A0A077YXI2_TRITR Loading...

Far-17a AIG1 domain containing protein

AlphaFold DB , UniProt , Accession A0A077YXI2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 246 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
1M76.8Confident92.8Very high156 Ų15659.9 Ų59.977%0.76833%0.328SS*.  0-46.40-65.2-16288.500112.4R3 L4 V5M1-R3 VanDerWaalsContact C-N 3.34Å; M1-R3 PolarHBondContact O-N 3.01Å; M1-L4 PolarHBondContact O-N 2.99Å; M1-L4 VanDerWaalsContact O-N 3.14Å; M1-V5 PolarHBondContact O-N 2.88Å
2L87.9Confident93.2Very high131 Ų13166.1 Ų66.169%0.68635%0.35SS*.Hα-helixtrans-49.6-48.1178.7-178.360.9000113.8L4 V5 I6L2-L4 PolarHBondContact O-N 3.32Å; L2-V5 PolarHBondContact O-N 2.91Å; L2-V5 VanDerWaalsContact O-N 3.14Å; L2-I6 HydrophobicContact CD1-CD1 3.96Å; L2-I6 HydrophobicContact CD1-CG1 4.18Å; L2-I6 HydrophobicContact CD2-CD1 4.48Å; L2-I6 HydrophobicContact CG-CD1 3.78Å; L2-I6 HydrophobicContact CG-CG1 4.42Å; L2-I6 WeakPolarHBondContact O-CG1 3.37Å; L2-I6 PolarHBondContact O-N 3.27Å
3R89Confident93.6Very high56 Ų5664.9 Ų64.921%0.21134%0.343CS..Hα-helixtrans-53.5-47.5177.3-168.9-173.8-47.9-1477.3113.5M1 V5 I6 Y7 T82 L154M1-R3 VanDerWaalsContact C-N 3.34Å; M1-R3 PolarHBondContact O-N 3.01Å; R3-V5 PolarHBondContact O-N 3.07Å; R3-I6 PolarHBondContact O-N 2.79Å; R3-Y7 HydrophobicContact CG-CD2 3.88Å; R3-Y7 HydrophobicContact CG-CE2 3.46Å; R3-Y7 VanDerWaalsContact CG-CE2 3.46Å; R3-Y7 WeakPolarHBondContact O-CD2 3.35Å; R3-Y7 PolarHBondContact O-N 2.94Å; R3-Y7 VanDerWaalsContact O-N 3.09Å; R3-T82 PolarHBondContact NH1-OG1 2.99Å; R3-L154 HydrophobicContact CG-CB 4.43Å; R3-L154 HydrophobicContact CG-CD1 4.47Å; R3-L154 VanDerWaalsContact CZ-O 3.27Å; R3-L154 PolarHBondContact NH1-O 3.04Å
4L91.6Very high93.9Very high42 Ų4260.3 Ų60.322%0.2232%0.319CS..Hα-helixtrans-63.8-41.3178.817761.4000111.5M1 L2 A8 V57 A60 F61M1-L4 PolarHBondContact O-N 2.99Å; M1-L4 VanDerWaalsContact O-N 3.14Å; L2-L4 PolarHBondContact O-N 3.32Å; L4-A8 VanDerWaalsContact O-CB 3.29Å; L4-A8 WeakPolarHBondContact O-CB 3.48Å; L4-A8 PolarHBondContact O-N 3.05Å; L4-V57 HydrophobicContact CD1-CG1 4.15Å; L4-A60 HydrophobicContact CB-CB 4.24Å; L4-A60 HydrophobicContact CD1-CB 4.01Å; L4-F61 HydrophobicContact CD1-CB 4.27Å; L4-F61 HydrophobicContact CD2-CD2 4.36Å
5V94.9Very high94.2Very high88 Ų8861.9 Ų61.953%0.53333%0.327SS..Hα-helixtrans-64-45177.9175.20000110.9M1 L2 R3 Y7 A8 V9M1-V5 PolarHBondContact O-N 2.88Å; L2-V5 PolarHBondContact O-N 2.91Å; L2-V5 VanDerWaalsContact O-N 3.14Å; R3-V5 PolarHBondContact O-N 3.07Å; V5-Y7 PolarHBondContact O-N 2.8Å; V5-A8 PolarHBondContact O-N 2.81Å; V5-V9 WeakPolarHBondContact O-CG2 3.38Å; V5-V9 PolarHBondContact O-N 3.22Å
6I95.2Very high94.4Very high43 Ų4364.6 Ų64.622%0.22134%0.335CS..Hα-helixtrans-59.9-49.9178.8-65.7166.3000110.5L2 R3 A8 V9 M10 I150 L154L2-I6 HydrophobicContact CD1-CD1 3.96Å; L2-I6 HydrophobicContact CD1-CG1 4.18Å; L2-I6 HydrophobicContact CD2-CD1 4.48Å; L2-I6 HydrophobicContact CG-CD1 3.78Å; L2-I6 HydrophobicContact CG-CG1 4.42Å; L2-I6 WeakPolarHBondContact O-CG1 3.37Å; L2-I6 PolarHBondContact O-N 3.27Å; R3-I6 PolarHBondContact O-N 2.79Å; I6-A8 VanDerWaalsContact C-N 3.32Å; I6-A8 PolarHBondContact O-N 2.6Å; I6-V9 PolarHBondContact O-N 3.21Å; I6-M10 HydrophobicContact CG2-CE 3.63Å; I6-M10 HydrophobicContact CG2-SD 3.86Å; I6-M10 WeakPolarHBondContact O-CG 3.46Å; I6-M10 PolarHBondContact O-N 3.32Å; I6-I150 HydrophobicContact CG2-CG2 3.99Å; I6-L154 HydrophobicContact CB-CD1 4.15Å; I6-L154 HydrophobicContact CD1-CD1 4.27Å; I6-L154 HydrophobicContact CD1-CD2 3.9Å; I6-L154 HydrophobicContact CG2-CD1 3.77Å
7Y96.2Very high94.7Very high3 Ų360.9 Ų60.91%0.01232%0.316CS..Hα-helixtrans-64-35.5177.4-69.7-51000113.1R3 V5 M10 A11 C56 V57 A60 D151 L154 V155R3-Y7 HydrophobicContact CG-CD2 3.88Å; R3-Y7 HydrophobicContact CG-CE2 3.46Å; R3-Y7 VanDerWaalsContact CG-CE2 3.46Å; R3-Y7 WeakPolarHBondContact O-CD2 3.35Å; R3-Y7 PolarHBondContact O-N 2.94Å; R3-Y7 VanDerWaalsContact O-N 3.09Å; V5-Y7 PolarHBondContact O-N 2.8Å; Y7-M10 HydrophobicContact CD1-SD 3.99Å; Y7-M10 PolarHBondContact O-N 3.23Å; Y7-A11 VanDerWaalsContact O-CB 3.3Å; Y7-A11 WeakPolarHBondContact O-CB 3.31Å; Y7-A11 PolarHBondContact O-N 3.44Å; Y7-C56 HydrophobicContact CD1-CB 3.54Å; Y7-C56 HydrophobicContact CD2-CB 4.11Å; Y7-C56 HydrophobicContact CE1-CB 3.72Å; Y7-C56 HydrophobicContact CE2-CB 4.24Å; Y7-C56 HydrophobicContact CG-CB 3.76Å; Y7-V57 WeakPolarHBondContact O-CG2 3.28Å; Y7-A60 HydrophobicContact CD2-CB 3.79Å; Y7-A60 HydrophobicContact CE2-CB 4.29Å; Y7-D151 HydrophobicContact CE1-CB 4.48Å; Y7-D151 WeakPolarHBondContact CE1-OD1 3.33Å; Y7-D151 PolarHBondContact OH-OD1 2.61Å; Y7-L154 HydrophobicContact CE1-CD1 3.98Å; Y7-L154 HydrophobicContact CE2-CD1 4.27Å; Y7-V155 WeakPolarHBondContact OH-CG2 3.37Å
8A97.4Very high94.8Very high47 Ų4759.2 Ų59.239%0.38831%0.31SS..Hα-helixtrans-63.8-42.1176.700000111.7L4 V5 I6 F12L4-A8 VanDerWaalsContact O-CB 3.29Å; L4-A8 WeakPolarHBondContact O-CB 3.48Å; L4-A8 PolarHBondContact O-N 3.05Å; V5-A8 PolarHBondContact O-N 2.81Å; I6-A8 VanDerWaalsContact C-N 3.32Å; I6-A8 PolarHBondContact O-N 2.6Å; A8-F12 WeakPolarHBondContact O-CB 3.45Å; A8-F12 PolarHBondContact O-N 2.98Å
9V97.4Very high95Very high82 Ų8263 Ų6350%0.49733%0.328SS..Hα-helixtrans-63.4-43.9174.3172.50000110.8V5 I6 F12 I13V5-V9 WeakPolarHBondContact O-CG2 3.38Å; V5-V9 PolarHBondContact O-N 3.22Å; I6-V9 PolarHBondContact O-N 3.21Å; V9-F12 WeakPolarHBondContact O-CB 3.25Å; V9-F12 PolarHBondContact O-N 3.12Å; V9-I13 HydrophobicContact CG1-CD1 4.2Å; V9-I13 WeakPolarHBondContact O-CG1 3.41Å; V9-I13 PolarHBondContact O-N 3.07Å; V9-I13 VanDerWaalsContact O-N 3.1Å
