; F219-V221 PolarHBondContact O-N 3.29Å; V221-P225 WeakPolarHBondContact O-CD 3.43Å; V221-P225 WeakPolarHBondContact O-CG 3.4Å
222D91.2Very high92.6Very high36 Ų3624.9 Ų24.919%0.19314%0.14CC..Hα-helixtrans-93.5-44.8178.7-66.729.7000111.2F150 L151 T154 F219 A220 I224 P225 A226 L273F150-D222 WeakPolarHBondContact CE1-OD1 3.16Å; F150-D222 WeakPolarHBondContact CZ-OD1 3.12Å; L151-D222 HydrophobicContact CD2-CB 4.08Å; L151-D222 WeakPolarHBondContact CD2-O 3.16Å; T154-D222 WeakPolarHBondContact CB-OD2 3.41Å; T154-D222 WeakPolarHBondContact CG2-OD2 3.32Å; T154-D222 PolarHBondContact OG1-OD2 3.49Å; F219-D222 PolarHBondContact O-N 3.49Å; A220-D222 PolarHBondContact O-N 2.95Å; D222-I224 PolarHBondContact O-N 3.25Å; D222-P225 WeakPolarHBondContact O-CD 3.22Å; D222-A226 WeakPolarHBondContact O-CB 3.35Å; D222-A226 PolarHBondContact O-N 3.29Å; D222-L273 HydrophobicContact CB-CD2 4.33Å
223S92.2Very high92.5Very high3 Ų325.1 Ų25.12%0.02114%0.141CC..Hα-helixtrans-70.3-31.8-173.649.50000113.5L89 R126 F219 A220 A226 I227L89-S223 VanDerWaalsContact CD1-CB 3.47Å; R126-S223 VanDerWaalsContact CZ-OG 3.22Å; R126-S223 PolarHBondContact NH1-OG 3.28Å; R126-S223 PolarHBondContact NH2-OG 3.38Å; F219-S223 PolarHBondContact O-N 2.83Å; F219-S223 PolarHBondContact O-OG 3.3Å; A220-S223 VanDerWaalsContact CA-OG 3.31Å; A220-S223 WeakPolarHBondContact CA-OG 3.1Å; S223-A226 PolarHBondContact O-N 3.41Å; S223-I227 WeakPolarHBondContact O-CG2 3.37Å; S223-I227 PolarHBondContact O-N 2.89Å
224I93.4Very high92.5Very high11 Ų1124.6 Ų24.66%0.05614%0.14CC..Hα-helixtrans-65.1-52.4177.2-65-71.9000111.8R126 M129 I130 A220 D222 A226 I227 F228R126-I224 VanDerWaalsContact NE-CD1 3.34Å; M129-I224 HydrophobicContact CB-CD1 4.29Å; M129-I224 HydrophobicContact CB-CG1 4.37Å; I130-I224 HydrophobicContact CB-CD1 4.42Å; I130-I224 HydrophobicContact CD1-CD1 4.28Å; I130-I224 HydrophobicContact CG1-CD1 3.33Å; A220-I224 HydrophobicContact CB-CG1 4.08Å; A220-I224 WeakPolarHBondContact O-CB 3.4Å; A220-I224 WeakPolarHBondContact O-CG1 3.46Å; A220-I224 PolarHBondContact O-N 3.08Å; D222-I224 PolarHBondContact O-N 3.25Å; I224-A226 PolarHBondContact O-N 2.92Å; I224-I227 WeakPolarHBondContact O-CG2 3.38Å; I224-I227 PolarHBondContact O-N 3.41Å; I224-F228 HydrophobicContact CG2-CD2 3.72Å; I224-F228 HydrophobicContact CG2-CE2 3.6Å; I224-F228 WeakPolarHBondContact O-CD2 3.47Å; I224-F228 PolarHBondContact O-N 3.48Å
225P94.6Very high92.5Very high5 Ų522 Ų223%0.03213%0.126CC..Hα-helixtrans-48.5-44.9167.1-36.741.9000114F147 L151 V221 D222 I227 F228 A229F147-P225 HydrophobicContact CB-CB 3.73Å; F147-P225 HydrophobicContact CB-CG 4.17Å; F147-P225 HydrophobicContact CD1-CB 4.41Å; F147-P225 HydrophobicContact CD1-CG 3.9Å; F147-P225 HydrophobicContact CD2-CB 3.97Å; F147-P225 HydrophobicContact CD2-CG 3.96Å; F147-P225 HydrophobicContact CE1-CG 4.26Å; F147-P225 HydrophobicContact CE2-CG 4.33Å; F147-P225 HydrophobicContact CG-CB 3.78Å; F147-P225 HydrophobicContact CG-CG 3.73Å; F147-P225 HydrophobicContact CZ-CG 4.47Å; L151-P225 HydrophobicContact CD1-CB 3.82Å; L151-P225 HydrophobicContact CD2-CB 4.03Å; L151-P225 HydrophobicContact CG-CB 3.91Å; V221-P225 WeakPolarHBondContact O-CD 3.43Å; V221-P225 WeakPolarHBondContact O-CG 3.4Å; D222-P225 WeakPolarHBondContact O-CD 3.22Å; P225-I227 PolarHBondContact O-N 2.92Å; P225-F228 PolarHBondContact O-N 2.78Å; P225-A229 PolarHBondContact O-N 3.39Å; P225-A229 VanDerWaalsContact O-N 3.07Å
226A94.7Very high92.7Very high0 Ų021.5 Ų21.50%012%0.123CC..Hα-helixtrans-65.3-40.4-173.500000112.5I85 L89 L151 D222 S223 I224 A229 I276I85-A226 HydrophobicContact CG2-CB 4.04Å; L89-A226 HydrophobicContact CD1-CB 4.45Å; L151-A226 HydrophobicContact CD1-CB 3.99Å; L151-A226 HydrophobicContact CD2-CB 4.32Å; D222-A226 WeakPolarHBondContact O-CB 3.35Å; D222-A226 PolarHBondContact O-N 3.29Å; S223-A226 PolarHBondContact O-N 3.41Å; I224-A226 PolarHBondContact O-N 2.92Å; A226-A229 WeakPolarHBondContact O-CB 3.41Å; A226-A229 PolarHBondContact O-N 3.49Å; A226-I276 HydrophobicContact CB-CD1 4.17Å; A226-I276 HydrophobicContact CB-CG2 4.12Å
227I93.9Very high92.8Very high0 Ų021.3 Ų21.30%012%0.122CC..Hα-helixtrans-70.1-35.7176.1-17364.6000111.9E86 S223 I224 P225 A229 V230 T231 V237E86-I227 HydrophobicContact CG-CD1 4.49Å; S223-I227 WeakPolarHBondContact O-CG2 3.37Å; S223-I227 PolarHBondContact O-N 2.89Å; I224-I227 WeakPolarHBondContact O-CG2 3.38Å; I224-I227 PolarHBondContact O-N 3.41Å; P225-I227 PolarHBondContact O-N 2.92Å; I227-A229 VanDerWaalsContact C-N 3.26Å; I227-A229 PolarHBondContact O-N 2.92Å; I227-V230 WeakPolarHBondContact O-CB 3.3Å; I227-V230 PolarHBondContact O-N 2.93Å; I227-T231 PolarHBondContact O-N 3.31Å; I227-T231 VanDerWaalsContact O-N 3.11Å; I227-V237 HydrophobicContact CB-CG1 4.42Å; I227-V237 HydrophobicContact CG1-CB 4.18Å; I227-V237 HydrophobicContact CG1-CG1 3.83Å; I227-V237 HydrophobicContact CG1-CG2 4.06Å; I227-V237 HydrophobicContact CG2-CG1 3.63Å
228F93.6Very high92.8Very high6 Ų619.4 Ų19.43%0.02611%0.11CC..Hα-helixtrans-67.9-23.6175.9-80.3-60.4000113.8S134 I137 L144 I224 P225 V230 T231 V237 M280S134-F228 VanDerWaalsContact N-CZ 3.33Å; I137-F228 HydrophobicContact CD1-CB 3.59Å; I137-F228 HydrophobicContact CD1-CD1 3.38Å; I137-F228 HydrophobicContact CD1-CD2 3.46Å; I137-F228 VanDerWaalsContact CD1-CD2 3.46Å; I137-F228 HydrophobicContact CD1-CE1 3.86Å; I137-F228 HydrophobicContact CD1-CE2 3.93Å; I137-F228 HydrophobicContact CD1-CG 3.18Å; I137-F228 HydrophobicContact CD1-CZ 4.13Å; L144-F228 HydrophobicContact CD2-CB 4.49Å; I224-F228 HydrophobicContact CG2-CD2 3.72Å; I224-F228 HydrophobicContact CG2-CE2 3.6Å; I224-F228 WeakPolarHBondContact O-CD2 3.47Å; I224-F228 PolarHBondContact O-N 3.48Å; P225-F228 PolarHBondContact O-N 2.78Å; F228-V230 PolarHBondContact O-N 3Å; F228-T231 WeakPolarHBondContact CA-O 3.45Å; F228-V237 HydrophobicContact CD1-CG2 4.03Å; F228-V237 HydrophobicContact CE1-CG1 4.43Å; F228-V237 HydrophobicContact CE1-CG2 3.83Å; F228-V237 HydrophobicContact CZ-CG1 4.24Å; F228-V237 HydrophobicContact CZ-CG2 4.44Å; F228-M280 HydrophobicContact CB-CE 4.4Å
229A91.6Very high93Very high15 Ų1514.9 Ų14.912%0.1249%0.087CC..THydrogen-bonded Turntrans-71.6-14.7169.700000113.5P225 A226 I227 I276 K279 M280P225-A229 PolarHBondContact O-N 3.39Å; P225-A229 VanDerWaalsContact O-N 3.07Å; A226-A229 WeakPolarHBondContact O-CB 3.41Å; A226-A229 PolarHBondContact O-N 3.49Å; I227-A229 VanDerWaalsContact C-N 3.26Å; I227-A229 PolarHBondContact O-N 2.92Å; A229-I276 HydrophobicContact CB-CG2 3.45Å; A229-I276 VanDerWaalsContact CB-CG2 3.45Å; A229-K279 VanDerWaalsContact O-CE 3.28Å; A229-K279 WeakPolarHBondContact O-CE 3.29Å; A229-K279 PolarHBondContact O-NZ 2.96Å; A229-M280 HydrophobicContact CB-CB 3.98Å; A229-M280 HydrophobicContact CB-CE 4.17Å; A229-M280 HydrophobicContact CB-CG 3.93Å; A229-M280 HydrophobicContact CB-SD 3.82Å
230V91.8Very high93.2Very high12 Ų1213 Ų137%0.0738%0.079CC..THydrogen-bonded Turntrans-92.4-48.8174178.60000110.8A78 T81 I85 I227 F228 I290A78-V230 HydrophobicContact CB-CG1 4.23Å; T81-V230 HydrophobicContact CG2-CG1 3.93Å; T81-V230 HydrophobicContact CG2-CG2 3.81Å; I85-V230 HydrophobicContact CD1-CG2 3.43Å; I85-V230 VanDerWaalsContact CD1-CG2 3.43Å; I227-V230 WeakPolarHBondContact O-CB 3.3Å; I227-V230 PolarHBondContact O-N 2.93Å; F228-V230 PolarHBondContact O-N 3Å; V230-I290 HydrophobicContact CG1-CG2 4.38Å
231T92.2Very high93.3Very high15 Ų1513 Ų139%0.0928%0.079CC..  trans-152142.5-178.1-177.90000111A78 I227 F228 D233 I236 V237A78-T231 HydrophobicContact CB-CG2 4.25Å; I227-T231 PolarHBondContact O-N 3.31Å; I227-T231 VanDerWaalsContact O-N 3.11Å; F228-T231 WeakPolarHBondContact CA-O 3.45Å; T231-D233 PolarHBondContact OG1-N 3.31Å; T231-D233 VanDerWaalsContact OG1-N 3.17Å; T231-I236 HydrophobicContact CG2-CB 4.01Å; T231-I236 HydrophobicContact CG2-CG2 3.78Å; T231-V237 HydrophobicContact CG2-CG2 3.93Å; T231-V237 WeakPolarHBondContact O-CG2 3.48Å
232T90.6Very high93.5Very high59 Ų599.8 Ų9.836%0.3626%0.059SC..  trans-95.9217455.90000112.7M1 I137 P234M1-T232 HydrophobicContact CE-CG2 4.44Å; I137-T232 HydrophobicContact CG2-CG2 4.48Å; T232-P234 VanDerWaalsContact O-CD 3.24Å; T232-P234 WeakPolarHBondContact O-CD 3.42Å
233D92.6Very high93.7Very high6 Ų68.1 Ų8.13%0.0325%0.05CC..  trans-76.4110176.3-170.8-24.2000110.6T3 V4 T231 F235 I236 V237T3-D233 WeakPolarHBondContact CA-OD2 3.42Å; T3-D233 WeakPolarHBondContact CB-OD1 3.4Å; T3-D233 PolarHBondContact OG1-OD1 3.42Å; T3-D233 PolarHBondContact OG1-OD2 2.99Å; V4-D233 WeakPolarHBondContact CG2-OD2 3.26Å; V4-D233 PolarHBondContact N-OD2 2.98Å; T231-D233 PolarHBondContact OG1-N 3.31Å; T231-D233 VanDerWaalsContact OG1-N 3.17Å; D233-F235 PolarHBondContact O-N 2.93Å; D233-F235 VanDerWaalsContact O-N 3.12Å; D233-F235 WeakPolarHBondContact OD1-CB 3.47Å; D233-F235 PolarHBondContact OD1-N 3.35Å; D233-I236 HydrophobicContact CB-CB 4.32Å; D233-I236 HydrophobicContact CB-CD1 4.17Å; D233-I236 HydrophobicContact CB-CG1 4.2Å; D233-I236 PolarHBondContact O-N 3.02Å; D233-V237 VanDerWaalsContact O-CG2 3.32Å; D233-V237 WeakPolarHBondContact O-CG2 3.31Å; D233-V237 PolarHBondContact O-N 3.45Å