10M96.4Very high95.1Very high5 Ų562.9 Ų62.93%0.02532%0.323CS..Hα-helixtrans-63.5-46178.4-69166.7163.700112.9I6 Y7 F12 I13 W14 Y143 F147 I150I6-M10 HydrophobicContact CG2-CE 3.63Å; I6-M10 HydrophobicContact CG2-SD 3.86Å; I6-M10 WeakPolarHBondContact O-CG 3.46Å; I6-M10 PolarHBondContact O-N 3.32Å; Y7-M10 HydrophobicContact CD1-SD 3.99Å; Y7-M10 PolarHBondContact O-N 3.23Å; M10-F12 VanDerWaalsContact C-N 3.3Å; M10-F12 PolarHBondContact O-N 3.19Å; M10-I13 PolarHBondContact O-N 2.97Å; M10-W14 VanDerWaalsContact O-CD1 3.26Å; M10-W14 PolarHBondContact O-N 3.23Å; M10-W14 VanDerWaalsContact O-N 3.15Å; M10-Y143 WeakPolarHBondContact CA-OH 3.35Å; M10-Y143 WeakPolarHBondContact CG-OH 3.28Å; M10-F147 HydrophobicContact CB-CD2 3.68Å; M10-F147 HydrophobicContact CB-CE2 3.68Å; M10-F147 HydrophobicContact CE-CD2 4.15Å; M10-F147 HydrophobicContact CG-CD2 3.75Å; M10-F147 HydrophobicContact CG-CE2 4.08Å; M10-F147 HydrophobicContact SD-CD2 3.43Å; M10-F147 WeakPolarHBondContact SD-CD2 3.47Å; M10-F147 HydrophobicContact SD-CE2 3.54Å; M10-F147 VanDerWaalsContact SD-CE2 3.54Å; M10-I150 HydrophobicContact CE-CB 3.44Å; M10-I150 VanDerWaalsContact CE-CB 3.44Å; M10-I150 HydrophobicContact CE-CD1 3.67Å; M10-I150 HydrophobicContact CE-CG1 4.16Å; M10-I150 HydrophobicContact CE-CG2 3.29Å
11A97.8Very high95.2Very high6 Ų659.9 Ų59.95%0.0531%0.308CS..Hα-helixtrans-63.9-37.517700000111.4Y7 I13 W14 L15 S53 V57Y7-A11 VanDerWaalsContact O-CB 3.3Å; Y7-A11 WeakPolarHBondContact O-CB 3.31Å; Y7-A11 PolarHBondContact O-N 3.44Å; A11-I13 PolarHBondContact O-N 3.39Å; A11-W14 PolarHBondContact O-N 2.9Å; A11-L15 VanDerWaalsContact O-CB 3.27Å; A11-L15 WeakPolarHBondContact O-CB 3.26Å; A11-L15 VanDerWaalsContact O-CG 3.24Å; A11-L15 WeakPolarHBondContact O-CG 3.42Å; A11-L15 PolarHBondContact O-N 2.81Å; A11-S53 WeakPolarHBondContact CA-OG 3.33Å; A11-V57 HydrophobicContact CB-CG2 3.77Å
12F98.1Very high96.1Very high134 Ų13459.9 Ų59.959%0.58830%0.3SS*.Hα-helixtrans-59-46.2173.9175-98000111.9A8 V9 M10 W14 L15 F16A8-F12 WeakPolarHBondContact O-CB 3.45Å; A8-F12 PolarHBondContact O-N 2.98Å; V9-F12 WeakPolarHBondContact O-CB 3.25Å; V9-F12 PolarHBondContact O-N 3.12Å; M10-F12 VanDerWaalsContact C-N 3.3Å; M10-F12 PolarHBondContact O-N 3.19Å; F12-W14 PolarHBondContact O-N 3.07Å; F12-L15 PolarHBondContact O-N 2.76Å; F12-F16 WeakPolarHBondContact O-CB 3.32Å; F12-F16 PolarHBondContact O-N 3.15Å
13I97.7Very high96.4Very high51 Ų5158.9 Ų58.926%0.26229%0.293SS..Hα-helixtrans-60.6-46.5178.2-68.8162.8000111V9 M10 A11 T17 V139 Y143V9-I13 HydrophobicContact CG1-CD1 4.2Å; V9-I13 WeakPolarHBondContact O-CG1 3.41Å; V9-I13 PolarHBondContact O-N 3.07Å; V9-I13 VanDerWaalsContact O-N 3.1Å; M10-I13 PolarHBondContact O-N 2.97Å; A11-I13 PolarHBondContact O-N 3.39Å; I13-T17 WeakPolarHBondContact O-CB 3.35Å; I13-T17 PolarHBondContact O-N 3.33Å; I13-T17 PolarHBondContact O-OG1 3.29Å; I13-V139 HydrophobicContact CG2-CG1 4.3Å; I13-V139 HydrophobicContact CG2-CG2 4.38Å; I13-Y143 HydrophobicContact CB-CE1 3.87Å; I13-Y143 HydrophobicContact CD1-CE1 4.35Å; I13-Y143 HydrophobicContact CD1-CE2 4.16Å; I13-Y143 WeakPolarHBondContact CD1-OH 3.47Å; I13-Y143 HydrophobicContact CG2-CD1 3.81Å; I13-Y143 HydrophobicContact CG2-CE1 3.49Å; I13-Y143 VanDerWaalsContact CG2-CE1 3.49Å; I13-Y143 HydrophobicContact CG2-CG 4.48Å
14W97.9Very high96.7Very high0 Ų063.6 Ų63.60%031%0.313CS..Hα-helixtrans-64.3-48178.4-73.4125.6000112.6M10 A11 F12 T17 C18 F46 Q49 T50 V139 Y143 F147M10-W14 VanDerWaalsContact O-CD1 3.26Å; M10-W14 PolarHBondContact O-N 3.23Å; M10-W14 VanDerWaalsContact O-N 3.15Å; A11-W14 PolarHBondContact O-N 2.9Å; F12-W14 PolarHBondContact O-N 3.07Å; W14-T17 PolarHBondContact O-N 3.4Å; W14-C18 WeakPolarHBondContact O-CB 3.23Å; W14-C18 PolarHBondContact O-N 2.95Å; W14-F46 AromaticContact CE3-CD2 3.57Å; W14-F46 HydrophobicContact CE3-CD2 3.57Å; W14-F46 AromaticContact CE3-CE2 3.72Å; W14-F46 HydrophobicContact CE3-CE2 3.72Å; W14-F46 AromaticContact CZ3-CD2 3.64Å; W14-F46 HydrophobicContact CZ3-CD2 3.64Å; W14-F46 HydrophobicContact CZ3-CE2 4.11Å; W14-Q49 HydrophobicContact CD2-CB 4.01Å; W14-Q49 HydrophobicContact CE3-CB 4.34Å; W14-Q49 HydrophobicContact CH2-CB 4.03Å; W14-Q49 HydrophobicContact CH2-CG 4.14Å; W14-Q49 HydrophobicContact CZ2-CB 3.62Å; W14-Q49 HydrophobicContact CZ2-CG 3.9Å; W14-Q49 HydrophobicContact CZ3-CB 4.36Å; W14-T50 HydrophobicContact CB-CG2 4.23Å; W14-V139 HydrophobicContact CE3-CG1 3.93Å; W14-V139 HydrophobicContact CH2-CG1 4.4Å; W14-V139 HydrophobicContact CZ3-CG1 3.66Å; W14-Y143 AromaticContact CD2-CD1 3.99Å; W14-Y143 HydrophobicContact CD2-CD1 3.99Å; W14-Y143 HydrophobicContact CD2-CE1 4.22Å; W14-Y143 AromaticContact CE2-CD1 3.47Å; W14-Y143 VanDerWaalsContact CE2-CD1 3.47Å; W14-Y143 AromaticContact CE2-CE1 3.74Å; W14-Y143 HydrophobicContact CE3-CD1 4.34Å; W14-Y143 HydrophobicContact CG-CE1 4.46Å; W14-Y143 AromaticContact CH2-CD1 3.79Å; W14-Y143 HydrophobicContact CH2-CD1 3.79Å; W14-Y143 HydrophobicContact CH2-CG 4.41Å; W14-Y143 AromaticContact CZ2-CD1 3.39Å; W14-Y143 HydrophobicContact CZ2-CD1 3.39Å; W14-Y143 HydrophobicContact CZ2-CE1 4.09Å; W14-Y143 HydrophobicContact CZ2-CG 4.21Å; W14-Y143 HydrophobicContact CZ3-CD1 4.25Å; W14-Y143 AromaticContact NE1-CD1 3.92Å; W14-Y143 AromaticContact NE1-CE1 3.69Å; W14-F147 HydrophobicContact CZ2-CB 4.48Å; W14-F147 AromaticContact NE1-CD2 3.72Å; W14-F147 AromaticContact NE1-CG 3.74Å
15L98.3Very high96.9Very high85 Ų8562 Ų6245%0.44530%0.304SS..Hα-helixtrans-65.3-43-179.7-73.1168.3000112.3A11 F12 T17 C18 M19 T50A11-L15 VanDerWaalsContact O-CB 3.27Å; A11-L15 WeakPolarHBondContact O-CB 3.26Å; A11-L15 VanDerWaalsContact O-CG 3.24Å; A11-L15 WeakPolarHBondContact O-CG 3.42Å; A11-L15 PolarHBondContact O-N 2.81Å; F12-L15 PolarHBondContact O-N 2.76Å; L15-T17 VanDerWaalsContact C-N 3.34Å; L15-C18 PolarHBondContact O-N 3.42Å; L15-M19 WeakPolarHBondContact O-CB 3.13Å; L15-M19 PolarHBondContact O-N 3.3Å; L15-T50 HydrophobicContact CD2-CG2 3.84Å; L15-T50 HydrophobicContact CG-CG2 4.34Å
16F98.3Very high96.8Very high104 Ų10460.5 Ų60.546%0.45630%0.296SS..Hα-helixtrans-61-45.4176176.4-97.8000110.9F12 C18 M19 Y20 W135F12-F16 WeakPolarHBondContact O-CB 3.32Å; F12-F16 PolarHBondContact O-N 3.15Å; F16-C18 VanDerWaalsContact C-N 3.3Å; F16-C18 PolarHBondContact O-N 3.4Å; F16-M19 PolarHBondContact O-N 2.97Å; F16-Y20 WeakPolarHBondContact O-CB 3.41Å; F16-Y20 PolarHBondContact O-N 3.13Å; F16-W135 HydrophobicContact CD1-CH2 4.13Å; F16-W135 HydrophobicContact CD1-CZ3 4.28Å; F16-W135 AromaticContact CE1-CH2 3.65Å; F16-W135 HydrophobicContact CE1-CH2 3.65Å; F16-W135 HydrophobicContact CE1-CZ2 4.31Å; F16-W135 HydrophobicContact CE1-CZ3 4.09Å
17T98.3Very high96.6Very high2 Ų259.3 Ų59.31%0.01229%0.291CS..Hα-helixtrans-63.6-38.4176.7-53.50000111.1I13 W14 L15 Y20 D21 F46 W135 V136 V139I13-T17 WeakPolarHBondContact O-CB 3.35Å; I13-T17 PolarHBondContact O-N 3.33Å; I13-T17 PolarHBondContact O-OG1 3.29Å; W14-T17 PolarHBondContact O-N 3.4Å; L15-T17 VanDerWaalsContact C-N 3.34Å; T17-Y20 PolarHBondContact O-N 3.09Å; T17-D21 WeakPolarHBondContact O-CB 3.32Å; T17-D21 PolarHBondContact O-N 2.84Å; T17-F46 HydrophobicContact CG2-CE2 4Å; T17-F46 HydrophobicContact CG2-CZ 3.87Å; T17-W135 HydrophobicContact CG2-CZ3 4.17Å; T17-V136 HydrophobicContact CG2-CG1 4.17Å; T17-V139 HydrophobicContact CG2-CB 4.06Å; T17-V139 HydrophobicContact CG2-CG1 3.81Å
18C97.6Very high96Very high31 Ų3161.5 Ų61.521%0.20930%0.303CS..Hα-helixtrans-66.2-42.8178.5-1720000111.6W14 L15 F16 Y22 F46 T50W14-C18 WeakPolarHBondContact O-CB 3.23Å; W14-C18 PolarHBondContact O-N 2.95Å; L15-C18 PolarHBondContact O-N 3.42Å; F16-C18 VanDerWaalsContact C-N 3.3Å; F16-C18 PolarHBondContact O-N 3.4Å; C18-Y22 WeakPolarHBondContact O-CB 2.88Å; C18-Y22 PolarHBondContact O-N 2.97Å; C18-Y22 VanDerWaalsContact O-N 3.08Å; C18-F46 VanDerWaalsContact CA-CZ 3.41Å; C18-F46 HydrophobicContact CB-CE1 4.32Å; C18-F46 HydrophobicContact CB-CE2 4.41Å; C18-F46 HydrophobicContact CB-CZ 3.76Å; C18-T50 HydrophobicContact CB-CG2 4.4Å
19M97.7Very high95.3Very high131 Ų13162.6 Ų62.665%0.64531%0.306SS*.Hα-helixtrans-63.5-45.4174.4-177.1179.7175.900111L15 F16 Y22 M23L15-M19 WeakPolarHBondContact O-CB 3.13Å; L15-M19 PolarHBondContact O-N 3.3Å; F16-M19 PolarHBondContact O-N 2.97Å; M19-Y22 PolarHBondContact O-N 3.23Å; M19-M23 WeakPolarHBondContact O-CB 3.31Å; M19-M23 WeakPolarHBondContact O-CG 3.21Å; M19-M23 PolarHBondContact O-N 3.44Å; M19-M23 VanDerWaalsContact O-N 3.08Å
20Y98Very high94.4Very high60 Ų6066.8 Ų66.824%0.23532%0.32CS..Hα-helixtrans-63.5-46.1178.7-172.2-81.5000112.1F16 T17 Y22 M23 Y24 V25 P133 W135 V136F16-Y20 WeakPolarHBondContact O-CB 3.41Å; F16-Y20 PolarHBondContact O-N 3.13Å; T17-Y20 PolarHBondContact O-N 3.09Å; Y20-Y22 VanDerWaalsContact C-N 3.3Å; Y20-Y22 PolarHBondContact O-N 3.25Å; Y20-M23 PolarHBondContact O-N 3.33Å; Y20-Y24 HydrophobicContact CD1-CD2 4.15Å; Y20-Y24 AromaticContact CD2-CD2 3.42Å; Y20-Y24 HydrophobicContact CD2-CD2 3.42Å; Y20-Y24 VanDerWaalsContact CD2-CD2 3.42Å; Y20-Y24 AromaticContact CD2-CE2 3.83Å; Y20-Y24 HydrophobicContact CD2-CE2 3.83Å; Y20-Y24 HydrophobicContact CD2-CG 4.43Å; Y20-Y24 HydrophobicContact CE1-CD2 4.19Å; Y20-Y24 HydrophobicContact CE1-CG 4.4Å; Y20-Y24 AromaticContact CE2-CD2 3.47Å; Y20-Y24 HydrophobicContact CE2-CD2 3.47Å; Y20-Y24 VanDerWaalsContact CE2-CD2 3.47Å; Y20-Y24 AromaticContact CE2-CE2 3.97Å; Y20-Y24 HydrophobicContact CE2-CE2 3.97Å; Y20-Y24 HydrophobicContact CE2-CG 4.13Å; Y20-Y24 AromaticContact CG-CD2 3.78Å; Y20-Y24 HydrophobicContact CG-CD2 3.78Å; Y20-Y24 AromaticContact CZ-CD2 3.88Å; Y20-Y24 WeakPolarHBondContact O-CD2 3.4Å; Y20-Y24 PolarHBondContact O-N 3.41Å; Y20-V25 HydrophobicContact CD1-CG2 4.4Å; Y20-V25 HydrophobicContact CE1-CG2 4.39Å; Y20-P133 HydrophobicContact CE1-CG 3.91Å; Y20-W135 AromaticContact CD1-CH2 3.75Å; Y20-W135 HydrophobicContact CD1-CH2 3.75Å; Y20-W135 AromaticContact CD1-CZ2 3.46Å; Y20-W135 HydrophobicContact CD1-CZ2 3.46Å; Y20-W135 VanDerWaalsContact CD1-CZ2 3.46Å; Y20-W135 AromaticContact CD2-CH2 3.99Å; Y20-W135 HydrophobicContact CD2-CH2 3.99Å; Y20-W135 AromaticContact CD2-CZ2 3.59Å; Y20-W135 HydrophobicContact CD2-CZ2 3.59Å; Y20-W135 HydrophobicContact CE1-CH2 4.36Å; Y20-W135 AromaticContact CE1-CZ2 3.61Å; Y20-W135 HydrophobicContact CE1-CZ2 3.61Å; Y20-W135 AromaticContact CE2-CZ2 3.74Å; Y20-W135 HydrophobicContact CE2-CZ2 3.74Å; Y20-W135 AromaticContact CG-CH2 3.54Å; Y20-W135 HydrophobicContact CG-CH2 3.54Å; Y20-W135 AromaticContact CG-CZ2 3.45Å; Y20-W135 HydrophobicContact CG-CZ2 3.45Å; Y20-W135 VanDerWaalsContact CG-CZ2 3.45Å; Y20-W135 AromaticContact CZ-CZ2 3.74Å; Y20-V136 HydrophobicContact CD1-CG2 3.75Å; Y20-V136 HydrophobicContact CE1-CG2 3.9Å
21D97Very high93.6Very high0 Ų070.8 Ų70.80%036%0.362CS..Hα-helixtrans-59.3-42177.8175.886000111.9T17 V25 W34 K37 Y43 F46T17-D21 WeakPolarHBondContact O-CB 3.32Å; T17-D21 PolarHBondContact O-N 2.84Å; D21-V25 HydrophobicContact CB-CB 4.5Å; D21-V25 HydrophobicContact CB-CG2 4.4Å; D21-V25 WeakPolarHBondContact O-CB 3.35Å; D21-V25 PolarHBondContact O-N 3.45Å; D21-V25 WeakPolarHBondContact OD1-CB 3.37Å; D21-W34 PolarHBondContact OD2-NE1 2.87Å; D21-K37 PolarHBondContact O-NZ 2.82Å; D21-K37 IonicContact OD1-NZ 2.85Å; D21-K37 PolarHBondContact OD1-NZ 2.66Å; D21-K37 IonicContact OD2-NZ 2.79Å; D21-K37 PolarHBondContact OD2-NZ 2.95Å; D21-Y43 WeakPolarHBondContact OD1-CE1 3.48Å; D21-Y43 PolarHBondContact OD1-OH 3.37Å; D21-F46 HydrophobicContact CB-CE1 4.37Å