234P92.5Very high93.8Very high21 Ų218 Ų814%0.1365%0.049CC..Hα-helixtrans-59.5-28-177.324.9-34.7000113.2T232 L238T232-P234 VanDerWaalsContact O-CD 3.24Å; T232-P234 WeakPolarHBondContact O-CD 3.42Å; P234-L238 VanDerWaalsContact O-CB 3.23Å; P234-L238 WeakPolarHBondContact O-CB 3.5Å; P234-L238 PolarHBondContact O-N 3.21Å
235F94Very high93.7Very high1 Ų17.8 Ų7.80%0.0045%0.048CC..Hα-helixtrans-64.9-46.3175.6177.7-100.9000110.8V4 L9 W10 F13 F59 D233 T239V4-F235 HydrophobicContact CG2-CD1 4.32Å; L9-F235 HydrophobicContact CB-CE2 4.09Å; L9-F235 HydrophobicContact CB-CZ 3.97Å; W10-F235 AromaticContact CD2-CD2 3.76Å; W10-F235 HydrophobicContact CD2-CD2 3.76Å; W10-F235 HydrophobicContact CD2-CE2 4.37Å; W10-F235 AromaticContact CE2-CD2 3.59Å; W10-F235 HydrophobicContact CE3-CD2 4.23Å; W10-F235 HydrophobicContact CG-CD2 4.16Å; W10-F235 HydrophobicContact CH2-CB 4.47Å; W10-F235 HydrophobicContact CH2-CD2 4.35Å; W10-F235 HydrophobicContact CZ2-CB 3.7Å; W10-F235 AromaticContact CZ2-CD2 3.89Å; W10-F235 HydrophobicContact CZ2-CD2 3.89Å; W10-F235 HydrophobicContact CZ2-CG 4.31Å; W10-F235 AromaticContact NE1-CD2 3.88Å; F13-F235 HydrophobicContact CB-CE2 4.01Å; F13-F235 HydrophobicContact CB-CZ 4.36Å; F13-F235 HydrophobicContact CG-CE2 4.37Å; F59-F235 HydrophobicContact CD2-CE1 4.12Å; F59-F235 HydrophobicContact CE2-CD1 4.2Å; F59-F235 AromaticContact CE2-CE1 3.6Å; F59-F235 HydrophobicContact CE2-CE1 3.6Å; F59-F235 HydrophobicContact CZ-CD1 4.37Å; F59-F235 HydrophobicContact CZ-CE1 4.12Å; D233-F235 PolarHBondContact O-N 2.93Å; D233-F235 VanDerWaalsContact O-N 3.12Å; D233-F235 WeakPolarHBondContact OD1-CB 3.47Å; D233-F235 PolarHBondContact OD1-N 3.35Å; F235-T239 HydrophobicContact CD1-CG2 4.22Å; F235-T239 HydrophobicContact CD2-CG2 3.99Å; F235-T239 HydrophobicContact CE1-CG2 3.93Å; F235-T239 HydrophobicContact CE2-CG2 3.72Å; F235-T239 HydrophobicContact CG-CG2 4.25Å; F235-T239 HydrophobicContact CZ-CG2 3.68Å; F235-T239 VanDerWaalsContact O-CB 3.27Å; F235-T239 WeakPolarHBondContact O-CB 3.31Å; F235-T239 WeakPolarHBondContact O-CG2 3.49Å; F235-T239 PolarHBondContact O-N 3.31Å; F235-T239 PolarHBondContact O-OG1 2.78Å
236I94.7Very high93.4Very high0 Ų07.7 Ų7.70%05%0.047CC..Hα-helixtrans-72.4-40.1-178.8-60.3178.3000110.8V4 F59 Q75 A78 F79 T231 D233 T239 S240V4-I236 HydrophobicContact CG2-CD1 4.34Å; V4-I236 HydrophobicContact CG2-CG1 4.5Å; F59-I236 HydrophobicContact CE1-CD1 4.31Å; F59-I236 HydrophobicContact CE1-CG1 4.4Å; F59-I236 HydrophobicContact CZ-CD1 4.15Å; F59-I236 HydrophobicContact CZ-CG1 4.12Å; Q75-I236 HydrophobicContact CB-CD1 3.83Å; Q75-I236 HydrophobicContact CG-CD1 4.23Å; A78-I236 HydrophobicContact CB-CG2 4.23Å; F79-I236 HydrophobicContact CB-CG2 3.93Å; T231-I236 HydrophobicContact CG2-CB 4.01Å; T231-I236 HydrophobicContact CG2-CG2 3.78Å; D233-I236 HydrophobicContact CB-CB 4.32Å; D233-I236 HydrophobicContact CB-CD1 4.17Å; D233-I236 HydrophobicContact CB-CG1 4.2Å; D233-I236 PolarHBondContact O-N 3.02Å; I236-T239 WeakPolarHBondContact CA-OG1 3.44Å; I236-T239 PolarHBondContact O-OG1 2.87Å; I236-S240 VanDerWaalsContact O-CB 3.25Å; I236-S240 WeakPolarHBondContact O-CB 3.25Å; I236-S240 PolarHBondContact O-N 3.45Å; I236-S240 PolarHBondContact O-OG 3.41Å
237V95.1Very high93.1Very high0 Ų07.8 Ų7.80%05%0.048CC..Hα-helixtrans-56.8-52.2174.1176.50000110.1I130 I227 F228 T231 D233 S240 N241I130-V237 HydrophobicContact CB-CG1 4.34Å; I130-V237 HydrophobicContact CD1-CG1 4.03Å; I130-V237 HydrophobicContact CG1-CG1 3.92Å; I130-V237 HydrophobicContact CG2-CB 4.14Å; I130-V237 HydrophobicContact CG2-CG1 3.55Å; I227-V237 HydrophobicContact CB-CG1 4.42Å; I227-V237 HydrophobicContact CG1-CB 4.18Å; I227-V237 HydrophobicContact CG1-CG1 3.83Å; I227-V237 HydrophobicContact CG1-CG2 4.06Å; I227-V237 HydrophobicContact CG2-CG1 3.63Å; F228-V237 HydrophobicContact CD1-CG2 4.03Å; F228-V237 HydrophobicContact CE1-CG1 4.43Å; F228-V237 HydrophobicContact CE1-CG2 3.83Å; F228-V237 HydrophobicContact CZ-CG1 4.24Å; F228-V237 HydrophobicContact CZ-CG2 4.44Å; T231-V237 HydrophobicContact CG2-CG2 3.93Å; T231-V237 WeakPolarHBondContact O-CG2 3.48Å; D233-V237 VanDerWaalsContact O-CG2 3.32Å; D233-V237 WeakPolarHBondContact O-CG2 3.31Å; D233-V237 PolarHBondContact O-N 3.45Å; V237-S240 PolarHBondContact O-OG 3Å; V237-N241 WeakPolarHBondContact O-CB 3.3Å; V237-N241 PolarHBondContact O-N 3.23Å
238L94.9Very high92.9Very high7 Ų77.9 Ų7.94%0.0375%0.049CC..Hα-helixtrans-66.1-46.4-179-174.869.2000112.6W10 F13 T127 I130 F131 P234 N241 L242W10-L238 HydrophobicContact CH2-CB 4.34Å; W10-L238 HydrophobicContact CH2-CD2 3.69Å; W10-L238 HydrophobicContact CZ3-CD2 3.35Å; F13-L238 HydrophobicContact CE1-CD2 4.22Å; F13-L238 HydrophobicContact CE1-CG 4.42Å; T127-L238 HydrophobicContact CG2-CD1 4Å; T127-L238 HydrophobicContact CG2-CD2 4.42Å; I130-L238 HydrophobicContact CD1-CD1 3.86Å; I130-L238 HydrophobicContact CG2-CB 4.34Å; F131-L238 HydrophobicContact CE2-CD2 4.37Å; F131-L238 HydrophobicContact CZ-CD2 4.26Å; P234-L238 VanDerWaalsContact O-CB 3.23Å; P234-L238 WeakPolarHBondContact O-CB 3.5Å; P234-L238 PolarHBondContact O-N 3.21Å; L238-N241 PolarHBondContact O-N 2.88Å; L238-L242 HydrophobicContact CD1-CD1 3.84Å; L238-L242 HydrophobicContact CD1-CG 4.02Å; L238-L242 HydrophobicContact CD2-CD1 4.22Å; L238-L242 HydrophobicContact CG-CD1 3.74Å; L238-L242 HydrophobicContact CG-CG 4.22Å; L238-L242 WeakPolarHBondContact O-CB 3.34Å; L238-L242 WeakPolarHBondContact O-CG 3.37Å; L238-L242 PolarHBondContact O-N 3.48Å
239T94.7Very high92.6Very high0 Ų07.8 Ų7.80%05%0.048CC..Hα-helixtrans-63.9-51.5-176.454.60000111.1F13 F55 F235 I236 N241 L242 F243F13-T239 HydrophobicContact CD1-CG2 3.79Å; F13-T239 HydrophobicContact CD2-CG2 3.61Å; F13-T239 HydrophobicContact CE1-CG2 3.74Å; F13-T239 HydrophobicContact CE2-CG2 3.55Å; F13-T239 HydrophobicContact CG-CG2 3.71Å; F13-T239 HydrophobicContact CZ-CG2 3.61Å; F55-T239 HydrophobicContact CZ-CG2 4.27Å; F235-T239 HydrophobicContact CD1-CG2 4.22Å; F235-T239 HydrophobicContact CD2-CG2 3.99Å; F235-T239 HydrophobicContact CE1-CG2 3.93Å; F235-T239 HydrophobicContact CE2-CG2 3.72Å; F235-T239 HydrophobicContact CG-CG2 4.25Å; F235-T239 HydrophobicContact CZ-CG2 3.68Å; F235-T239 VanDerWaalsContact O-CB 3.27Å; F235-T239 WeakPolarHBondContact O-CB 3.31Å; F235-T239 WeakPolarHBondContact O-CG2 3.49Å; F235-T239 PolarHBondContact O-N 3.31Å; F235-T239 PolarHBondContact O-OG1 2.78Å; I236-T239 WeakPolarHBondContact CA-OG1 3.44Å; I236-T239 PolarHBondContact O-OG1 2.87Å; T239-N241 VanDerWaalsContact C-N 3.26Å; T239-N241 PolarHBondContact O-N 3.31Å; T239-L242 PolarHBondContact O-N 2.93Å; T239-F243 VanDerWaalsContact O-CD2 3.24Å; T239-F243 WeakPolarHBondContact O-CD2 3.41Å; T239-F243 PolarHBondContact O-N 3.18Å
240S95.5Very high92.5Very high0 Ų07 Ų70%04%0.042CC..Hα-helixtrans-58.8-39.9179.2620000112.1F79 I236 V237 A244F79-S240 WeakPolarHBondContact O-CB 3.12Å; I236-S240 VanDerWaalsContact O-CB 3.25Å; I236-S240 WeakPolarHBondContact O-CB 3.25Å; I236-S240 PolarHBondContact O-N 3.45Å; I236-S240 PolarHBondContact O-OG 3.41Å; V237-S240 PolarHBondContact O-OG 3Å; S240-A244 WeakPolarHBondContact O-CB 3.33Å; S240-A244 PolarHBondContact O-N 3.42Å; S240-A244 VanDerWaalsContact O-N 3.08Å
241N95Very high92.3Very high1 Ų17.3 Ų7.31%0.0054%0.043CC..Hα-helixtrans-67.6-50178.3-164.3-65.5000112.6E86 R126 I130 V237 L238 T239 F243 A244 I245E86-N241 HydrophobicContact CG-CB 4.3Å; E86-N241 WeakPolarHBondContact CG-ND2 3.47Å; E86-N241 PolarHBondContact OE1-ND2 3.36Å; E86-N241 PolarHBondContact OE2-ND2 3.46Å; R126-N241 VanDerWaalsContact CG-OD1 3.25Å; R126-N241 WeakPolarHBondContact CG-OD1 3.38Å; R126-N241 PolarHBondContact NE-ND2 3.42Å; R126-N241 PolarHBondContact NE-OD1 2.92Å; R126-N241 PolarHBondContact NH2-ND2 3.17Å; I130-N241 HydrophobicContact CD1-CB 3.89Å; V237-N241 WeakPolarHBondContact O-CB 3.3Å; V237-N241 PolarHBondContact O-N 3.23Å; L238-N241 PolarHBondContact O-N 2.88Å; T239-N241 VanDerWaalsContact C-N 3.26Å; T239-N241 PolarHBondContact O-N 3.31Å; N241-F243 VanDerWaalsContact C-N 3.32Å; N241-F243 PolarHBondContact O-N 3.23Å; N241-A244 WeakPolarHBondContact O-CA 3.33Å; N241-A244 WeakPolarHBondContact O-CB 3.3Å; N241-A244 PolarHBondContact O-N 2.9Å; N241-I245 WeakPolarHBondContact O-CG1 3.35Å; N241-I245 PolarHBondContact O-N 3.26Å; N241-I245 WeakPolarHBondContact OD1-CD1 3.4Å
242L94.5Very high92.3Very high7 Ų76.8 Ų6.84%0.0374%0.039CC..Hα-helixtrans-61.3-41.3178.5-72.3178.2000111.5F13 V17 I123 L238 T239 A244 I245 L246F13-L242 HydrophobicContact CE1-CD1 3.72Å; F13-L242 HydrophobicContact CZ-CB 4.07Å; F13-L242 HydrophobicContact CZ-CD1 3.6Å; F13-L242 HydrophobicContact CZ-CG 4.4Å; V17-L242 HydrophobicContact CG2-CD1 4.34Å; I123-L242 HydrophobicContact CB-CD2 4.04Å; I123-L242 HydrophobicContact CG1-CD2 3.75Å; I123-L242 HydrophobicContact CG2-CD2 3.67Å; L238-L242 HydrophobicContact CD1-CD1 3.84Å; L238-L242 HydrophobicContact CD1-CG 4.02Å; L238-L242 HydrophobicContact CD2-CD1 4.22Å; L238-L242 HydrophobicContact CG-CD1 3.74Å; L238-L242 HydrophobicContact CG-CG 4.22Å; L238-L242 WeakPolarHBondContact O-CB 3.34Å; L238-L242 WeakPolarHBondContact O-CG 3.37Å; L238-L242 PolarHBondContact O-N 3.48Å; T239-L242 PolarHBondContact O-N 2.93Å; L242-A244 VanDerWaalsContact C-N 3.26Å; L242-A244 PolarHBondContact O-N 3.22Å; L242-I245 PolarHBondContact O-N 2.9Å; L242-L246 WeakPolarHBondContact O-CB 3.48Å; L242-L246 WeakPolarHBondContact O-CD1 3.25Å; L242-L246 WeakPolarHBondContact O-CG 3.26Å; L242-L246 PolarHBondContact O-N 3.2Å