22Y95Very high93Very high156 Ų15671.6 Ų71.661%0.61237%0.372SS*.Hα-helixtrans-64.2-40177.2178.8-98.9000112.5C18 M19 Y20 W34C18-Y22 WeakPolarHBondContact O-CB 2.88Å; C18-Y22 PolarHBondContact O-N 2.97Å; C18-Y22 VanDerWaalsContact O-N 3.08Å; M19-Y22 PolarHBondContact O-N 3.23Å; Y20-Y22 VanDerWaalsContact C-N 3.3Å; Y20-Y22 PolarHBondContact O-N 3.25Å; Y22-W34 AromaticContact CD2-CD1 3.92Å; Y22-W34 HydrophobicContact CD2-CD2 4.37Å; Y22-W34 HydrophobicContact CD2-CG 4.04Å
23M95.4Very high92.7Very high110 Ų11069.7 Ų69.754%0.54237%0.371SS..Hα-helixtrans-83.5-33.9-174.3-66.9-61.6-64.600113.9M19 Y20M19-M23 WeakPolarHBondContact O-CB 3.31Å; M19-M23 WeakPolarHBondContact O-CG 3.21Å; M19-M23 PolarHBondContact O-N 3.44Å; M19-M23 VanDerWaalsContact O-N 3.08Å; Y20-M23 PolarHBondContact O-N 3.33Å
24Y95.3Very high92.4Very high156 Ų15670.3 Ų70.361%0.61237%0.37SS*.Hα-helixtrans-126-24.1-165.1-58.1-69.1000114.9Y20 P26Y20-Y24 HydrophobicContact CD1-CD2 4.15Å; Y20-Y24 AromaticContact CD2-CD2 3.42Å; Y20-Y24 HydrophobicContact CD2-CD2 3.42Å; Y20-Y24 VanDerWaalsContact CD2-CD2 3.42Å; Y20-Y24 AromaticContact CD2-CE2 3.83Å; Y20-Y24 HydrophobicContact CD2-CE2 3.83Å; Y20-Y24 HydrophobicContact CD2-CG 4.43Å; Y20-Y24 HydrophobicContact CE1-CD2 4.19Å; Y20-Y24 HydrophobicContact CE1-CG 4.4Å; Y20-Y24 AromaticContact CE2-CD2 3.47Å; Y20-Y24 HydrophobicContact CE2-CD2 3.47Å; Y20-Y24 VanDerWaalsContact CE2-CD2 3.47Å; Y20-Y24 AromaticContact CE2-CE2 3.97Å; Y20-Y24 HydrophobicContact CE2-CE2 3.97Å; Y20-Y24 HydrophobicContact CE2-CG 4.13Å; Y20-Y24 AromaticContact CG-CD2 3.78Å; Y20-Y24 HydrophobicContact CG-CD2 3.78Å; Y20-Y24 AromaticContact CZ-CD2 3.88Å; Y20-Y24 WeakPolarHBondContact O-CD2 3.4Å; Y20-Y24 PolarHBondContact O-N 3.41Å; Y24-P26 WeakPolarHBondContact O-CD 3.47Å
25V94.6Very high92Very high8 Ų875.6 Ų75.65%0.04840%0.397CS..SBendtrans-89.7117.6-177.5178.20000109.5Y20 D21 K37 I132Y20-V25 HydrophobicContact CD1-CG2 4.4Å; Y20-V25 HydrophobicContact CE1-CG2 4.39Å; D21-V25 HydrophobicContact CB-CB 4.5Å; D21-V25 HydrophobicContact CB-CG2 4.4Å; D21-V25 WeakPolarHBondContact O-CB 3.35Å; D21-V25 PolarHBondContact O-N 3.45Å; D21-V25 WeakPolarHBondContact OD1-CB 3.37Å; V25-K37 PolarHBondContact O-NZ 3.35Å; V25-I132 HydrophobicContact CG1-CG1 3.94Å
26P93Very high91.7Very high56 Ų5674.9 Ų74.936%0.36439%0.392SS..PPolyproline II helixtrans-66.1155-176.227.5-34.1000112.3Y24 K37 L131Y24-P26 WeakPolarHBondContact O-CD 3.47Å; P26-K37 WeakPolarHBondContact O-CE 3.39Å; P26-L131 HydrophobicContact CG-CB 4.12Å; P26-L131 HydrophobicContact CG-CD2 4.12Å
27V91.3Very high91.5Very high19 Ų1970.3 Ų70.312%0.11537%0.372CS..PPolyproline II helixtrans-84.5139.2171.8-176.60000109.1P29 Q30 W34 M36V27-P29 CarbonylContact C-O 3.48Å; V27-P29 CarbonylContact O-C 3.57Å; V27-P29 VanDerWaalsContact O-C 3.28Å; V27-P29 VanDerWaalsContact O-O 3.1Å; V27-Q30 WeakPolarHBondContact O-CA 3.39Å; V27-Q30 PolarHBondContact O-N 3.1Å; V27-W34 HydrophobicContact CG2-CB 4.32Å; V27-M36 HydrophobicContact CG1-CB 4.08Å
28L83.9Confident91.4Very high49 Ų4972.9 Ų72.926%0.25739%0.385SS..SBendtrans-110.2129.6174.2-64.2178.6000110.7R39 Y127 L128 L131L28-R39 PolarHBondContact O-NH2 2.98Å; L28-Y127 HydrophobicContact CD1-CE2 4.13Å; L28-L128 HydrophobicContact CD1-CD2 3.51Å; L28-L131 HydrophobicContact CD1-CD1 4.26Å; L28-L131 HydrophobicContact CD2-CD1 3.95Å
29P82.5Confident91.2Very high70 Ų7073 Ų7346%0.45538%0.381SS..SBendcis-67.5157.9-6.328.9-33.7000112.9V27 G32V27-P29 CarbonylContact C-O 3.48Å; V27-P29 CarbonylContact O-C 3.57Å; V27-P29 VanDerWaalsContact O-C 3.28Å; V27-P29 VanDerWaalsContact O-O 3.1Å; P29-G32 PolarHBondContact O-N 3.45Å; P29-G32 VanDerWaalsContact O-N 3.1Å
30Q78Confident91.1Very high170 Ų17069.4 Ų69.479%0.79436%0.362SS*.THydrogen-bonded Turntrans-56137.8-177.5-67.8177.61.100111.4V27 G32V27-Q30 WeakPolarHBondContact O-CA 3.39Å; V27-Q30 PolarHBondContact O-N 3.1Å; Q30-G32 VanDerWaalsContact C-N 3.32Å
31G80.5Confident91.1Very high88 Ų8867.4 Ų67.491%0.90736%0.355SS*.THydrogen-bonded Turntrans85.5-2.6-174.300000114.8
32G85.7Confident91.1Very high24 Ų2468.1 Ų68.125%0.24736%0.36CS..  trans-68.216117200000113.6P29 Q30P29-G32 PolarHBondContact O-N 3.45Å; P29-G32 VanDerWaalsContact O-N 3.1Å; Q30-G32 VanDerWaalsContact C-N 3.32Å
33V91Very high91.2Very high93 Ų9361.6 Ų61.656%0.56433%0.334SS*.  trans-81.6144.1173.3-71.50000110.9I35 M36V33-I35 HydrophobicContact CB-CG2 4.28Å; V33-I35 HydrophobicContact CG2-CG2 3.59Å; V33-I35 PolarHBondContact O-N 3.34Å; V33-M36 HydrophobicContact CG2-CG 3.95Å; V33-M36 HydrophobicContact CG2-SD 4.31Å; V33-M36 VanDerWaalsContact O-CB 3.25Å; V33-M36 WeakPolarHBondContact O-CB 3.2Å; V33-M36 PolarHBondContact O-N 3.5Å
34W90.4Very high91.3Very high64 Ų6458.2 Ų58.224%0.24232%0.318CS..G310 helixtrans-52.7-34.6-174.4-177.996.1000113.8D21 Y22 V27 M36 K37 I47D21-W34 PolarHBondContact OD2-NE1 2.87Å; Y22-W34 AromaticContact CD2-CD1 3.92Å; Y22-W34 HydrophobicContact CD2-CD2 4.37Å; Y22-W34 HydrophobicContact CD2-CG 4.04Å; V27-W34 HydrophobicContact CG2-CB 4.32Å; W34-M36 PolarHBondContact O-N 2.97Å; W34-K37 HydrophobicContact CG-CD 4.38Å; W34-K37 VanDerWaalsContact O-CB 3.3Å; W34-K37 WeakPolarHBondContact O-CB 3.31Å; W34-K37 WeakPolarHBondContact O-CG 3.01Å; W34-K37 PolarHBondContact O-N 3.06Å; W34-I47 HydrophobicContact CH2-CD1 3.67Å; W34-I47 HydrophobicContact CH2-CG1 4.03Å; W34-I47 HydrophobicContact CZ2-CD1 4.17Å
35I91.5Very high91.4Very high111 Ų11150.8 Ų50.857%0.56929%0.289SS*.G310 helixtrans-58-22.5177.1-162.2171000113.5V33 K37 L38V33-I35 HydrophobicContact CB-CG2 4.28Å; V33-I35 HydrophobicContact CG2-CG2 3.59Å; V33-I35 PolarHBondContact O-N 3.34Å; I35-K37 PolarHBondContact O-N 3.44Å; I35-L38 HydrophobicContact CG1-CD1 3.78Å; I35-L38 HydrophobicContact CG1-CG 4.39Å; I35-L38 VanDerWaalsContact O-CB 3.29Å; I35-L38 WeakPolarHBondContact O-CB 3.29Å; I35-L38 PolarHBondContact O-N 3.23Å
36M91.7Very high91.6Very high71 Ų7150.4 Ų50.435%0.3529%0.286SS..G310 helixtrans-63.4-18.5173.6-73.1179.3142.800113.5V27 V33 W34 L38 R39V27-M36 HydrophobicContact CG1-CB 4.08Å; V33-M36 HydrophobicContact CG2-CG 3.95Å; V33-M36 HydrophobicContact CG2-SD 4.31Å; V33-M36 VanDerWaalsContact O-CB 3.25Å; V33-M36 WeakPolarHBondContact O-CB 3.2Å; V33-M36 PolarHBondContact O-N 3.5Å; W34-M36 PolarHBondContact O-N 2.97Å; M36-L38 PolarHBondContact O-N 2.69Å; M36-R39 WeakPolarHBondContact O-CB 3.39Å; M36-R39 VanDerWaalsContact O-CG 3.24Å; M36-R39 WeakPolarHBondContact O-CG 3.49Å; M36-R39 PolarHBondContact O-N 3.49Å; M36-R39 PolarHBondContact O-NE 3.21Å
37K94.3Very high91.8Very high8 Ų849.6 Ų49.64%0.03528%0.279CS..G310 helixtrans-64.2-28.5171.9-68.6-180170.5-170.30111.5D21 V25 P26 W34 I35 R39 F40 Y43D21-K37 PolarHBondContact O-NZ 2.82Å; D21-K37 IonicContact OD1-NZ 2.85Å; D21-K37 PolarHBondContact OD1-NZ 2.66Å; D21-K37 IonicContact OD2-NZ 2.79Å; D21-K37 PolarHBondContact OD2-NZ 2.95Å; V25-K37 PolarHBondContact O-NZ 3.35Å; P26-K37 WeakPolarHBondContact O-CE 3.39Å; W34-K37 HydrophobicContact CG-CD 4.38Å; W34-K37 VanDerWaalsContact O-CB 3.3Å; W34-K37 WeakPolarHBondContact O-CB 3.31Å; W34-K37 WeakPolarHBondContact O-CG 3.01Å; W34-K37 PolarHBondContact O-N 3.06Å; I35-K37 PolarHBondContact O-N 3.44Å; K37-R39 PolarHBondContact O-N 3.11Å; K37-F40 PolarHBondContact O-N 3.34Å; K37-Y43 HydrophobicContact CB-CD1 3.82Å; K37-Y43 HydrophobicContact CB-CD2 3.91Å; K37-Y43 HydrophobicContact CB-CE1 4.04Å; K37-Y43 HydrophobicContact CB-CE2 4.09Å; K37-Y43 HydrophobicContact CB-CG 3.76Å; K37-Y43 HydrophobicContact CD-CD1 4.25Å; K37-Y43 HydrophobicContact CD-CE1 3.64Å; K37-Y43 HydrophobicContact CD-CE2 4.26Å; K37-Y43 HydrophobicContact CG-CE1 4.33Å; K37-Y43 HydrophobicContact CG-CE2 4.29Å; K37-Y43 WeakPolarHBondContact O-CB 3.48Å
38L94.5Very high92.2Very high55 Ų5549.1 Ų49.129%0.28828%0.278SS..G310 helixtrans-66.4-2.8177.2-60.4-176.7000114.3I35 M36 F40 I44 I47I35-L38 HydrophobicContact CG1-CD1 3.78Å; I35-L38 HydrophobicContact CG1-CG 4.39Å; I35-L38 VanDerWaalsContact O-CB 3.29Å; I35-L38 WeakPolarHBondContact O-CB 3.29Å; I35-L38 PolarHBondContact O-N 3.23Å; M36-L38 PolarHBondContact O-N 2.69Å; L38-F40 PolarHBondContact O-N 2.9Å; L38-I44 HydrophobicContact CB-CG1 4.49Å; L38-I44 VanDerWaalsContact O-CD1 3.3Å; L38-I44 WeakPolarHBondContact O-CD1 3.5Å; L38-I44 VanDerWaalsContact O-CG1 3.23Å; L38-I44 WeakPolarHBondContact O-CG1 3.38Å; L38-I47 HydrophobicContact CD2-CG1 4.03Å
39R93.6Very high92.9Very high34 Ų3446.8 Ų46.813%0.12827%0.266CS..G310 helixtrans-71.4-22.5170.5-56.4177.9-67.1162.9-4.2111.9L28 M36 K37 Y176 L179 N183 Y189 M191L28-R39 PolarHBondContact O-NH2 2.98Å; M36-R39 WeakPolarHBondContact O-CB 3.39Å; M36-R39 VanDerWaalsContact O-CG 3.24Å; M36-R39 WeakPolarHBondContact O-CG 3.49Å; M36-R39 PolarHBondContact O-N 3.49Å; M36-R39 PolarHBondContact O-NE 3.21Å; K37-R39 PolarHBondContact O-N 3.11Å; R39-Y176 WeakPolarHBondContact O-CE2 3.38Å; R39-Y176 PolarHBondContact O-OH 2.87Å; R39-L179 HydrophobicContact CB-CD2 4.2Å; R39-L179 WeakPolarHBondContact O-CD2 3.26Å; R39-N183 WeakPolarHBondContact CD-OD1 3.43Å; R39-N183 PolarHBondContact NH1-OD1 2.98Å; R39-Y189 PolarHBondContact NH1-OH 3.1Å; R39-M191 HydrophobicContact CB-CE 3.16Å; R39-M191 HydrophobicContact CB-SD 3.52Å; R39-M191 VanDerWaalsContact CB-SD 3.52Å; R39-M191 HydrophobicContact CG-CE 4.13Å; R39-M191 VanDerWaalsContact O-SD 3.37Å
40F95.7Very high93.6Very high55 Ų5543.9 Ų43.924%0.24125%0.247CC..SBendtrans-89.4135.1175-63-83.9000111.5K37 L38 T42 Y43 I44 M191 Y192K37-F40 PolarHBondContact O-N 3.34Å; L38-F40 PolarHBondContact O-N 2.9Å; F40-T42 PolarHBondContact O-N 3.31Å; F40-Y43 HydrophobicContact CB-CD2 4.15Å; F40-Y43 HydrophobicContact CD2-CD2 4.49Å; F40-Y43 PolarHBondContact O-N 3.31Å; F40-I44 PolarHBondContact O-N 2.76Å; F40-M191 HydrophobicContact CD1-CB 4.4Å; F40-M191 HydrophobicContact CD2-CE 4.38Å; F40-M191 HydrophobicContact CE1-CB 4Å; F40-M191 HydrophobicContact CE1-CE 4.28Å; F40-M191 WeakPolarHBondContact CE1-O 3.43Å; F40-M191 HydrophobicContact CE2-CE 4.05Å; F40-M191 HydrophobicContact CZ-CE 4Å; F40-Y192 AromaticContact CD1-CE1 3.96Å; F40-Y192 HydrophobicContact CD1-CE1 3.96Å
41L97.5Very high94.6Very high18 Ų1841.1 Ų41.19%0.09424%0.237CC..Hα-helixtrans-58.2-39.1179.3-172.358000111.6Y43 I44 N45 V104 L107 V108 F172 Y176 Y192L41-Y43 VanDerWaalsContact C-N 3.25Å; L41-Y43 PolarHBondContact O-N 3.16Å; L41-I44 PolarHBondContact O-N 3.45Å; L41-N45 WeakPolarHBondContact O-CB 3.38Å; L41-N45 PolarHBondContact O-N 2.76Å; L41-V104 HydrophobicContact CD1-CG1 3.88Å; L41-V104 HydrophobicContact CD2-CG1 4.44Å; L41-V104 HydrophobicContact CG-CG1 4.19Å; L41-L107 HydrophobicContact CD2-CD2 4.14Å; L41-V108 HydrophobicContact CD2-CG2 4.04Å; L41-V108 HydrophobicContact CG-CG2 3.88Å; L41-F172 HydrophobicContact CD1-CE1 3.96Å; L41-F172 HydrophobicContact CD1-CZ 3.89Å; L41-Y176 HydrophobicContact CB-CD1 4.34Å; L41-Y176 HydrophobicContact CB-CE1 3.62Å; L41-Y176 HydrophobicContact CB-CE2 4.09Å; L41-Y176 HydrophobicContact CD1-CD1 4.05Å; L41-Y176 HydrophobicContact CD1-CD2 4.15Å; L41-Y176 HydrophobicContact CD1-CE1 4.19Å; L41-Y176 HydrophobicContact CD1-CE2 4.31Å; L41-Y176 HydrophobicContact CD1-CG 4.04Å; L41-Y176 HydrophobicContact CD2-CD1 4.4Å; L41-Y176 HydrophobicContact CD2-CE1 4.25Å; L41-Y176 HydrophobicContact CG-CD1 4.5Å; L41-Y176 HydrophobicContact CG-CE1 4.23Å; L41-Y176 PolarHBondContact N-OH 3.32Å; L41-Y192 PolarHBondContact N-OH 3.34Å