243F95.1Very high92.1Very high1 Ų15 Ų50%0.0043%0.027CC..Hα-helixtrans-61.6-33.7173.1-87.4-76.5000112.7F13 V16 M20 L51 S52 F55 F79 Y83 T239 N241F13-F243 HydrophobicContact CD2-CE2 4.19Å; F13-F243 HydrophobicContact CE2-CD2 4.11Å; F13-F243 AromaticContact CE2-CE2 3.68Å; F13-F243 HydrophobicContact CE2-CE2 3.68Å; V16-F243 HydrophobicContact CG1-CZ 4.01Å; M20-F243 HydrophobicContact CE-CD1 3.51Å; M20-F243 HydrophobicContact CE-CE1 3.38Å; M20-F243 HydrophobicContact CE-CZ 4.38Å; M20-F243 HydrophobicContact SD-CD1 4.09Å; M20-F243 HydrophobicContact SD-CE1 3.38Å; M20-F243 WeakPolarHBondContact SD-CE1 3.26Å; M20-F243 HydrophobicContact SD-CZ 3.85Å; L51-F243 HydrophobicContact CG-CE1 4.48Å; S52-F243 WeakPolarHBondContact OG-CD1 3.47Å; F55-F243 HydrophobicContact CB-CE1 3.94Å; F55-F243 HydrophobicContact CB-CE2 3.91Å; F55-F243 HydrophobicContact CB-CZ 3.46Å; F55-F243 VanDerWaalsContact CB-CZ 3.46Å; F55-F243 AromaticContact CD1-CD2 3.99Å; F55-F243 HydrophobicContact CD1-CD2 3.99Å; F55-F243 AromaticContact CD1-CE2 3.38Å; F55-F243 HydrophobicContact CD1-CE2 3.38Å; F55-F243 AromaticContact CD1-CZ 3.88Å; F55-F243 HydrophobicContact CD1-CZ 3.88Å; F55-F243 AromaticContact CD2-CE2 3.62Å; F55-F243 HydrophobicContact CD2-CE2 3.62Å; F55-F243 AromaticContact CD2-CZ 3.52Å; F55-F243 HydrophobicContact CD2-CZ 3.52Å; F55-F243 HydrophobicContact CE1-CD2 4.32Å; F55-F243 AromaticContact CE1-CE2 3.71Å; F55-F243 HydrophobicContact CE1-CE2 3.71Å; F55-F243 AromaticContact CE2-CE2 3.93Å; F55-F243 HydrophobicContact CE2-CE2 3.93Å; F55-F243 HydrophobicContact CE2-CZ 4.21Å; F55-F243 HydrophobicContact CG-CD2 4.29Å; F55-F243 HydrophobicContact CG-CE1 4.25Å; F55-F243 AromaticContact CG-CE2 3.32Å; F55-F243 HydrophobicContact CG-CE2 3.32Å; F55-F243 AromaticContact CG-CZ 3.32Å; F55-F243 HydrophobicContact CG-CZ 3.32Å; F55-F243 AromaticContact CZ-CE2 3.97Å; F55-F243 HydrophobicContact CZ-CE2 3.97Å; F79-F243 HydrophobicContact CE2-CD2 4Å; F79-F243 HydrophobicContact CZ-CB 4.26Å; F79-F243 AromaticContact CZ-CD2 3.78Å; F79-F243 HydrophobicContact CZ-CD2 3.78Å; F79-F243 HydrophobicContact CZ-CE2 4.45Å; F79-F243 HydrophobicContact CZ-CG 4.16Å; Y83-F243 HydrophobicContact CD2-CB 3.98Å; Y83-F243 HydrophobicContact CE2-CB 4.13Å; T239-F243 VanDerWaalsContact O-CD2 3.24Å; T239-F243 WeakPolarHBondContact O-CD2 3.41Å; T239-F243 PolarHBondContact O-N 3.18Å; N241-F243 VanDerWaalsContact C-N 3.32Å; N241-F243 PolarHBondContact O-N 3.23Å
244A93.9Very high91.8Very high1 Ų16.6 Ų6.61%0.0084%0.035CC..Hα-helixtrans-71.7-40.517600000112.8Y83 E86 K87 S240 N241 L242 L246Y83-A244 HydrophobicContact CD2-CB 4.06Å; Y83-A244 HydrophobicContact CE2-CB 4.24Å; E86-A244 HydrophobicContact CB-CB 3.63Å; K87-A244 HydrophobicContact CB-CB 4.28Å; K87-A244 HydrophobicContact CD-CB 4.18Å; K87-A244 WeakPolarHBondContact CD-O 3.37Å; K87-A244 PolarHBondContact NZ-O 3.42Å; S240-A244 WeakPolarHBondContact O-CB 3.33Å; S240-A244 PolarHBondContact O-N 3.42Å; S240-A244 VanDerWaalsContact O-N 3.08Å; N241-A244 WeakPolarHBondContact O-CA 3.33Å; N241-A244 WeakPolarHBondContact O-CB 3.3Å; N241-A244 PolarHBondContact O-N 2.9Å; L242-A244 VanDerWaalsContact C-N 3.26Å; L242-A244 PolarHBondContact O-N 3.22Å; A244-L246 VanDerWaalsContact C-N 3.34Å
245I92.4Very high91.5Very high7 Ų76.2 Ų6.24%0.0363%0.032CC..Hα-helixtrans-67.1-37.1175.1-65.9176.9000110.6V119 I123 R126 N241 L242 G247 L248V119-I245 HydrophobicContact CG1-CG2 4.06Å; I123-I245 HydrophobicContact CD1-CG2 4.46Å; I123-I245 HydrophobicContact CG1-CG2 3.89Å; R126-I245 HydrophobicContact CB-CD1 4.09Å; R126-I245 HydrophobicContact CG-CD1 3.99Å; N241-I245 WeakPolarHBondContact O-CG1 3.35Å; N241-I245 PolarHBondContact O-N 3.26Å; N241-I245 WeakPolarHBondContact OD1-CD1 3.4Å; L242-I245 PolarHBondContact O-N 2.9Å; I245-G247 PolarHBondContact O-N 3.22Å; I245-L248 HydrophobicContact CB-CD1 4.28Å; I245-L248 HydrophobicContact CG1-CD1 4.45Å; I245-L248 HydrophobicContact CG2-CD1 3.97Å; I245-L248 VanDerWaalsContact O-CB 3.23Å; I245-L248 WeakPolarHBondContact O-CB 3.23Å; I245-L248 WeakPolarHBondContact O-CG 3.26Å; I245-L248 PolarHBondContact O-N 3.47Å
246L88.6Confident91Very high2 Ų28.3 Ų8.31%0.015%0.049CC..THydrogen-bonded Turntrans-62.5129.4174.1-69.1165.1000109.6M20 L21 W48 K87 I123 L242 A244M20-L246 HydrophobicContact CB-CD1 4.08Å; M20-L246 HydrophobicContact CB-CD2 4.45Å; M20-L246 HydrophobicContact CE-CB 3.92Å; M20-L246 HydrophobicContact CE-CD1 3.34Å; M20-L246 HydrophobicContact CE-CG 4.17Å; M20-L246 HydrophobicContact SD-CD1 3.84Å; L21-L246 HydrophobicContact CD2-CD2 3.82Å; L21-L246 HydrophobicContact CG-CD2 4.31Å; W48-L246 HydrophobicContact CE3-CB 4.26Å; W48-L246 HydrophobicContact CZ3-CB 4.45Å; K87-L246 PolarHBondContact NZ-O 2.66Å; I123-L246 HydrophobicContact CD1-CD2 4.41Å; L242-L246 WeakPolarHBondContact O-CB 3.48Å; L242-L246 WeakPolarHBondContact O-CD1 3.25Å; L242-L246 WeakPolarHBondContact O-CG 3.26Å; L242-L246 PolarHBondContact O-N 3.2Å; A244-L246 VanDerWaalsContact C-N 3.34Å
247G87Confident90.2Very high3 Ų311.5 Ų11.53%0.0318%0.082CC..THydrogen-bonded Turntrans85.11.8-173.400000115.9I245 R249 A250 M251I245-G247 PolarHBondContact O-N 3.22Å; G247-R249 PolarHBondContact O-N 3.12Å; G247-A250 PolarHBondContact O-N 2.9Å; G247-A250 VanDerWaalsContact O-N 3.08Å; G247-M251 PolarHBondContact O-N 2.98Å
248L89.9Confident89.4Confident1 Ų113.2 Ų13.21%0.0059%0.092CC..Hα-helixtrans-54.3-34.7172-85.9-178.9000112.9A90 V94 W97 V119 I245 M251 Y252A90-L248 HydrophobicContact CB-CD1 4.38Å; A90-L248 HydrophobicContact CB-CD2 3.73Å; A90-L248 HydrophobicContact CB-CG 4.48Å; V94-L248 HydrophobicContact CG2-CD2 3.8Å; W97-L248 HydrophobicContact CH2-CB 4.07Å; W97-L248 HydrophobicContact CH2-CD1 3.76Å; W97-L248 HydrophobicContact CH2-CG 4.46Å; W97-L248 HydrophobicContact CZ2-CD1 4.46Å; W97-L248 HydrophobicContact CZ3-CB 4.08Å; W97-L248 HydrophobicContact CZ3-CD1 4.46Å; V119-L248 HydrophobicContact CG2-CB 4.23Å; I245-L248 HydrophobicContact CB-CD1 4.28Å; I245-L248 HydrophobicContact CG1-CD1 4.45Å; I245-L248 HydrophobicContact CG2-CD1 3.97Å; I245-L248 VanDerWaalsContact O-CB 3.23Å; I245-L248 WeakPolarHBondContact O-CB 3.23Å; I245-L248 WeakPolarHBondContact O-CG 3.26Å; I245-L248 PolarHBondContact O-N 3.47Å; L248-M251 HydrophobicContact CD2-CE 3.39Å; L248-M251 PolarHBondContact O-N 3.49Å; L248-Y252 WeakPolarHBondContact O-CB 3.44Å; L248-Y252 PolarHBondContact O-N 2.93Å
249R87.9Confident88.5Confident4 Ų414.1 Ų14.12%0.01510%0.101CC..Hα-helixtrans-64-43.8176.5-163.3-177.5-49.4134.95.7112.4D24 Q28 L115 V116 G247 M251 Y252 F253D24-R249 PolarHBondContact O-NH1 2.87Å; D24-R249 VanDerWaalsContact O-NH1 3.14Å; D24-R249 IonicContact OD1-NH1 2.91Å; D24-R249 IonicContact OD2-CZ 3.95Å; D24-R249 IonicContact OD2-NH1 2.63Å; D24-R249 PolarHBondContact OD2-NH1 3.09Å; D24-R249 IonicContact OD2-NH2 3.01Å; D24-R249 PolarHBondContact OD2-NH2 3.32Å; Q28-R249 VanDerWaalsContact OE1-CD 3.32Å; L115-R249 HydrophobicContact CB-CG 4.16Å; L115-R249 HydrophobicContact CD1-CG 4.17Å; V116-R249 VanDerWaalsContact CG2-NH2 3.31Å; G247-R249 PolarHBondContact O-N 3.12Å; R249-M251 VanDerWaalsContact C-N 3.31Å; R249-Y252 PolarHBondContact O-N 2.93Å; R249-F253 HydrophobicContact CG-CD2 4.24Å; R249-F253 HydrophobicContact CG-CE2 3.88Å; R249-F253 WeakPolarHBondContact O-CD2 3.27Å; R249-F253 PolarHBondContact O-N 2.83Å
250A88.9Confident87.4Confident0 Ų022.5 Ų22.50%014%0.14CC..Hα-helixtrans-64.8-40.9175.300000110.5A41 W44 G247 Y252 F253 L254A41-A250 WeakPolarHBondContact CB-O 3.28Å; W44-A250 HydrophobicContact CB-CB 3.63Å; G247-A250 PolarHBondContact O-N 2.9Å; G247-A250 VanDerWaalsContact O-N 3.08Å; A250-Y252 PolarHBondContact O-N 2.83Å; A250-F253 PolarHBondContact O-N 3.35Å; A250-L254 WeakPolarHBondContact O-CB 3.23Å; A250-L254 PolarHBondContact O-N 3.26Å
251M89.3Confident86.5Confident18 Ų1827.6 Ų27.69%0.08916%0.159CC..Hα-helixtrans-63.7-39176.5-165.3173.282.300112.3V91 V94 G247 L248 R249 L254 L255V91-M251 HydrophobicContact CB-CE 4.21Å; V91-M251 HydrophobicContact CG2-CE 3.71Å; V91-M251 HydrophobicContact CG2-SD 3.92Å; V94-M251 HydrophobicContact CB-CE 4.16Å; V94-M251 HydrophobicContact CG2-CE 3.5Å; G247-M251 PolarHBondContact O-N 2.98Å; L248-M251 HydrophobicContact CD2-CE 3.39Å; L248-M251 PolarHBondContact O-N 3.49Å; R249-M251 VanDerWaalsContact C-N 3.31Å; M251-L254 WeakPolarHBondContact O-CB 3.39Å; M251-L254 PolarHBondContact O-N 3.3Å; M251-L255 HydrophobicContact CG-CD1 4Å; M251-L255 HydrophobicContact CG-CG 4.35Å; M251-L255 WeakPolarHBondContact O-CB 3.38Å; M251-L255 WeakPolarHBondContact O-CG 3.32Å; M251-L255 PolarHBondContact O-N 3.47Å
252Y90.7Very high85.5Confident4 Ų429.6 Ų29.62%0.01617%0.168CC..Hα-helixtrans-57.2-53.2173.8171.5-88.7000111.4V94 W97 L98 F101 Q111 L115 L248 R249 A250 L254 L255 A256V94-Y252 HydrophobicContact CG1-CD2 4.09Å; W97-Y252 HydrophobicContact CB-CD2 4.23Å; W97-Y252 HydrophobicContact CB-CE2 4.24Å; W97-Y252 HydrophobicContact CE3-CD2 4.3Å; L98-Y252 HydrophobicContact CB-CE2 4.46Å; L98-Y252 HydrophobicContact CD2-CD2 3.98Å; L98-Y252 HydrophobicContact CD2-CE2 3.26Å; L98-Y252 HydrophobicContact CG-CD2 4.07Å; L98-Y252 HydrophobicContact CG-CE2 3.61Å; F101-Y252 AromaticContact CD2-CE2 3.59Å; F101-Y252 HydrophobicContact CD2-CE2 3.59Å; F101-Y252 AromaticContact CD2-CZ 3.54Å; F101-Y252 WeakPolarHBondContact CD2-OH 3.39Å; F101-Y252 HydrophobicContact CE2-CD2 4.49Å; F101-Y252 AromaticContact CE2-CE2 3.79Å; F101-Y252 HydrophobicContact CE2-CE2 3.79Å; F101-Y252 AromaticContact CE2-CZ 3.86Å; Q111-Y252 PolarHBondContact OE1-OH 3.46Å; L115-Y252 HydrophobicContact CD1-CD1 3.34Å; L115-Y252 HydrophobicContact CD1-CD2 4.25Å; L115-Y252 HydrophobicContact CD1-CE1 3.8Å; L115-Y252 HydrophobicContact CD1-CG 3.61Å; L115-Y252 HydrophobicContact CD2-CD2 4.34Å; L115-Y252 HydrophobicContact CD2-CG 4.33Å; L248-Y252 WeakPolarHBondContact O-CB 3.44Å; L248-Y252 PolarHBondContact O-N 2.93Å; R249-Y252 PolarHBondContact O-N 2.93Å; A250-Y252 PolarHBondContact O-N 2.83Å; Y252-L254 PolarHBondContact O-N 3.41Å; Y252-L255 PolarHBondContact O-N 3.11Å; Y252-L255 VanDerWaalsContact O-N 3.15Å; Y252-A256 HydrophobicContact CE1-CB 4.44Å; Y252-A256 WeakPolarHBondContact O-CB 3.24Å; Y252-A256 PolarHBondContact O-N 2.97Å
253F86.8Confident84.4Confident22 Ų2232.2 Ų32.210%0.09619%0.187CC..Hα-helixtrans-67.7-25.3180-71.5-65.9000112.9A35 M36 A41 R112 L115 R249 A250A35-F253 HydrophobicContact CB-CE1 4.39Å; M36-F253 HydrophobicContact CB-CB 4.05Å; M36-F253 HydrophobicContact CB-CD2 3.97Å; M36-F253 HydrophobicContact CB-CG 3.94Å; A41-F253 HydrophobicContact CB-CB 3.97Å; R112-F253 HydrophobicContact CB-CZ 4.2Å; L115-F253 HydrophobicContact CD1-CE2 4.3Å; L115-F253 HydrophobicContact CD1-CZ 4.35Å; R249-F253 HydrophobicContact CG-CD2 4.24Å; R249-F253 HydrophobicContact CG-CE2 3.88Å; R249-F253 WeakPolarHBondContact O-CD2 3.27Å; R249-F253 PolarHBondContact O-N 2.83Å; A250-F253 PolarHBondContact O-N 3.35Å
254L86.6Confident83.7Confident39 Ų3934.5 Ų34.520%0.20420%0.198CC..Hα-helixtrans-68.8-45.8171.4-172.474.8000111M38 A41 A42 A250 M251 Y252 V258M38-L254 HydrophobicContact CE-CD1 3.4Å; M38-L254 HydrophobicContact CE-CG 3.87Å; M38-L254 WeakPolarHBondContact CE-O 3.39Å; M38-L254 HydrophobicContact SD-CD1 3.66Å; M38-L254 HydrophobicContact SD-CG 4.26Å; A41-L254 HydrophobicContact CB-CB 3.98Å; A41-L254 HydrophobicContact CB-CD1 4.32Å; A42-L254 HydrophobicContact CB-CD1 3.66Å; A250-L254 WeakPolarHBondContact O-CB 3.23Å; A250-L254 PolarHBondContact O-N 3.26Å; M251-L254 WeakPolarHBondContact O-CB 3.39Å; M251-L254 PolarHBondContact O-N 3.3Å; Y252-L254 PolarHBondContact O-N 3.41Å; L254-V258 WeakPolarHBondContact O-CG2 3.25Å
255L86.5Confident83.2Confident13 Ų1335.2 Ų35.27%0.06820%0.202CC..Hα-helixtrans-81.4-25.4-175.8-67.6179.2000113.2V91 V94 L98 M251 Y252 G257 V258 A259 F262V91-L255 HydrophobicContact CG1-CD1 3.82Å; V94-L255 HydrophobicContact CG1-CB 4.27Å; V94-L255 HydrophobicContact CG1-CD1 3.94Å; L98-L255 HydrophobicContact CD1-CB 4.42Å; M251-L255 HydrophobicContact CG-CD1 4Å; M251-L255 HydrophobicContact CG-CG 4.35Å; M251-L255 WeakPolarHBondContact O-CB 3.38Å; M251-L255 WeakPolarHBondContact O-CG 3.32Å; M251-L255 PolarHBondContact O-N 3.47Å; Y252-L255 PolarHBondContact O-N 3.11Å; Y252-L255 VanDerWaalsContact O-N 3.15Å; L255-G257 PolarHBondContact O-N 2.96Å; L255-G257 VanDerWaalsContact O-N 3.11Å; L255-V258 HydrophobicContact CD2-CG2 4.13Å; L255-V258 CarbonylContact O-C 3.59Å; L255-V258 PolarHBondContact O-N 2.89Å; L255-A259 WeakPolarHBondContact O-CA 3.38Å; L255-A259 WeakPolarHBondContact O-CB 3.25Å; L255-A259 PolarHBondContact O-N 3.2Å; L255-F262 HydrophobicContact CD2-CD2 3.98Å; L255-F262 HydrophobicContact CD2-CE2 3.9Å; L255-F262 HydrophobicContact CD2-CZ 4.5Å
256A83.9Confident82.9Confident44 Ų4436.6 Ų36.636%0.36421%0.208SC..THydrogen-bonded Turntrans-54.7-35.2-177.400000113.6L98 Y252L98-A256 HydrophobicContact CD2-CB 3.64Å; Y252-A256 HydrophobicContact CE1-CB 4.44Å; Y252-A256 WeakPolarHBondContact O-CB 3.24Å; Y252-A256 PolarHBondContact O-N 2.97Å
257G77.1Confident82.9Confident68 Ų6842 Ų4270%0.70123%0.229SC*.THydrogen-bonded Turntrans-85.4-7.9178.600000115.3L255L255-G257 PolarHBondContact O-N 2.96Å; L255-G257 VanDerWaalsContact O-N 3.11Å
258V78Confident83.1Confident35 Ų3542.1 Ų42.121%0.21223%0.229CC..THydrogen-bonded Turntrans-133.16.8-172.4-66.80000112.7M38 L254 L255 E260 R261 F262M38-V258 HydrophobicContact CE-CG1 4.16Å; M38-V258 HydrophobicContact CE-CG2 4.33Å; L254-V258 WeakPolarHBondContact O-CG2 3.25Å; L255-V258 HydrophobicContact CD2-CG2 4.13Å; L255-V258 CarbonylContact O-C 3.59Å; L255-V258 PolarHBondContact O-N 2.89Å; V258-E260 VanDerWaalsContact C-N 3.27Å; V258-E260 PolarHBondContact O-N 3.17Å; V258-R261 VanDerWaalsContact O-CB 3.31Å; V258-R261 WeakPolarHBondContact O-CB 3.35Å; V258-R261 PolarHBondContact O-N 3.46Å; V258-F262 HydrophobicContact CB-CD2 4.27Å; V258-F262 HydrophobicContact CB-CE2 3.95Å; V258-F262 HydrophobicContact CG2-CD2 3.96Å; V258-F262 HydrophobicContact CG2-CE2 3.53Å; V258-F262 WeakPolarHBondContact O-CD2 3.27Å
259A76.4Confident83.1Confident27 Ų2742.5 Ų42.522%0.22323%0.231CC..G310 helixtrans-53.8-42.4-170.900000112.8F95 L98 L255 R261 F262F95-A259 HydrophobicContact CE1-CB 4.15Å; L98-A259 HydrophobicContact CD1-CB 3.75Å; L255-A259 WeakPolarHBondContact O-CA 3.38Å; L255-A259 WeakPolarHBondContact O-CB 3.25Å; L255-A259 PolarHBondContact O-N 3.2Å; A259-R261 PolarHBondContact O-N 2.97Å; A259-F262 PolarHBondContact O-N 2.71Å; A259-F262 VanDerWaalsContact O-N 3.11Å
260E71.8Confident83.3Confident176 Ų17642.4 Ų42.482%0.82223%0.231SC*.G310 helixtrans-59.5-27.6177.8-64.3179.4-175.900113.2V258 F262V258-E260 VanDerWaalsContact C-N 3.27Å; V258-E260 PolarHBondContact O-N 3.17Å; E260-F262 VanDerWaalsContact C-N 3.31Å; E260-F262 PolarHBondContact O-N 2.83Å
261R75Confident83.6Confident106 Ų10646.1 Ų46.140%0.425%0.254SS..G310 helixtrans-74.9-24.3-179-55.9-169.2169.2-128.3-19.6111.7V258 A259 N308 N312 D316V258-R261 VanDerWaalsContact O-CB 3.31Å; V258-R261 WeakPolarHBondContact O-CB 3.35Å; V258-R261 PolarHBondContact O-N 3.46Å; A259-R261 PolarHBondContact O-N 2.97Å; R261-N308 PolarHBondContact O-ND2 3.13Å; R261-N308 PolarHBondContact O-OD1 2.86Å; R261-N312 VanDerWaalsContact CD-OD1 3.24Å; R261-N312 WeakPolarHBondContact CD-OD1 3.28Å; R261-N312 WeakPolarHBondContact CG-OD1 3.28Å; R261-N312 PolarHBondContact NH1-ND2 3.35Å; R261-D316 IonicContact CZ-OD1 3.5Å; R261-D316 IonicContact CZ-OD2 2.77Å; R261-D316 IonicContact NH1-OD1 2.85Å; R261-D316 IonicContact NH1-OD2 3.12Å; R261-D316 PolarHBondContact NH1-OD2 2.94Å; R261-D316 IonicContact NH2-OD1 3.35Å; R261-D316 PolarHBondContact NH2-OD1 3.48Å; R261-D316 VanDerWaalsContact NH2-OD1 3.12Å; R261-D316 IonicContact NH2-OD2 3.88Å; R261-D316 PolarHBondContact NH2-OD2 3.05Å
262F75.4Confident83.8Confident44 Ų4445.3 Ų45.319%0.19325%0.25CS..G310 helixtrans-98.816.2-168.8-75.6-74.8000115.3F95 L255 V258 A259 E260 M264 L265 F305 N308F95-F262 HydrophobicContact CE1-CB 4.28Å; F95-F262 HydrophobicContact CZ-CB 3.57Å; L255-F262 HydrophobicContact CD2-CD2 3.98Å; L255-F262 HydrophobicContact CD2-CE2 3.9Å; L255-F262 HydrophobicContact CD2-CZ 4.5Å; V258-F262 HydrophobicContact CB-CD2 4.27Å; V258-F262 HydrophobicContact CB-CE2 3.95Å; V258-F262 HydrophobicContact CG2-CD2 3.96Å; V258-F262 HydrophobicContact CG2-CE2 3.53Å; V258-F262 WeakPolarHBondContact O-CD2 3.27Å; A259-F262 PolarHBondContact O-N 2.71Å; A259-F262 VanDerWaalsContact O-N 3.11Å; E260-F262 VanDerWaalsContact C-N 3.31Å; E260-F262 PolarHBondContact O-N 2.83Å; F262-M264 PolarHBondContact O-N 3.23Å; F262-L265 HydrophobicContact CB-CD1 3.75Å; F262-L265 HydrophobicContact CB-CG 4.09Å; F262-L265 HydrophobicContact CD1-CD1 3.65Å; F262-L265 HydrophobicContact CD1-CD2 4.33Å; F262-L265 HydrophobicContact CD1-CG 3.93Å; F262-L265 HydrophobicContact CG-CD1 3.98Å; F262-L265 HydrophobicContact CG-CG 4.46Å; F262-L265 WeakPolarHBondContact O-CB 3.25Å; F262-L265 WeakPolarHBondContact O-CG 3.33Å; F262-L265 PolarHBondContact O-N 2.83Å; F262-F305 HydrophobicContact CE1-CD1 4.04Å; F262-F305 HydrophobicContact CE1-CE1 4.12Å; F262-N308 WeakPolarHBondContact CA-ND2 3.44Å; F262-N308 WeakPolarHBondContact CD1-OD1 3.45Å
263S71.9Confident83.9Confident61 Ų6145.3 Ų45.343%0.42725%0.25SS..THydrogen-bonded Turntrans-55-25.1-178.6600000114.6L265S263-L265 VanDerWaalsContact C-N 3.33Å; S263-L265 PolarHBondContact O-N 2.86Å