42T97.2Very high95.4Very high15 Ų1537 Ų379%0.09219%0.194CC..Hα-helixtrans-54.8-42.5176.2-54.60000111.5F40 N45 F46 V108 L140 H141F40-T42 PolarHBondContact O-N 3.31Å; T42-N45 PolarHBondContact O-N 3.23Å; T42-F46 WeakPolarHBondContact O-CB 3.42Å; T42-F46 PolarHBondContact O-N 3.1Å; T42-V108 HydrophobicContact CG2-CG1 4.25Å; T42-L140 HydrophobicContact CG2-CB 3.74Å; T42-H141 WeakPolarHBondContact CG2-NE2 3.48Å; T42-H141 PolarHBondContact OG1-CD2 3.34Å; T42-H141 PolarHBondContact OG1-NE2 3.37Å
43Y96.9Very high96Very high20 Ų2035.9 Ų35.98%0.07818%0.182CC..Hα-helixtrans-74.5-36.2179.7-87.5-79.2000112.5D21 K37 F40 L41 F46 I47D21-Y43 WeakPolarHBondContact OD1-CE1 3.48Å; D21-Y43 PolarHBondContact OD1-OH 3.37Å; K37-Y43 HydrophobicContact CB-CD1 3.82Å; K37-Y43 HydrophobicContact CB-CD2 3.91Å; K37-Y43 HydrophobicContact CB-CE1 4.04Å; K37-Y43 HydrophobicContact CB-CE2 4.09Å; K37-Y43 HydrophobicContact CB-CG 3.76Å; K37-Y43 HydrophobicContact CD-CD1 4.25Å; K37-Y43 HydrophobicContact CD-CE1 3.64Å; K37-Y43 HydrophobicContact CD-CE2 4.26Å; K37-Y43 HydrophobicContact CG-CE1 4.33Å; K37-Y43 HydrophobicContact CG-CE2 4.29Å; K37-Y43 WeakPolarHBondContact O-CB 3.48Å; F40-Y43 HydrophobicContact CB-CD2 4.15Å; F40-Y43 HydrophobicContact CD2-CD2 4.49Å; F40-Y43 PolarHBondContact O-N 3.31Å; L41-Y43 VanDerWaalsContact C-N 3.25Å; L41-Y43 PolarHBondContact O-N 3.16Å; Y43-F46 AromaticContact CD1-CD1 3.96Å; Y43-F46 HydrophobicContact CD1-CD1 3.96Å; Y43-F46 HydrophobicContact CE1-CD1 4.24Å; Y43-F46 HydrophobicContact CE1-CE1 4.49Å; Y43-F46 PolarHBondContact O-N 3.29Å; Y43-I47 WeakPolarHBondContact O-CG1 3.22Å; Y43-I47 PolarHBondContact O-N 2.91Å
44I97.9Very high96.3Very high38 Ų3833.8 Ų33.820%0.19517%0.171CC..Hα-helixtrans-60.5-48.2171.2-63.2174.7000110.1L38 F40 L41 G48 F100 F172 Y176L38-I44 HydrophobicContact CB-CG1 4.49Å; L38-I44 VanDerWaalsContact O-CD1 3.3Å; L38-I44 WeakPolarHBondContact O-CD1 3.5Å; L38-I44 VanDerWaalsContact O-CG1 3.23Å; L38-I44 WeakPolarHBondContact O-CG1 3.38Å; F40-I44 PolarHBondContact O-N 2.76Å; L41-I44 PolarHBondContact O-N 3.45Å; I44-G48 PolarHBondContact O-N 2.84Å; I44-F100 HydrophobicContact CG2-CE2 4.11Å; I44-F100 HydrophobicContact CG2-CZ 3.93Å; I44-F172 HydrophobicContact CG2-CE2 4.29Å; I44-F172 HydrophobicContact CG2-CZ 4.16Å; I44-Y176 HydrophobicContact CD1-CD2 3.62Å; I44-Y176 HydrophobicContact CD1-CE2 3.67Å
45N98.5Very high96.6Very high0 Ų032.8 Ų32.80%017%0.17CC..Hα-helixtrans-59-50.3175.1173.757.1000110.7L41 T42 I47 G48 Q49 V104 G105 V108 S144L41-N45 WeakPolarHBondContact O-CB 3.38Å; L41-N45 PolarHBondContact O-N 2.76Å; T42-N45 PolarHBondContact O-N 3.23Å; N45-I47 PolarHBondContact O-N 3.08Å; N45-G48 CarbonylContact O-C 3.56Å; N45-G48 VanDerWaalsContact O-CA 3.29Å; N45-G48 WeakPolarHBondContact O-CA 3.47Å; N45-G48 PolarHBondContact O-N 3.42Å; N45-Q49 VanDerWaalsContact O-CG 3.23Å; N45-Q49 WeakPolarHBondContact O-CG 3.49Å; N45-Q49 PolarHBondContact O-N 3.21Å; N45-Q49 PolarHBondContact OD1-NE2 2.9Å; N45-V104 HydrophobicContact CB-CG1 4.22Å; N45-G105 WeakPolarHBondContact OD1-CA 3.33Å; N45-V108 HydrophobicContact CB-CG2 4.02Å; N45-S144 PolarHBondContact ND2-OG 3.11Å
46F98.2Very high96.8Very high0 Ų027.6 Ų27.60%014%0.144CC..Hα-helixtrans-55.1-47.6-179.6169.8-135.4000113.6W14 T17 C18 D21 T42 Y43 G48 Q49 T50 L140W14-F46 AromaticContact CE3-CD2 3.57Å; W14-F46 HydrophobicContact CE3-CD2 3.57Å; W14-F46 AromaticContact CE3-CE2 3.72Å; W14-F46 HydrophobicContact CE3-CE2 3.72Å; W14-F46 AromaticContact CZ3-CD2 3.64Å; W14-F46 HydrophobicContact CZ3-CD2 3.64Å; W14-F46 HydrophobicContact CZ3-CE2 4.11Å; T17-F46 HydrophobicContact CG2-CE2 4Å; T17-F46 HydrophobicContact CG2-CZ 3.87Å; C18-F46 VanDerWaalsContact CA-CZ 3.41Å; C18-F46 HydrophobicContact CB-CE1 4.32Å; C18-F46 HydrophobicContact CB-CE2 4.41Å; C18-F46 HydrophobicContact CB-CZ 3.76Å; D21-F46 HydrophobicContact CB-CE1 4.37Å; T42-F46 WeakPolarHBondContact O-CB 3.42Å; T42-F46 PolarHBondContact O-N 3.1Å; Y43-F46 AromaticContact CD1-CD1 3.96Å; Y43-F46 HydrophobicContact CD1-CD1 3.96Å; Y43-F46 HydrophobicContact CE1-CD1 4.24Å; Y43-F46 HydrophobicContact CE1-CE1 4.49Å; Y43-F46 PolarHBondContact O-N 3.29Å; F46-G48 VanDerWaalsContact C-N 3.32Å; F46-Q49 PolarHBondContact O-N 3.46Å; F46-T50 WeakPolarHBondContact O-CB 3.42Å; F46-T50 PolarHBondContact O-N 3.42Å; F46-T50 PolarHBondContact O-OG1 3.47Å; F46-L140 HydrophobicContact CB-CD2 3.61Å; F46-L140 HydrophobicContact CD1-CD2 3.52Å; F46-L140 HydrophobicContact CD2-CD2 3.59Å; F46-L140 HydrophobicContact CE1-CD2 3.94Å; F46-L140 HydrophobicContact CE2-CD2 4Å; F46-L140 HydrophobicContact CG-CD2 3.29Å; F46-L140 HydrophobicContact CZ-CD2 4.12Å
47I98Very high97Very high39 Ų3926.1 Ų26.120%0.214%0.139CC..Hα-helixtrans-66.7-39.4176.1-62.6-52.4000110.8W34 L38 Y43 N45 T50 L51W34-I47 HydrophobicContact CH2-CD1 3.67Å; W34-I47 HydrophobicContact CH2-CG1 4.03Å; W34-I47 HydrophobicContact CZ2-CD1 4.17Å; L38-I47 HydrophobicContact CD2-CG1 4.03Å; Y43-I47 WeakPolarHBondContact O-CG1 3.22Å; Y43-I47 PolarHBondContact O-N 2.91Å; N45-I47 PolarHBondContact O-N 3.08Å; I47-T50 PolarHBondContact O-N 3.36Å; I47-L51 HydrophobicContact CG2-CD1 4.04Å; I47-L51 HydrophobicContact CG2-CG 4.37Å; I47-L51 WeakPolarHBondContact O-CB 3.4Å; I47-L51 WeakPolarHBondContact O-CG 3.3Å; I47-L51 PolarHBondContact O-N 3.37Å
48G98.2Very high97Very high10 Ų1029.6 Ų29.610%0.10316%0.157CC..Hα-helixtrans-51.8-55.7169.500000114.1I44 N45 F46 T50 L51 Y52 I101I44-G48 PolarHBondContact O-N 2.84Å; N45-G48 CarbonylContact O-C 3.56Å; N45-G48 VanDerWaalsContact O-CA 3.29Å; N45-G48 WeakPolarHBondContact O-CA 3.47Å; N45-G48 PolarHBondContact O-N 3.42Å; F46-G48 VanDerWaalsContact C-N 3.32Å; G48-T50 VanDerWaalsContact C-N 3.32Å; G48-T50 PolarHBondContact O-N 3.46Å; G48-L51 PolarHBondContact O-N 3.03Å; G48-Y52 WeakPolarHBondContact O-CB 3.41Å; G48-Y52 PolarHBondContact O-N 2.99Å; G48-I101 WeakPolarHBondContact O-CD1 3.3Å