264M79.3Confident84.4Confident49 Ų4946 Ų4624%0.24126%0.256CS..THydrogen-bonded Turntrans-79.6-10.3179.5-58.1-173.9177.600114.6F262 K266 Y267 I307 V311F262-M264 PolarHBondContact O-N 3.23Å; M264-K266 PolarHBondContact O-N 3.45Å; M264-Y267 HydrophobicContact CB-CD2 4.38Å; M264-Y267 PolarHBondContact O-N 2.79Å; M264-Y267 VanDerWaalsContact O-N 3.1Å; M264-I307 HydrophobicContact SD-CG2 4.06Å; M264-V311 HydrophobicContact CE-CB 3.62Å; M264-V311 HydrophobicContact CE-CG1 3.27Å; M264-V311 HydrophobicContact CE-CG2 3.62Å; M264-V311 HydrophobicContact SD-CB 3.9Å; M264-V311 HydrophobicContact SD-CG1 4.24Å; M264-V311 HydrophobicContact SD-CG2 3.67Å
265L84Confident84.8Confident16 Ų1646 Ų468%0.08426%0.255CS..Hα-helixtrans-58.3-31.4-179.4-74.9-178.7000112.4V91 F95 F262 S263 Y267 G268 L269 T304 F305V91-L265 HydrophobicContact CG1-CD1 3.8Å; F95-L265 HydrophobicContact CE2-CD1 3.93Å; F95-L265 HydrophobicContact CZ-CD1 4.16Å; F262-L265 HydrophobicContact CB-CD1 3.75Å; F262-L265 HydrophobicContact CB-CG 4.09Å; F262-L265 HydrophobicContact CD1-CD1 3.65Å; F262-L265 HydrophobicContact CD1-CD2 4.33Å; F262-L265 HydrophobicContact CD1-CG 3.93Å; F262-L265 HydrophobicContact CG-CD1 3.98Å; F262-L265 HydrophobicContact CG-CG 4.46Å; F262-L265 WeakPolarHBondContact O-CB 3.25Å; F262-L265 WeakPolarHBondContact O-CG 3.33Å; F262-L265 PolarHBondContact O-N 2.83Å; S263-L265 VanDerWaalsContact C-N 3.33Å; S263-L265 PolarHBondContact O-N 2.86Å; L265-Y267 PolarHBondContact O-N 3.42Å; L265-Y267 VanDerWaalsContact O-N 3.17Å; L265-G268 PolarHBondContact O-N 3.43Å; L265-L269 WeakPolarHBondContact O-CG 3.33Å; L265-L269 PolarHBondContact O-N 3.39Å; L265-T304 HydrophobicContact CD2-CG2 3.73Å; L265-F305 HydrophobicContact CD2-CD1 4.07Å; L265-F305 HydrophobicContact CD2-CE1 3.8Å
266K85.5Confident85.1Confident37 Ų3745.6 Ų45.616%0.16125%0.252CS..Hα-helixtrans-53.6-36.3176.872.5-174.2-173.4-174.80113.1M158 E163 M264 A270M158-K266 HydrophobicContact CE-CB 3.96Å; E163-K266 IonicContact OE1-NZ 2.92Å; E163-K266 PolarHBondContact OE1-NZ 3.46Å; M264-K266 PolarHBondContact O-N 3.45Å; K266-A270 VanDerWaalsContact O-CB 3.29Å; K266-A270 WeakPolarHBondContact O-CB 3.36Å; K266-A270 PolarHBondContact O-N 2.89Å
267Y89.3Confident85.6Confident116 Ų11643.5 Ų43.546%0.45524%0.235SC..Hα-helixtrans-72.6-38.2178.8-61.2-67.5000111.6M264 L265 A270 V271M264-Y267 HydrophobicContact CB-CD2 4.38Å; M264-Y267 PolarHBondContact O-N 2.79Å; M264-Y267 VanDerWaalsContact O-N 3.1Å; L265-Y267 PolarHBondContact O-N 3.42Å; L265-Y267 VanDerWaalsContact O-N 3.17Å; Y267-A270 PolarHBondContact O-N 3.41Å; Y267-V271 VanDerWaalsContact O-CG2 3.29Å; Y267-V271 WeakPolarHBondContact O-CG2 3.43Å; Y267-V271 PolarHBondContact O-N 2.77Å
268G90.7Very high86.5Confident4 Ų443.8 Ų43.84%0.04122%0.22CC..Hα-helixtrans-61.8-46173.700000111.9L265 V271 I272 I300 T304L265-G268 PolarHBondContact O-N 3.43Å; G268-V271 PolarHBondContact O-N 3.04Å; G268-I272 WeakPolarHBondContact O-CG1 3.39Å; G268-I272 PolarHBondContact O-N 3.38Å; G268-I300 WeakPolarHBondContact O-CG2 3.38Å; G268-T304 VanDerWaalsContact CA-OG1 3.27Å; G268-T304 WeakPolarHBondContact CA-OG1 3.48Å
269L89.8Confident87.2Confident9 Ų942.9 Ų42.95%0.04721%0.213CC..Hα-helixtrans-63.2-42.9176.4-61.7-178.6000111.9S88 L89 D92 M158 L265 V271 I272 L273S88-L269 WeakPolarHBondContact O-CD2 3.48Å; L89-L269 HydrophobicContact CD2-CD2 4.35Å; D92-L269 HydrophobicContact CB-CD1 3.92Å; M158-L269 HydrophobicContact CE-CB 4.05Å; M158-L269 HydrophobicContact CE-CD1 4.17Å; M158-L269 HydrophobicContact SD-CB 4.09Å; L265-L269 WeakPolarHBondContact O-CG 3.33Å; L265-L269 PolarHBondContact O-N 3.39Å; L269-V271 VanDerWaalsContact C-N 3.34Å; L269-V271 PolarHBondContact O-N 3.16Å; L269-I272 WeakPolarHBondContact O-CB 3.31Å; L269-I272 PolarHBondContact O-N 3.01Å; L269-L273 WeakPolarHBondContact O-CG 3.41Å; L269-L273 PolarHBondContact O-N 3.23Å
270A92.5Very high87.9Confident2 Ų242 Ų422%0.01720%0.204CC..Hα-helixtrans-57.3-45.4175.200000112.1G155 M158 A159 K266 Y267 I272 L273 V274G155-A270 WeakPolarHBondContact O-CB 3.3Å; M158-A270 HydrophobicContact CB-CB 4.09Å; M158-A270 HydrophobicContact CG-CB 4.19Å; M158-A270 HydrophobicContact SD-CB 4.17Å; A159-A270 HydrophobicContact CB-CB 3.96Å; K266-A270 VanDerWaalsContact O-CB 3.29Å; K266-A270 WeakPolarHBondContact O-CB 3.36Å; K266-A270 PolarHBondContact O-N 2.89Å; Y267-A270 PolarHBondContact O-N 3.41Å; A270-I272 PolarHBondContact O-N 2.85Å; A270-L273 PolarHBondContact O-N 2.98Å; A270-V274 WeakPolarHBondContact O-CG2 3.33Å; A270-V274 PolarHBondContact O-N 3.42Å
271V94.9Very high88.9Confident79 Ų7935.9 Ų35.948%0.47918%0.177SC..Hα-helixtrans-65-39.6177.6176.40000111.4Y267 G268 L269 V274 F275 I300Y267-V271 VanDerWaalsContact O-CG2 3.29Å; Y267-V271 WeakPolarHBondContact O-CG2 3.43Å; Y267-V271 PolarHBondContact O-N 2.77Å; G268-V271 PolarHBondContact O-N 3.04Å; L269-V271 VanDerWaalsContact C-N 3.34Å; L269-V271 PolarHBondContact O-N 3.16Å; V271-V274 PolarHBondContact O-N 2.87Å; V271-F275 WeakPolarHBondContact O-CB 3.37Å; V271-F275 PolarHBondContact O-N 2.9Å; V271-I300 HydrophobicContact CB-CG2 4.31Å; V271-I300 HydrophobicContact CG1-CD1 3.74Å; V271-I300 HydrophobicContact CG1-CG1 4.09Å; V271-I300 HydrophobicContact CG1-CG2 4.34Å
272I93.6Very high89.8Confident0 Ų033.4 Ų33.40%017%0.171CC..Hα-helixtrans-60.6-48.2174.6-70.6167000110.6G268 L269 A270 F275 I276 V297 I300 L301G268-I272 WeakPolarHBondContact O-CG1 3.39Å; G268-I272 PolarHBondContact O-N 3.38Å; L269-I272 WeakPolarHBondContact O-CB 3.31Å; L269-I272 PolarHBondContact O-N 3.01Å; A270-I272 PolarHBondContact O-N 2.85Å; I272-F275 PolarHBondContact O-N 3.41Å; I272-I276 HydrophobicContact CG2-CD1 3.52Å; I272-I276 HydrophobicContact CG2-CG1 4.36Å; I272-I276 WeakPolarHBondContact O-CB 3.3Å; I272-I276 VanDerWaalsContact O-CG1 3.25Å; I272-I276 WeakPolarHBondContact O-CG1 3.38Å; I272-I276 PolarHBondContact O-N 3.41Å; I272-V297 HydrophobicContact CD1-CG1 4.32Å; I272-V297 HydrophobicContact CG2-CG2 4.41Å; I272-I300 HydrophobicContact CD1-CB 4.48Å; I272-I300 HydrophobicContact CD1-CG2 4.12Å; I272-I300 HydrophobicContact CG1-CB 4.08Å; I272-I300 HydrophobicContact CG1-CD1 3.95Å; I272-I300 HydrophobicContact CG1-CG2 3.77Å; I272-L301 HydrophobicContact CD1-CD2 3.61Å; I272-L301 HydrophobicContact CD1-CG 3.95Å
273L93.1Very high90.3Very high4 Ų433.6 Ų33.62%0.02118%0.176CC..Hα-helixtrans-61.1-45.9179-71.8170.7000111.9L89 L151 M158 D222 L269 A270 F275 I276 G277L89-L273 HydrophobicContact CD1-CD2 4.45Å; L89-L273 HydrophobicContact CD2-CD2 4.16Å; L89-L273 HydrophobicContact CD2-CG 4.35Å; L151-L273 HydrophobicContact CD2-CD2 3.71Å; M158-L273 HydrophobicContact SD-CD1 4.23Å; D222-L273 HydrophobicContact CB-CD2 4.33Å; L269-L273 WeakPolarHBondContact O-CG 3.41Å; L269-L273 PolarHBondContact O-N 3.23Å; A270-L273 PolarHBondContact O-N 2.98Å; L273-F275 PolarHBondContact O-N 2.86Å; L273-I276 PolarHBondContact O-N 3.36Å; L273-G277 PolarHBondContact O-N 3.38Å
274V96.1Very high90.8Very high36 Ų3636.7 Ų36.722%0.21819%0.188CC..Hα-helixtrans-60.2-46.9176167.20000111.2L152 V156 A270 V271 I276 G277 I278L152-V274 HydrophobicContact CD1-CB 4.28Å; L152-V274 HydrophobicContact CD1-CG1 3.74Å; L152-V274 HydrophobicContact CD1-CG2 4.24Å; V156-V274 HydrophobicContact CG2-CG2 3.93Å; A270-V274 WeakPolarHBondContact O-CG2 3.33Å; A270-V274 PolarHBondContact O-N 3.42Å; V271-V274 PolarHBondContact O-N 2.87Å; V274-I276 PolarHBondContact O-N 3.23Å; V274-G277 PolarHBondContact O-N 2.94Å; V274-I278 HydrophobicContact CG1-CD1 3.75Å; V274-I278 HydrophobicContact CG1-CG1 4.49Å; V274-I278 WeakPolarHBondContact O-CB 3.24Å; V274-I278 VanDerWaalsContact O-CG1 3.26Å; V274-I278 WeakPolarHBondContact O-CG1 3.35Å; V274-I278 PolarHBondContact O-N 2.87Å
275F95.8Very high91.2Very high40 Ų4042.8 Ų42.818%0.17521%0.213CC..Hα-helixtrans-60.5-47.2178.6169.2-106.1000111.9V271 I272 L273 I278 K279 I288 V296V271-F275 WeakPolarHBondContact O-CB 3.37Å; V271-F275 PolarHBondContact O-N 2.9Å; I272-F275 PolarHBondContact O-N 3.41Å; L273-F275 PolarHBondContact O-N 2.86Å; F275-I278 PolarHBondContact O-N 3.34Å; F275-K279 WeakPolarHBondContact O-CB 3.49Å; F275-K279 PolarHBondContact O-N 3.29Å; F275-I288 HydrophobicContact CE2-CD1 4.42Å; F275-V296 HydrophobicContact CD1-CB 4.43Å; F275-V296 HydrophobicContact CD1-CG1 3.78Å; F275-V296 HydrophobicContact CD2-CG1 3.9Å; F275-V296 HydrophobicContact CE1-CB 3.92Å; F275-V296 HydrophobicContact CE1-CG1 3.76Å; F275-V296 HydrophobicContact CE2-CB 4.28Å; F275-V296 HydrophobicContact CE2-CG1 3.88Å; F275-V296 HydrophobicContact CE2-CG2 4.22Å; F275-V296 HydrophobicContact CG-CG1 3.85Å; F275-V296 HydrophobicContact CZ-CB 3.84Å; F275-V296 HydrophobicContact CZ-CG1 3.81Å; F275-V296 HydrophobicContact CZ-CG2 4.02Å
276I93.5Very high91.2Very high4 Ų449.1 Ų49.12%0.02124%0.237CC..Hα-helixtrans-66.7-41.4179.8-65.2168000110.8I85 L151 A226 A229 I272 L273 V274 I278 K279 M280I85-I276 HydrophobicContact CD1-CD1 3.53Å; I85-I276 HydrophobicContact CD1-CG1 4.41Å; I85-I276 HydrophobicContact CG1-CD1 3.79Å; I85-I276 HydrophobicContact CG2-CD1 3.98Å; L151-I276 HydrophobicContact CD1-CG2 3.9Å; A226-I276 HydrophobicContact CB-CD1 4.17Å; A226-I276 HydrophobicContact CB-CG2 4.12Å; A229-I276 HydrophobicContact CB-CG2 3.45Å; A229-I276 VanDerWaalsContact CB-CG2 3.45Å; I272-I276 HydrophobicContact CG2-CD1 3.52Å; I272-I276 HydrophobicContact CG2-CG1 4.36Å; I272-I276 WeakPolarHBondContact O-CB 3.3Å; I272-I276 VanDerWaalsContact O-CG1 3.25Å; I272-I276 WeakPolarHBondContact O-CG1 3.38Å; I272-I276 PolarHBondContact O-N 3.41Å; L273-I276 PolarHBondContact O-N 3.36Å; V274-I276 PolarHBondContact O-N 3.23Å; I276-I278 PolarHBondContact O-N 3.41Å; I276-K279 WeakPolarHBondContact O-CB 3.19Å; I276-K279 PolarHBondContact O-N 2.87Å; I276-M280 WeakPolarHBondContact O-CB 3.37Å; I276-M280 PolarHBondContact O-N 3.41Å
277G94.6Very high91.1Very high0 Ų053.9 Ų53.90%026%0.26CS..Hα-helixtrans-58.9-46.4175.400000112.1G148 L273 V274 M280 L281G148-G277 VanDerWaalsContact O-CA 3.3Å; G148-G277 WeakPolarHBondContact O-CA 3.3Å; L273-G277 PolarHBondContact O-N 3.38Å; V274-G277 PolarHBondContact O-N 2.94Å; G277-M280 PolarHBondContact O-N 3.01Å; G277-L281 VanDerWaalsContact O-CG 3.3Å; G277-L281 WeakPolarHBondContact O-CG 3.36Å; G277-L281 PolarHBondContact O-N 3.39Å
278I95.3Very high91.1Very high75 Ų7549.4 Ų49.439%0.38524%0.243SC..Hα-helixtrans-61.2-49.3174.9-69.2166.6000110.9L152 V274 F275 I276 M280 L281 I282L152-I278 HydrophobicContact CD1-CD1 4.34Å; L152-I278 HydrophobicContact CD1-CG1 4Å; V274-I278 HydrophobicContact CG1-CD1 3.75Å; V274-I278 HydrophobicContact CG1-CG1 4.49Å; V274-I278 WeakPolarHBondContact O-CB 3.24Å; V274-I278 VanDerWaalsContact O-CG1 3.26Å; V274-I278 WeakPolarHBondContact O-CG1 3.35Å; V274-I278 PolarHBondContact O-N 2.87Å; F275-I278 PolarHBondContact O-N 3.34Å; I276-I278 PolarHBondContact O-N 3.41Å; I278-M280 PolarHBondContact O-N 3.46Å; I278-L281 PolarHBondContact O-N 2.92Å; I278-L281 VanDerWaalsContact O-N 3.13Å; I278-I282 HydrophobicContact CG2-CD1 4.45Å; I278-I282 HydrophobicContact CG2-CG2 4.43Å; I278-I282 WeakPolarHBondContact O-CG1 3.37Å; I278-I282 PolarHBondContact O-N 2.88Å
279K92.9Very high91.1Very high16 Ų1652.1 Ų52.17%0.0726%0.26CS..Hα-helixtrans-51.9-44.4177.4173.8-175.3177.1-162.70111.3A229 F275 I276 V283 I288 S293A229-K279 VanDerWaalsContact O-CE 3.28Å; A229-K279 WeakPolarHBondContact O-CE 3.29Å; A229-K279 PolarHBondContact O-NZ 2.96Å; F275-K279 WeakPolarHBondContact O-CB 3.49Å; F275-K279 PolarHBondContact O-N 3.29Å; I276-K279 WeakPolarHBondContact O-CB 3.19Å; I276-K279 PolarHBondContact O-N 2.87Å; K279-V283 PolarHBondContact O-N 3Å; K279-I288 HydrophobicContact CB-CD1 3.96Å; K279-I288 HydrophobicContact CD-CB 4.35Å; K279-I288 HydrophobicContact CG-CB 4.14Å; K279-I288 HydrophobicContact CG-CD1 4Å; K279-I288 HydrophobicContact CG-CG1 4.35Å; K279-S293 WeakPolarHBondContact CD-OG 3.18Å; K279-S293 WeakPolarHBondContact CE-OG 3.41Å; K279-S293 PolarHBondContact NZ-OG 2.82Å
280M91Very high91.1Very high7 Ų753.2 Ų53.23%0.03427%0.266CS..Hα-helixtrans-70.5-38.1-177.7-158.9176-160.100112L144 F147 G148 L151 F228 A229 I276 G277 I278 I282 V283L144-M280 HydrophobicContact CB-CE 3.85Å; L144-M280 HydrophobicContact CB-CG 4.26Å; L144-M280 HydrophobicContact CD2-CE 3.26Å; L144-M280 HydrophobicContact CG-CE 4.13Å; L144-M280 VanDerWaalsContact O-CG 3.24Å; L144-M280 WeakPolarHBondContact O-CG 3.25Å; F147-M280 HydrophobicContact CB-CE 3.49Å; F147-M280 VanDerWaalsContact CB-CE 3.49Å; F147-M280 HydrophobicContact CB-SD 3.57Å; F147-M280 VanDerWaalsContact CB-SD 3.57Å; F147-M280 HydrophobicContact CD2-CE 3.97Å; F147-M280 HydrophobicContact CG-CE 4.26Å; G148-M280 PolarHBondContact N-SD 3.02Å; L151-M280 HydrophobicContact CD1-SD 4.46Å; F228-M280 HydrophobicContact CB-CE 4.4Å; A229-M280 HydrophobicContact CB-CB 3.98Å; A229-M280 HydrophobicContact CB-CE 4.17Å; A229-M280 HydrophobicContact CB-CG 3.93Å; A229-M280 HydrophobicContact CB-SD 3.82Å; I276-M280 WeakPolarHBondContact O-CB 3.37Å; I276-M280 PolarHBondContact O-N 3.41Å; G277-M280 PolarHBondContact O-N 3.01Å; I278-M280 PolarHBondContact O-N 3.46Å; M280-I282 VanDerWaalsContact C-N 3.34Å; M280-I282 PolarHBondContact O-N 3.44Å; M280-V283 WeakPolarHBondContact O-CG1 3.01Å
281L93.5Very high91.1Very high48 Ų4855.7 Ų55.725%0.25129%0.286SS..Hα-helixtrans-69.1-27.3176.8-73.5173000114Y145 A149 L152 G277 I278Y145-L281 HydrophobicContact CD1-CD2 4.16Å; Y145-L281 VanDerWaalsContact CE1-O 3.23Å; Y145-L281 WeakPolarHBondContact CE1-O 3.25Å; Y145-L281 WeakPolarHBondContact O-CD2 3.46Å; A149-L281 HydrophobicContact CB-CD2 4.13Å; L152-L281 HydrophobicContact CB-CD1 4.49Å; L152-L281 HydrophobicContact CD2-CD1 3.87Å; G277-L281 VanDerWaalsContact O-CG 3.3Å; G277-L281 WeakPolarHBondContact O-CG 3.36Å; G277-L281 PolarHBondContact O-N 3.39Å; I278-L281 PolarHBondContact O-N 2.92Å; I278-L281 VanDerWaalsContact O-N 3.13Å
282I92.6Very high91Very high55 Ų5555.5 Ų55.528%0.28229%0.285SS..THydrogen-bonded Turntrans-986.8-178.371.7178.8000113.4I278 M280 D284 F285 Y286 I288I278-I282 HydrophobicContact CG2-CD1 4.45Å; I278-I282 HydrophobicContact CG2-CG2 4.43Å; I278-I282 WeakPolarHBondContact O-CG1 3.37Å; I278-I282 PolarHBondContact O-N 2.88Å; M280-I282 VanDerWaalsContact C-N 3.34Å; M280-I282 PolarHBondContact O-N 3.44Å; I282-D284 VanDerWaalsContact C-N 3.28Å; I282-D284 PolarHBondContact O-N 2.94Å; I282-D284 VanDerWaalsContact O-N 3.13Å; I282-F285 PolarHBondContact O-N 2.66Å; I282-Y286 HydrophobicContact CD1-CD1 4.34Å; I282-Y286 PolarHBondContact O-N 3.12Å; I282-I288 HydrophobicContact CD1-CD1 4Å; I282-I288 HydrophobicContact CD1-CG1 4.33Å
283V86.3Confident90.9Very high47 Ų4755.6 Ų55.629%0.28529%0.286SS..THydrogen-bonded Turntrans-53.8-38.6-167.568.10000114.3K279 M280K279-V283 PolarHBondContact O-N 3Å; M280-V283 WeakPolarHBondContact O-CG1 3.01Å
284D83.1Confident90.9Very high127 Ų12756.7 Ų56.768%0.67929%0.291SS*.THydrogen-bonded Turntrans-78.2-23.4179.9-75.61.4000113.6Y145 I282Y145-D284 VanDerWaalsContact OH-CB 3.28Å; Y145-D284 WeakPolarHBondContact OH-CB 3.18Å; Y145-D284 PolarHBondContact OH-OD2 2.81Å; I282-D284 VanDerWaalsContact C-N 3.28Å; I282-D284 PolarHBondContact O-N 2.94Å; I282-D284 VanDerWaalsContact O-N 3.13Å
285F86.1Confident90.9Very high177 Ų17757.1 Ų57.178%0.77630%0.303SS*.THydrogen-bonded Turntrans-93.9-37.1-178.8-58.1-78.7000112.1I282I282-F285 PolarHBondContact O-N 2.66Å
286Y85Confident90.8Very high149 Ų14957.5 Ų57.558%0.58431%0.309SS*.  trans-150.4112.8-175.8-171.4-99.4000111.2I282 I288I282-Y286 HydrophobicContact CD1-CD1 4.34Å; I282-Y286 PolarHBondContact O-N 3.12Å; Y286-I288 HydrophobicContact CD1-CG1 3.74Å; Y286-I288 HydrophobicContact CE1-CG1 3.86Å; Y286-I288 PolarHBondContact O-N 3.49Å
287H84.4Confident90.8Very high136 Ų13657.3 Ų57.363%0.6331%0.308SS*.  trans-84106177.6-162.680.5000110.8P289H287-P289 WeakPolarHBondContact O-CD 3.47Å
288I87.5Confident90.8Very high23 Ų2362.9 Ų62.912%0.11833%0.332CS..  trans-74.2119.4174.7-59.7-177.7000109.2F275 K279 I282 Y286 V292F275-I288 HydrophobicContact CE2-CD1 4.42Å; K279-I288 HydrophobicContact CB-CD1 3.96Å; K279-I288 HydrophobicContact CD-CB 4.35Å; K279-I288 HydrophobicContact CG-CB 4.14Å; K279-I288 HydrophobicContact CG-CD1 4Å; K279-I288 HydrophobicContact CG-CG1 4.35Å; I282-I288 HydrophobicContact CD1-CD1 4Å; I282-I288 HydrophobicContact CD1-CG1 4.33Å; Y286-I288 HydrophobicContact CD1-CG1 3.74Å; Y286-I288 HydrophobicContact CE1-CG1 3.86Å; Y286-I288 PolarHBondContact O-N 3.49Å; I288-V292 HydrophobicContact CG2-CB 4.03Å; I288-V292 HydrophobicContact CG2-CG1 4.03Å
289P90.7Very high90.9Very high61 Ų6160.9 Ų60.940%0.39633%0.33SS..  trans-58.5145.1178.5-22.933.1000112.2H287 A291 V292 S293H287-P289 WeakPolarHBondContact O-CD 3.47Å; P289-A291 PolarHBondContact O-N 3.02Å; P289-V292 HydrophobicContact CB-CG2 4.18Å; P289-V292 HydrophobicContact CG-CG2 4.23Å; P289-V292 WeakPolarHBondContact O-CB 3.33Å; P289-V292 PolarHBondContact O-N 2.84Å; P289-S293 PolarHBondContact O-N 3.47Å; P289-S293 VanDerWaalsContact O-N 3.07Å; P289-S293 PolarHBondContact O-OG 3.29Å
290I89.9Confident90.9Very high32 Ų3261.3 Ų61.316%0.16433%0.333CS..Hα-helixtrans-59.5-37.7-179.5-60.2163.1000110.9P74 L77 A78 V230 V292 S293 L294P74-I290 HydrophobicContact CB-CD1 4.32Å; L77-I290 HydrophobicContact CB-CG2 3.87Å; A78-I290 HydrophobicContact CB-CD1 4.28Å; A78-I290 HydrophobicContact CB-CG2 4.44Å; V230-I290 HydrophobicContact CG1-CG2 4.38Å; I290-V292 VanDerWaalsContact C-N 3.29Å; I290-V292 PolarHBondContact O-N 2.97Å; I290-S293 WeakPolarHBondContact O-CB 3.34Å; I290-S293 PolarHBondContact O-N 3.33Å; I290-S293 VanDerWaalsContact O-N 3.12Å; I290-L294 PolarHBondContact O-N 2.82Å
291A93.1Very high91Very high54 Ų5462 Ų6245%0.44634%0.337SS..Hα-helixtrans-59-38.4175.700000113L77 P289 G295L77-A291 HydrophobicContact CD1-CB 4.09Å; P289-A291 PolarHBondContact O-N 3.02Å; A291-G295 PolarHBondContact O-N 2.92Å
292V92.6Very high90.9Very high74 Ų7462.4 Ų62.445%0.44834%0.341SS..Hα-helixtrans-69.1-43.2175.5178.10000109.8I288 P289 I290 L294 G295 V296I288-V292 HydrophobicContact CG2-CB 4.03Å; I288-V292 HydrophobicContact CG2-CG1 4.03Å; P289-V292 HydrophobicContact CB-CG2 4.18Å; P289-V292 HydrophobicContact CG-CG2 4.23Å; P289-V292 WeakPolarHBondContact O-CB 3.33Å; P289-V292 PolarHBondContact O-N 2.84Å; I290-V292 VanDerWaalsContact C-N 3.29Å; I290-V292 PolarHBondContact O-N 2.97Å; V292-L294 VanDerWaalsContact C-N 3.31Å; V292-L294 PolarHBondContact O-N 3.17Å; V292-G295 PolarHBondContact O-N 2.76Å; V292-V296 HydrophobicContact CG1-CG2 4.27Å; V292-V296 VanDerWaalsContact O-CG2 3.3Å; V292-V296 WeakPolarHBondContact O-CG2 3.33Å; V292-V296 PolarHBondContact O-N 3.23Å