49Q98.3Very high96.9Very high0 Ų027.5 Ų27.50%015%0.146CC..Hα-helixtrans-60.4-42178.8-63.5-70.1-11.600111W14 N45 F46 Y52 S53 I101 F147W14-Q49 HydrophobicContact CD2-CB 4.01Å; W14-Q49 HydrophobicContact CE3-CB 4.34Å; W14-Q49 HydrophobicContact CH2-CB 4.03Å; W14-Q49 HydrophobicContact CH2-CG 4.14Å; W14-Q49 HydrophobicContact CZ2-CB 3.62Å; W14-Q49 HydrophobicContact CZ2-CG 3.9Å; W14-Q49 HydrophobicContact CZ3-CB 4.36Å; N45-Q49 VanDerWaalsContact O-CG 3.23Å; N45-Q49 WeakPolarHBondContact O-CG 3.49Å; N45-Q49 PolarHBondContact O-N 3.21Å; N45-Q49 PolarHBondContact OD1-NE2 2.9Å; F46-Q49 PolarHBondContact O-N 3.46Å; Q49-Y52 PolarHBondContact O-N 2.92Å; Q49-S53 VanDerWaalsContact O-CB 3.27Å; Q49-S53 WeakPolarHBondContact O-CB 3.29Å; Q49-S53 PolarHBondContact O-N 2.86Å; Q49-S53 PolarHBondContact O-OG 3.2Å; Q49-I101 PolarHBondContact NE2-O 3.17Å; Q49-I101 VanDerWaalsContact NE2-O 3.09Å; Q49-F147 VanDerWaalsContact OE1-CE1 3.27Å
50T98.2Very high96.8Very high8 Ų826.1 Ų26.15%0.04914%0.141CC..Hα-helixtrans-61.1-53.2177.4-56.80000110.9W14 L15 C18 F46 I47 G48 Y52 S53 C54W14-T50 HydrophobicContact CB-CG2 4.23Å; L15-T50 HydrophobicContact CD2-CG2 3.84Å; L15-T50 HydrophobicContact CG-CG2 4.34Å; C18-T50 HydrophobicContact CB-CG2 4.4Å; F46-T50 WeakPolarHBondContact O-CB 3.42Å; F46-T50 PolarHBondContact O-N 3.42Å; F46-T50 PolarHBondContact O-OG1 3.47Å; I47-T50 PolarHBondContact O-N 3.36Å; G48-T50 VanDerWaalsContact C-N 3.32Å; G48-T50 PolarHBondContact O-N 3.46Å; T50-Y52 PolarHBondContact O-N 3.11Å; T50-S53 PolarHBondContact O-N 2.87Å; T50-S53 PolarHBondContact O-OG 3.08Å; T50-C54 PolarHBondContact O-N 3.3Å; T50-C54 PolarHBondContact O-SG 2.98Å; T50-C54 VanDerWaalsContact O-SG 3.4Å
51L98.2Very high96.6Very high112 Ų11228.1 Ų28.159%0.58615%0.15SC*.Hα-helixtrans-62.8-42.5179-67.9175.4000112I47 G48 C54 L55I47-L51 HydrophobicContact CG2-CD1 4.04Å; I47-L51 HydrophobicContact CG2-CG 4.37Å; I47-L51 WeakPolarHBondContact O-CB 3.4Å; I47-L51 WeakPolarHBondContact O-CG 3.3Å; I47-L51 PolarHBondContact O-N 3.37Å; G48-L51 PolarHBondContact O-N 3.03Å; L51-C54 WeakPolarHBondContact O-CB 3.45Å; L51-C54 PolarHBondContact O-N 3.36Å; L51-L55 WeakPolarHBondContact O-CG 3.45Å; L51-L55 PolarHBondContact O-N 3.44Å; L51-L55 VanDerWaalsContact O-N 3.1Å
52Y98.3Very high96.2Very high2 Ų230 Ų301%0.00816%0.159CC..Hα-helixtrans-65-42.5178.9-178.3-101.1000112.3G48 Q49 T50 C54 L55 C56 C93 I96 Y97 I101 F147 D151 H157G48-Y52 WeakPolarHBondContact O-CB 3.41Å; G48-Y52 PolarHBondContact O-N 2.99Å; Q49-Y52 PolarHBondContact O-N 2.92Å; T50-Y52 PolarHBondContact O-N 3.11Å; Y52-C54 VanDerWaalsContact C-N 3.27Å; Y52-C54 PolarHBondContact O-N 2.98Å; Y52-L55 CarbonylContact O-C 3.15Å; Y52-L55 WeakPolarHBondContact O-CA 3.3Å; Y52-L55 WeakPolarHBondContact O-CB 3.45Å; Y52-L55 PolarHBondContact O-N 3.31Å; Y52-C56 WeakPolarHBondContact CE1-SG 3.47Å; Y52-C56 PolarHBondContact O-N 3.22Å; Y52-C56 PolarHBondContact O-SG 2.84Å; Y52-C93 HydrophobicContact CE2-CB 4.16Å; Y52-C93 WeakPolarHBondContact CE2-O 3.41Å; Y52-I96 HydrophobicContact CD2-CG2 3.57Å; Y52-I96 HydrophobicContact CE2-CG2 3.74Å; Y52-Y97 HydrophobicContact CE1-CD2 4.04Å; Y52-Y97 AromaticContact CZ-CD2 3.82Å; Y52-Y97 WeakPolarHBondContact OH-CB 3.39Å; Y52-Y97 WeakPolarHBondContact OH-CD2 3.3Å; Y52-I101 HydrophobicContact CD1-CB 4.5Å; Y52-I101 HydrophobicContact CD1-CG1 4.13Å; Y52-I101 HydrophobicContact CD1-CG2 3.81Å; Y52-I101 HydrophobicContact CD2-CD1 4.43Å; Y52-I101 HydrophobicContact CD2-CG1 3.88Å; Y52-I101 HydrophobicContact CE1-CG2 4.17Å; Y52-I101 HydrophobicContact CE2-CG1 4.45Å; Y52-I101 HydrophobicContact CG-CD1 3.94Å; Y52-I101 HydrophobicContact CG-CG1 3.69Å; Y52-I101 HydrophobicContact CG-CG2 4.23Å; Y52-F147 AromaticContact CD1-CE1 3.7Å; Y52-F147 HydrophobicContact CD1-CE1 3.7Å; Y52-F147 AromaticContact CD1-CZ 3.85Å; Y52-F147 HydrophobicContact CD1-CZ 3.85Å; Y52-F147 HydrophobicContact CE1-CE1 4.08Å; Y52-F147 HydrophobicContact CE1-CZ 4.2Å; Y52-D151 VanDerWaalsContact CE1-OD2 3.27Å; Y52-D151 WeakPolarHBondContact CE1-OD2 3.14Å; Y52-D151 PolarHBondContact OH-OD2 2.68Å; Y52-H157 PolarHBondContact OH-CE1 3.41Å
53S97.8Very high95.6Very high0 Ų029.5 Ų29.50%016%0.157CC..Hα-helixtrans-60-37.7176.772.40000112.3A11 Q49 T50 C56 V57A11-S53 WeakPolarHBondContact CA-OG 3.33Å; Q49-S53 VanDerWaalsContact O-CB 3.27Å; Q49-S53 WeakPolarHBondContact O-CB 3.29Å; Q49-S53 PolarHBondContact O-N 2.86Å; Q49-S53 PolarHBondContact O-OG 3.2Å; T50-S53 PolarHBondContact O-N 2.87Å; T50-S53 PolarHBondContact O-OG 3.08Å; S53-C56 PolarHBondContact O-N 2.88Å; S53-V57 WeakPolarHBondContact O-CG2 3.44Å; S53-V57 PolarHBondContact O-N 3.38Å
54C97.9Very high95.1Very high50 Ų5032.8 Ų32.834%0.33817%0.169SC..Hα-helixtrans-63.9-40.4171.9-670000112.2T50 L51 Y52 C56 V57 L58T50-C54 PolarHBondContact O-N 3.3Å; T50-C54 PolarHBondContact O-SG 2.98Å; T50-C54 VanDerWaalsContact O-SG 3.4Å; L51-C54 WeakPolarHBondContact O-CB 3.45Å; L51-C54 PolarHBondContact O-N 3.36Å; Y52-C54 VanDerWaalsContact C-N 3.27Å; Y52-C54 PolarHBondContact O-N 2.98Å; C54-C56 VanDerWaalsContact C-N 3.33Å; C54-V57 PolarHBondContact O-N 2.91Å; C54-L58 PolarHBondContact O-N 3.47Å