293S90.9Very high91Very high3 Ų365.5 Ų65.52%0.02136%0.356CS..Hα-helixtrans-57.9-46176.2-56.10000111.4K279 P289 I290 V296 V297K279-S293 WeakPolarHBondContact CD-OG 3.18Å; K279-S293 WeakPolarHBondContact CE-OG 3.41Å; K279-S293 PolarHBondContact NZ-OG 2.82Å; P289-S293 PolarHBondContact O-N 3.47Å; P289-S293 VanDerWaalsContact O-N 3.07Å; P289-S293 PolarHBondContact O-OG 3.29Å; I290-S293 WeakPolarHBondContact O-CB 3.34Å; I290-S293 PolarHBondContact O-N 3.33Å; I290-S293 VanDerWaalsContact O-N 3.12Å; S293-V296 PolarHBondContact O-N 3.28Å; S293-V297 WeakPolarHBondContact O-CB 3.45Å; S293-V297 VanDerWaalsContact O-CG2 3.31Å; S293-V297 WeakPolarHBondContact O-CG2 3.46Å; S293-V297 PolarHBondContact O-N 3.44Å
294L94.1Very high91.2Very high26 Ų2664 Ų6414%0.13635%0.347CS..Hα-helixtrans-57.3-51.9175.1-179.860.2000111.5L77 L80 T81 L84 I290 V292 V296 V297 F298L77-L294 HydrophobicContact CD2-CD2 3.63Å; L80-L294 HydrophobicContact CD2-CD1 4.26Å; L80-L294 HydrophobicContact CD2-CD2 3.95Å; L80-L294 HydrophobicContact CG-CD1 4.02Å; L80-L294 HydrophobicContact CG-CD2 4.48Å; T81-L294 WeakPolarHBondContact OG1-CB 3.43Å; L84-L294 HydrophobicContact CD1-CD1 3.58Å; I290-L294 PolarHBondContact O-N 2.82Å; V292-L294 VanDerWaalsContact C-N 3.31Å; V292-L294 PolarHBondContact O-N 3.17Å; L294-V296 VanDerWaalsContact C-N 3.32Å; L294-V296 PolarHBondContact O-N 3.01Å; L294-V297 PolarHBondContact O-N 2.89Å; L294-F298 WeakPolarHBondContact O-CB 3.25Å; L294-F298 PolarHBondContact O-N 3.07Å
295G95.4Very high91.5Very high45 Ų4562.7 Ų62.746%0.46434%0.335SS..Hα-helixtrans-60.3-40.9-178.700000112.6A291 V292 G299A291-G295 PolarHBondContact O-N 2.92Å; V292-G295 PolarHBondContact O-N 2.76Å; G295-G299 PolarHBondContact O-N 3.02Å
296V94.6Very high91.7Very high48 Ų4859.4 Ų59.429%0.29133%0.325SS..Hα-helixtrans-67.2-51.5177.2172.60000111.2F275 V292 S293 L294 F298 G299 I300F275-V296 HydrophobicContact CD1-CB 4.43Å; F275-V296 HydrophobicContact CD1-CG1 3.78Å; F275-V296 HydrophobicContact CD2-CG1 3.9Å; F275-V296 HydrophobicContact CE1-CB 3.92Å; F275-V296 HydrophobicContact CE1-CG1 3.76Å; F275-V296 HydrophobicContact CE2-CB 4.28Å; F275-V296 HydrophobicContact CE2-CG1 3.88Å; F275-V296 HydrophobicContact CE2-CG2 4.22Å; F275-V296 HydrophobicContact CG-CG1 3.85Å; F275-V296 HydrophobicContact CZ-CB 3.84Å; F275-V296 HydrophobicContact CZ-CG1 3.81Å; F275-V296 HydrophobicContact CZ-CG2 4.02Å; V292-V296 HydrophobicContact CG1-CG2 4.27Å; V292-V296 VanDerWaalsContact O-CG2 3.3Å; V292-V296 WeakPolarHBondContact O-CG2 3.33Å; V292-V296 PolarHBondContact O-N 3.23Å; S293-V296 PolarHBondContact O-N 3.28Å; L294-V296 VanDerWaalsContact C-N 3.32Å; L294-V296 PolarHBondContact O-N 3.01Å; V296-F298 PolarHBondContact O-N 3.23Å; V296-G299 PolarHBondContact O-N 2.79Å; V296-I300 HydrophobicContact CG1-CD1 3.66Å; V296-I300 HydrophobicContact CG1-CG1 4.4Å; V296-I300 WeakPolarHBondContact O-CD1 3.34Å; V296-I300 VanDerWaalsContact O-CG1 3.26Å; V296-I300 WeakPolarHBondContact O-CG1 3.37Å; V296-I300 PolarHBondContact O-N 3.4Å
297V93.2Very high92Very high0 Ų056.1 Ų56.10%032%0.316CS..Hα-helixtrans-59.2-48.8179.2171.10000110.5L84 I85 I272 S293 L294 G299 I300 L301L84-V297 HydrophobicContact CB-CG1 4.28Å; I85-V297 HydrophobicContact CD1-CG2 4.34Å; I85-V297 HydrophobicContact CG1-CG1 4.01Å; I85-V297 HydrophobicContact CG1-CG2 4.05Å; I272-V297 HydrophobicContact CD1-CG1 4.32Å; I272-V297 HydrophobicContact CG2-CG2 4.41Å; S293-V297 WeakPolarHBondContact O-CB 3.45Å; S293-V297 VanDerWaalsContact O-CG2 3.31Å; S293-V297 WeakPolarHBondContact O-CG2 3.46Å; S293-V297 PolarHBondContact O-N 3.44Å; L294-V297 PolarHBondContact O-N 2.89Å; V297-G299 PolarHBondContact O-N 3.33Å; V297-I300 PolarHBondContact O-N 3.32Å; V297-L301 HydrophobicContact CG1-CD1 4.18Å; V297-L301 WeakPolarHBondContact O-CG 3.36Å; V297-L301 PolarHBondContact O-N 3.26Å
298F94.7Very high92.1Very high117 Ų11750 Ų5051%0.51329%0.288SS..Hα-helixtrans-60.1-45.1177.3-178.9-99.7000111.8L84 L294 V296 I300 L301 V302L84-F298 HydrophobicContact CD1-CB 4.35Å; L84-F298 HydrophobicContact CD1-CD2 4.22Å; L294-F298 WeakPolarHBondContact O-CB 3.25Å; L294-F298 PolarHBondContact O-N 3.07Å; V296-F298 PolarHBondContact O-N 3.23Å; F298-I300 PolarHBondContact O-N 3.12Å; F298-L301 PolarHBondContact O-N 2.68Å; F298-V302 HydrophobicContact CD1-CG2 4.12Å; F298-V302 HydrophobicContact CD2-CG2 4.49Å; F298-V302 HydrophobicContact CE1-CG2 3.68Å; F298-V302 HydrophobicContact CE2-CG2 4.08Å; F298-V302 HydrophobicContact CZ-CG2 3.66Å; F298-V302 WeakPolarHBondContact O-CG2 3.19Å; F298-V302 PolarHBondContact O-N 3.05Å
299G96.7Very high92.1Very high33 Ų3351.8 Ų51.834%0.3431%0.306SS..Hα-helixtrans-59.8-43.1177.300000112.8G295 V296 V297 V302 M303G295-G299 PolarHBondContact O-N 3.02Å; V296-G299 PolarHBondContact O-N 2.79Å; V297-G299 PolarHBondContact O-N 3.33Å; G299-V302 PolarHBondContact O-N 2.84Å; G299-M303 VanDerWaalsContact O-CB 3.25Å; G299-M303 WeakPolarHBondContact O-CB 3.49Å; G299-M303 PolarHBondContact O-N 3.13Å
300I94.6Very high92Very high25 Ų2555.1 Ų55.113%0.12831%0.311CS..Hα-helixtrans-63.3-45.4176.1-65.5158.5000110.5G268 V271 I272 V296 V297 F298 M303 T304G268-I300 WeakPolarHBondContact O-CG2 3.38Å; V271-I300 HydrophobicContact CB-CG2 4.31Å; V271-I300 HydrophobicContact CG1-CD1 3.74Å; V271-I300 HydrophobicContact CG1-CG1 4.09Å; V271-I300 HydrophobicContact CG1-CG2 4.34Å; I272-I300 HydrophobicContact CD1-CB 4.48Å; I272-I300 HydrophobicContact CD1-CG2 4.12Å; I272-I300 HydrophobicContact CG1-CB 4.08Å; I272-I300 HydrophobicContact CG1-CD1 3.95Å; I272-I300 HydrophobicContact CG1-CG2 3.77Å; V296-I300 HydrophobicContact CG1-CD1 3.66Å; V296-I300 HydrophobicContact CG1-CG1 4.4Å; V296-I300 WeakPolarHBondContact O-CD1 3.34Å; V296-I300 VanDerWaalsContact O-CG1 3.26Å; V296-I300 WeakPolarHBondContact O-CG1 3.37Å; V296-I300 PolarHBondContact O-N 3.4Å; V297-I300 PolarHBondContact O-N 3.32Å; F298-I300 PolarHBondContact O-N 3.12Å; I300-M303 PolarHBondContact O-N 3.34Å; I300-T304 WeakPolarHBondContact O-CB 3.12Å; I300-T304 PolarHBondContact O-N 2.94Å; I300-T304 PolarHBondContact O-OG1 3.21Å
301L91.3Very high91.8Very high22 Ų2254.7 Ų54.712%0.11531%0.31CS..Hα-helixtrans-60.5-49.1178.5-68.9175.2000111.5L84 I272 V297 F298 M303 T304 F305L84-L301 HydrophobicContact CB-CD1 4.46Å; I272-L301 HydrophobicContact CD1-CD2 3.61Å; I272-L301 HydrophobicContact CD1-CG 3.95Å; V297-L301 HydrophobicContact CG1-CD1 4.18Å; V297-L301 WeakPolarHBondContact O-CG 3.36Å; V297-L301 PolarHBondContact O-N 3.26Å; F298-L301 PolarHBondContact O-N 2.68Å; L301-M303 PolarHBondContact O-N 3.35Å; L301-T304 PolarHBondContact O-N 2.95Å; L301-F305 HydrophobicContact CB-CE2 4.35Å; L301-F305 WeakPolarHBondContact O-CD2 3.3Å; L301-F305 WeakPolarHBondContact O-CG 3.36Å; L301-F305 PolarHBondContact O-N 3.32Å
302V93.2Very high91.3Very high57 Ų5753.5 Ų53.535%0.34530%0.296SS..Hα-helixtrans-59.6-46.8177.6170.70000110.9F298 G299 T304 F305 I306F298-V302 HydrophobicContact CD1-CG2 4.12Å; F298-V302 HydrophobicContact CD2-CG2 4.49Å; F298-V302 HydrophobicContact CE1-CG2 3.68Å; F298-V302 HydrophobicContact CE2-CG2 4.08Å; F298-V302 HydrophobicContact CZ-CG2 3.66Å; F298-V302 WeakPolarHBondContact O-CG2 3.19Å; F298-V302 PolarHBondContact O-N 3.05Å; G299-V302 PolarHBondContact O-N 2.84Å; V302-T304 VanDerWaalsContact C-N 3.33Å; V302-T304 PolarHBondContact O-N 2.85Å; V302-F305 PolarHBondContact O-N 3.4Å; V302-I306 HydrophobicContact CG1-CD1 3.71Å; V302-I306 HydrophobicContact CG1-CG1 4.43Å; V302-I306 VanDerWaalsContact O-CG1 3.28Å; V302-I306 WeakPolarHBondContact O-CG1 3.49Å; V302-I306 PolarHBondContact O-N 3.43Å
303M94Very high90.9Very high120 Ų12057.4 Ų57.459%0.59130%0.304SS*.Hα-helixtrans-61.8-42.5178.7-173.5175.5-67.800111.6G299 I300 L301 F305 I306 I307G299-M303 VanDerWaalsContact O-CB 3.25Å; G299-M303 WeakPolarHBondContact O-CB 3.49Å; G299-M303 PolarHBondContact O-N 3.13Å; I300-M303 PolarHBondContact O-N 3.34Å; L301-M303 PolarHBondContact O-N 3.35Å; M303-F305 PolarHBondContact O-N 3.4Å; M303-I306 PolarHBondContact O-N 2.92Å; M303-I307 HydrophobicContact CG-CD1 3.79Å; M303-I307 HydrophobicContact CG-CG1 4.4Å; M303-I307 WeakPolarHBondContact O-CB 3.33Å; M303-I307 VanDerWaalsContact O-CG1 3.26Å; M303-I307 WeakPolarHBondContact O-CG1 3.35Å; M303-I307 PolarHBondContact O-N 3.06Å
304T91.1Very high90.5Very high16 Ų1663.7 Ų63.710%0.09833%0.327CS..Hα-helixtrans-62.9-44.1178.1-52.80000110.8L265 G268 I300 L301 V302 I307 N308L265-T304 HydrophobicContact CD2-CG2 3.73Å; G268-T304 VanDerWaalsContact CA-OG1 3.27Å; G268-T304 WeakPolarHBondContact CA-OG1 3.48Å; I300-T304 WeakPolarHBondContact O-CB 3.12Å; I300-T304 PolarHBondContact O-N 2.94Å; I300-T304 PolarHBondContact O-OG1 3.21Å; L301-T304 PolarHBondContact O-N 2.95Å; V302-T304 VanDerWaalsContact C-N 3.33Å; V302-T304 PolarHBondContact O-N 2.85Å; T304-I307 PolarHBondContact O-N 3.43Å; T304-N308 WeakPolarHBondContact O-CB 3.3Å; T304-N308 PolarHBondContact O-N 2.85Å
305F88.4Confident89.6Confident98 Ų9867.1 Ų67.143%0.4334%0.342SS..Hα-helixtrans-63.5-40.6175.6-71.8-52.2000112.7F262 L265 L301 V302 M303 N308 A309F262-F305 HydrophobicContact CE1-CD1 4.04Å; F262-F305 HydrophobicContact CE1-CE1 4.12Å; L265-F305 HydrophobicContact CD2-CD1 4.07Å; L265-F305 HydrophobicContact CD2-CE1 3.8Å; L301-F305 HydrophobicContact CB-CE2 4.35Å; L301-F305 WeakPolarHBondContact O-CD2 3.3Å; L301-F305 WeakPolarHBondContact O-CG 3.36Å; L301-F305 PolarHBondContact O-N 3.32Å; V302-F305 PolarHBondContact O-N 3.4Å; M303-F305 PolarHBondContact O-N 3.4Å; F305-N308 PolarHBondContact O-N 3.35Å; F305-A309 WeakPolarHBondContact O-CB 3.47Å; F305-A309 PolarHBondContact O-N 2.92Å
306I90.9Very high88.8Confident109 Ų10967.9 Ų67.956%0.55934%0.336SS*.Hα-helixtrans-64.6-48.2177.2-69.5167.6000110.9V302 M303 N308 A309 W310V302-I306 HydrophobicContact CG1-CD1 3.71Å; V302-I306 HydrophobicContact CG1-CG1 4.43Å; V302-I306 VanDerWaalsContact O-CG1 3.28Å; V302-I306 WeakPolarHBondContact O-CG1 3.49Å; V302-I306 PolarHBondContact O-N 3.43Å; M303-I306 PolarHBondContact O-N 2.92Å; I306-N308 VanDerWaalsContact C-N 3.31Å; I306-N308 PolarHBondContact O-N 3.4Å; I306-A309 PolarHBondContact O-N 3.09Å; I306-W310 WeakPolarHBondContact O-CB 3.35Å; I306-W310 PolarHBondContact O-N 2.95Å
307I90.4Very high87.8Confident80 Ų8072.9 Ų72.941%0.4135%0.353SS..Hα-helixtrans-59.8-46.2178.2-69.5167.7000109.6M264 M303 T304 A309 W310 V311M264-I307 HydrophobicContact SD-CG2 4.06Å; M303-I307 HydrophobicContact CG-CD1 3.79Å; M303-I307 HydrophobicContact CG-CG1 4.4Å; M303-I307 WeakPolarHBondContact O-CB 3.33Å; M303-I307 VanDerWaalsContact O-CG1 3.26Å; M303-I307 WeakPolarHBondContact O-CG1 3.35Å; M303-I307 PolarHBondContact O-N 3.06Å; T304-I307 PolarHBondContact O-N 3.43Å; I307-A309 PolarHBondContact O-N 2.92Å; I307-W310 PolarHBondContact O-N 3.49Å; I307-V311 HydrophobicContact CG2-CG2 4.34Å; I307-V311 WeakPolarHBondContact O-CG2 3.38Å; I307-V311 PolarHBondContact O-N 2.84Å
308N87.8Confident86.8Confident7 Ų779.6 Ų79.64%0.03739%0.385CS..Hα-helixtrans-61.1-46.2179.7-169.6-93.1000111.9R261 F262 T304 F305 I306 W310 V311 N312R261-N308 PolarHBondContact O-ND2 3.13Å; R261-N308 PolarHBondContact O-OD1 2.86Å; F262-N308 WeakPolarHBondContact CA-ND2 3.44Å; F262-N308 WeakPolarHBondContact CD1-OD1 3.45Å; T304-N308 WeakPolarHBondContact O-CB 3.3Å; T304-N308 PolarHBondContact O-N 2.85Å; F305-N308 PolarHBondContact O-N 3.35Å; I306-N308 VanDerWaalsContact C-N 3.31Å; I306-N308 PolarHBondContact O-N 3.4Å; N308-W310 VanDerWaalsContact C-N 3.33Å; N308-W310 PolarHBondContact O-N 2.85Å; N308-V311 PolarHBondContact O-N 3.37Å; N308-N312 VanDerWaalsContact O-CB 3.26Å; N308-N312 WeakPolarHBondContact O-CB 3.28Å; N308-N312 PolarHBondContact O-N 3.38Å
309A86.9Confident85.2Confident60 Ų6083.8 Ų83.850%0.49640%0.397SS..Hα-helixtrans-61-41.1175.700000112.3F305 I306 I307 Y313F305-A309 WeakPolarHBondContact O-CB 3.47Å; F305-A309 PolarHBondContact O-N 2.92Å; I306-A309 PolarHBondContact O-N 3.09Å; I307-A309 PolarHBondContact O-N 2.92Å; A309-Y313 WeakPolarHBondContact O-CB 3.42Å; A309-Y313 PolarHBondContact O-N 3.19Å
310W88Confident83.4Confident131 Ų13185.7 Ų85.750%0.49642%0.417SS..Hα-helixtrans-68.5-43.8179.5179.583.9000112.9I306 I307 N308 Y313 R314I306-W310 WeakPolarHBondContact O-CB 3.35Å; I306-W310 PolarHBondContact O-N 2.95Å; I307-W310 PolarHBondContact O-N 3.49Å; N308-W310 VanDerWaalsContact C-N 3.33Å; N308-W310 PolarHBondContact O-N 2.85Å; W310-Y313 PolarHBondContact O-N 2.96Å; W310-R314 VanDerWaalsContact CE2-NE 3.34Å; W310-R314 PolarHBondContact O-N 3.08Å
311V85.9Confident81.1Confident24 Ų2490.2 Ų90.215%0.14547%0.469CS..Hα-helixtrans-65.9-42.7176.4176.40000110.5M264 I307 N308 Y313 R314 H315M264-V311 HydrophobicContact CE-CB 3.62Å; M264-V311 HydrophobicContact CE-CG1 3.27Å; M264-V311 HydrophobicContact CE-CG2 3.62Å; M264-V311 HydrophobicContact SD-CB 3.9Å; M264-V311 HydrophobicContact SD-CG1 4.24Å; M264-V311 HydrophobicContact SD-CG2 3.67Å; I307-V311 HydrophobicContact CG2-CG2 4.34Å; I307-V311 WeakPolarHBondContact O-CG2 3.38Å; I307-V311 PolarHBondContact O-N 2.84Å; N308-V311 PolarHBondContact O-N 3.37Å; V311-Y313 VanDerWaalsContact C-N 3.33Å; V311-Y313 PolarHBondContact O-N 2.83Å; V311-R314 WeakPolarHBondContact O-CB 3.33Å; V311-R314 PolarHBondContact O-N 3.39Å; V311-R314 VanDerWaalsContact O-N 3.14Å; V311-H315 VanDerWaalsContact CG1-CD2 3.46Å; V311-H315 WeakPolarHBondContact CG1-CD2 3.4Å; V311-H315 PolarHBondContact O-CD2 2.87Å; V311-H315 VanDerWaalsContact O-CD2 3.26Å; V311-H315 PolarHBondContact O-N 2.98Å
312N83.6Confident80.6Confident29 Ų2993.6 Ų93.616%0.15549%0.487CS..Hα-helixtrans-61.3-41.9176179.482.7000112R261 N308 R314 H315 D316R261-N312 VanDerWaalsContact CD-OD1 3.24Å; R261-N312 WeakPolarHBondContact CD-OD1 3.28Å; R261-N312 WeakPolarHBondContact CG-OD1 3.28Å; R261-N312 PolarHBondContact NH1-ND2 3.35Å; N308-N312 VanDerWaalsContact O-CB 3.26Å; N308-N312 WeakPolarHBondContact O-CB 3.28Å; N308-N312 PolarHBondContact O-N 3.38Å; N312-R314 VanDerWaalsContact C-N 3.3Å; N312-R314 PolarHBondContact O-N 3.39Å; N312-H315 PolarHBondContact O-N 3.26Å; N312-D316 PolarHBondContact ND2-OD2 3.22Å; N312-D316 PolarHBondContact O-N 3.38Å
313Y83.3Confident79.9Confident156 Ų15695.5 Ų95.561%0.61250%0.495SS*.Hα-helixtrans-60.2-38.5174.5178.3-102.4000112.6A309 W310 V311 K317A309-Y313 WeakPolarHBondContact O-CB 3.42Å; A309-Y313 PolarHBondContact O-N 3.19Å; W310-Y313 PolarHBondContact O-N 2.96Å; V311-Y313 VanDerWaalsContact C-N 3.33Å; V311-Y313 PolarHBondContact O-N 2.83Å; Y313-K317 PolarHBondContact O-N 3.06Å; Y313-K317 VanDerWaalsContact O-N 3.07Å
314R81.7Confident79.1Confident135 Ų13594.2 Ų94.251%0.50949%0.489SS..Hα-helixtrans-65.9-42.2175.1-76.3-177.7166-158.3-5.1112.5W310 V311 N312 K317 Q318W310-R314 VanDerWaalsContact CE2-NE 3.34Å; W310-R314 PolarHBondContact O-N 3.08Å; V311-R314 WeakPolarHBondContact O-CB 3.33Å; V311-R314 PolarHBondContact O-N 3.39Å; V311-R314 VanDerWaalsContact O-N 3.14Å; N312-R314 VanDerWaalsContact C-N 3.3Å; N312-R314 PolarHBondContact O-N 3.39Å; R314-K317 PolarHBondContact O-N 3.18Å; R314-Q318 WeakPolarHBondContact O-CG 3.36Å; R314-Q318 PolarHBondContact O-N 3.22Å; R314-Q318 VanDerWaalsContact O-N 3.09Å
315H76.9Confident78.4Confident98 Ų9898.8 Ų98.845%0.45451%0.512SS..Hα-helixtrans-65.4-41176-78.5-65.9000112.4V311 N312 K317 Q318 R319V311-H315 VanDerWaalsContact CG1-CD2 3.46Å; V311-H315 WeakPolarHBondContact CG1-CD2 3.4Å; V311-H315 PolarHBondContact O-CD2 2.87Å; V311-H315 VanDerWaalsContact O-CD2 3.26Å; V311-H315 PolarHBondContact O-N 2.98Å; N312-H315 PolarHBondContact O-N 3.26Å; H315-K317 VanDerWaalsContact C-N 3.3Å; H315-K317 PolarHBondContact O-N 2.99Å; H315-Q318 PolarHBondContact O-N 3.31Å; H315-R319 PolarHBondContact O-N 3.37Å
316D77Confident77.8Confident61 Ų6198.8 Ų98.833%0.32652%0.517SS..Hα-helixtrans-61.6-39.5176.1-73.5-27.8000110.7R261 N312 R319 G320R261-D316 IonicContact CZ-OD1 3.5Å; R261-D316 IonicContact CZ-OD2 2.77Å; R261-D316 IonicContact NH1-OD1 2.85Å; R261-D316 IonicContact NH1-OD2 3.12Å; R261-D316 PolarHBondContact NH1-OD2 2.94Å; R261-D316 IonicContact NH2-OD1 3.35Å; R261-D316 PolarHBondContact NH2-OD1 3.48Å; R261-D316 VanDerWaalsContact NH2-OD1 3.12Å; R261-D316 IonicContact NH2-OD2 3.88Å; R261-D316 PolarHBondContact NH2-OD2 3.05Å; N312-D316 PolarHBondContact ND2-OD2 3.22Å; N312-D316 PolarHBondContact O-N 3.38Å; D316-R319 PolarHBondContact O-N 3.26Å; D316-G320 PolarHBondContact O-N 2.72Å; D316-G320 VanDerWaalsContact O-N 3.08Å
317K74.5Confident77Confident152 Ų15298.1 Ų98.166%0.66152%0.515SS*.Hα-helixtrans-67.9-33.7176-168.8175.1-179179.30113.6Y313 R314 H315 G321Y313-K317 PolarHBondContact O-N 3.06Å; Y313-K317 VanDerWaalsContact O-N 3.07Å; R314-K317 PolarHBondContact O-N 3.18Å; H315-K317 VanDerWaalsContact C-N 3.3Å; H315-K317 PolarHBondContact O-N 2.99Å; K317-G321 PolarHBondContact O-N 3.45Å
318Q71.3Confident76Confident142 Ų14299.4 Ų99.466%0.66452%0.522SS*.Hα-helixtrans-75.3-27.4177.2-73.1175.10.900113.2R314 H315R314-Q318 WeakPolarHBondContact O-CG 3.36Å; R314-Q318 PolarHBondContact O-N 3.22Å; R314-Q318 VanDerWaalsContact O-N 3.09Å; H315-Q318 PolarHBondContact O-N 3.31Å
319R62.7Low75.1Confident205 Ų205106.5 Ų106.577%0.77456%0.559SS**Hα-helixtrans-83.3-27.1175.4-71.7-178.3174.8178.9-0.3113.1H315 D316H315-R319 PolarHBondContact O-N 3.37Å; D316-R319 PolarHBondContact O-N 3.26Å
320G58Low74.1Confident72 Ų72110.4 Ų110.474%0.74257%0.565SS**  trans-94.3-1.9-177.200000115.8D316D316-G320 PolarHBondContact O-N 2.72Å; D316-G320 VanDerWaalsContact O-N 3.08Å
321G46.3Very low72.8Confident120 Ų120108.5 Ų108.5100%1.23757%0.571SS**  trans-1100172.800000110.7K317K317-G321 PolarHBondContact O-N 3.45Å

Retrieved 321 of 321 residues in 630.3 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).