55L96.6Very high94.5Very high43 Ų4336.6 Ų36.623%0.22518%0.181CC..Hα-helixtrans-64.3-36.9174-67.4172.3000111.9L51 Y52 L58 R59 L89 F92L51-L55 WeakPolarHBondContact O-CG 3.45Å; L51-L55 PolarHBondContact O-N 3.44Å; L51-L55 VanDerWaalsContact O-N 3.1Å; Y52-L55 CarbonylContact O-C 3.15Å; Y52-L55 WeakPolarHBondContact O-CA 3.3Å; Y52-L55 WeakPolarHBondContact O-CB 3.45Å; Y52-L55 PolarHBondContact O-N 3.31Å; L55-L58 PolarHBondContact O-N 3.21Å; L55-R59 VanDerWaalsContact O-CB 3.29Å; L55-R59 WeakPolarHBondContact O-CB 3.45Å; L55-R59 PolarHBondContact O-N 3.47Å; L55-L89 HydrophobicContact CD2-CD1 4.12Å; L55-F92 HydrophobicContact CD1-CD1 4.22Å; L55-F92 HydrophobicContact CD1-CE1 3.77Å
56C95.5Very high93.7Very high2 Ų239.2 Ų39.21%0.01420%0.199CC..Hα-helixtrans-64.6-40.8174.7-67.30000112.2Y7 Y52 S53 C54 R59 A60Y7-C56 HydrophobicContact CD1-CB 3.54Å; Y7-C56 HydrophobicContact CD2-CB 4.11Å; Y7-C56 HydrophobicContact CE1-CB 3.72Å; Y7-C56 HydrophobicContact CE2-CB 4.24Å; Y7-C56 HydrophobicContact CG-CB 3.76Å; Y52-C56 WeakPolarHBondContact CE1-SG 3.47Å; Y52-C56 PolarHBondContact O-N 3.22Å; Y52-C56 PolarHBondContact O-SG 2.84Å; S53-C56 PolarHBondContact O-N 2.88Å; C54-C56 VanDerWaalsContact C-N 3.33Å; C56-R59 PolarHBondContact O-N 2.97Å; C56-A60 VanDerWaalsContact O-CB 3.26Å; C56-A60 WeakPolarHBondContact O-CB 3.37Å; C56-A60 PolarHBondContact O-N 3.34Å
57V96.3Very high92.7Very high39 Ų3944.1 Ų44.124%0.23622%0.222CC..Hα-helixtrans-61-47.5172.61740000110.9L4 Y7 A11 S53 C54 R59 A60 F61L4-V57 HydrophobicContact CD1-CG1 4.15Å; Y7-V57 WeakPolarHBondContact O-CG2 3.28Å; A11-V57 HydrophobicContact CB-CG2 3.77Å; S53-V57 WeakPolarHBondContact O-CG2 3.44Å; S53-V57 PolarHBondContact O-N 3.38Å; C54-V57 PolarHBondContact O-N 2.91Å; V57-R59 PolarHBondContact O-N 2.84Å; V57-A60 PolarHBondContact O-N 3.37Å; V57-F61 WeakPolarHBondContact O-CB 3.46Å; V57-F61 PolarHBondContact O-N 2.79Å
58L94.4Very high91.7Very high81 Ų8146.4 Ų46.442%0.42424%0.238SC..Hα-helixtrans-60.7-46.8178.8176.960.6000111.7C54 L55 F61 I62 L89C54-L58 PolarHBondContact O-N 3.47Å; L55-L58 PolarHBondContact O-N 3.21Å; L58-F61 PolarHBondContact O-N 2.89Å; L58-I62 HydrophobicContact CD1-CD1 4.02Å; L58-I62 HydrophobicContact CD1-CG1 4.38Å; L58-I62 HydrophobicContact CG-CD1 4Å; L58-I62 WeakPolarHBondContact O-CG1 3.33Å; L58-I62 PolarHBondContact O-N 2.95Å; L58-L89 HydrophobicContact CD2-CD2 4.34Å; L58-L89 HydrophobicContact CG-CD2 4.34Å
59R91.5Very high90.5Very high12 Ų1255.3 Ų55.35%0.04527%0.268CS..Hα-helixtrans-58.3-52.9175.7177.2-176.4168.6175.40.8110.8L55 C56 V57 F61 I62 D63 L89 H90 D94 V155L55-R59 VanDerWaalsContact O-CB 3.29Å; L55-R59 WeakPolarHBondContact O-CB 3.45Å; L55-R59 PolarHBondContact O-N 3.47Å; C56-R59 PolarHBondContact O-N 2.97Å; V57-R59 PolarHBondContact O-N 2.84Å; R59-F61 PolarHBondContact O-N 2.92Å; R59-I62 PolarHBondContact O-N 3.48Å; R59-D63 IonicContact NE-OD2 3.22Å; R59-D63 VanDerWaalsContact O-CG 3.24Å; R59-D63 PolarHBondContact O-N 2.92Å; R59-L89 HydrophobicContact CB-CD2 4.47Å; R59-H90 PolarHBondContact NE-CD2 2.98Å; R59-H90 PolarHBondContact NE-NE2 3.47Å; R59-H90 VanDerWaalsContact NE-NE2 3.17Å; R59-H90 PolarHBondContact NH2-CD2 3.1Å; R59-D94 IonicContact NH1-OD1 3.11Å; R59-D94 PolarHBondContact NH1-OD1 3.41Å; R59-V155 VanDerWaalsContact NH2-CG1 3.27Å
60A91.5Very high89.1Confident5 Ų561 Ų614%0.04130%0.299CS..Hα-helixtrans-60.6-32.518000000112.9L4 Y7 C56 V57 R64L4-A60 HydrophobicContact CB-CB 4.24Å; L4-A60 HydrophobicContact CD1-CB 4.01Å; Y7-A60 HydrophobicContact CD2-CB 3.79Å; Y7-A60 HydrophobicContact CE2-CB 4.29Å; C56-A60 VanDerWaalsContact O-CB 3.26Å; C56-A60 WeakPolarHBondContact O-CB 3.37Å; C56-A60 PolarHBondContact O-N 3.34Å; V57-A60 PolarHBondContact O-N 3.37Å; A60-R64 VanDerWaalsContact O-CB 3.23Å; A60-R64 WeakPolarHBondContact O-CB 3.49Å; A60-R64 PolarHBondContact O-N 3.11Å
61F91.5Very high87.1Confident96 Ų9667.3 Ų67.342%0.42134%0.337SS..Hα-helixtrans-71.3-40.3173.7-177.2-107.5000112.8L4 V57 L58 R59 R65L4-F61 HydrophobicContact CD1-CB 4.27Å; L4-F61 HydrophobicContact CD2-CD2 4.36Å; V57-F61 WeakPolarHBondContact O-CB 3.46Å; V57-F61 PolarHBondContact O-N 2.79Å; L58-F61 PolarHBondContact O-N 2.89Å; R59-F61 PolarHBondContact O-N 2.92Å; F61-R65 HydrophobicContact CE1-CG 4.42Å; F61-R65 HydrophobicContact CZ-CG 4.34Å; F61-R65 WeakPolarHBondContact O-CG 3.45Å; F61-R65 PolarHBondContact O-N 3.3Å; F61-R65 VanDerWaalsContact O-N 3.07Å
62I88.9Confident85Confident57 Ų5763 Ų6329%0.29232%0.32SS..Hα-helixtrans-64.2-49174.7-70.1165.8000110.3L58 R59 R64 R65 S66 L89L58-I62 HydrophobicContact CD1-CD1 4.02Å; L58-I62 HydrophobicContact CD1-CG1 4.38Å; L58-I62 HydrophobicContact CG-CD1 4Å; L58-I62 WeakPolarHBondContact O-CG1 3.33Å; L58-I62 PolarHBondContact O-N 2.95Å; R59-I62 PolarHBondContact O-N 3.48Å; I62-R64 VanDerWaalsContact C-N 3.32Å; I62-R64 PolarHBondContact O-N 2.85Å; I62-R65 PolarHBondContact O-N 2.85Å; I62-R65 VanDerWaalsContact O-N 3.09Å; I62-S66 PolarHBondContact O-N 3.45Å; I62-L89 HydrophobicContact CD1-CD2 3.76Å
63D85.9Confident82.7Confident6 Ų669 Ų693%0.03236%0.359CS..Hα-helixtrans-58.7-47.4179.9-65-11000109.8R59 R65 S66 E67 H90R59-D63 IonicContact NE-OD2 3.22Å; R59-D63 VanDerWaalsContact O-CG 3.24Å; R59-D63 PolarHBondContact O-N 2.92Å; D63-R65 VanDerWaalsContact C-N 3.31Å; D63-R65 PolarHBondContact O-N 3.14Å; D63-S66 PolarHBondContact O-N 2.95Å; D63-S66 PolarHBondContact O-OG 3.2Å; D63-E67 WeakPolarHBondContact O-CG 3.31Å; D63-E67 PolarHBondContact O-N 2.59Å; D63-H90 IonicContact OD1-CE1 3.16Å; D63-H90 PolarHBondContact OD1-CE1 2.98Å; D63-H90 IonicContact OD1-NE2 3.43Å; D63-H90 PolarHBondContact OD1-NE2 3.37Å; D63-H90 VanDerWaalsContact OD1-NE2 3.16Å; D63-H90 IonicContact OD2-NE2 3.76Å; D63-H90 PolarHBondContact OD2-NE2 3.09Å
64R85.2Confident80.3Confident89 Ų8975.4 Ų75.434%0.33639%0.389SS..Hα-helixtrans-58.8-40.9176.1179.455.7-177153.75113A60 I62 S66 E67 V68A60-R64 VanDerWaalsContact O-CB 3.23Å; A60-R64 WeakPolarHBondContact O-CB 3.49Å; A60-R64 PolarHBondContact O-N 3.11Å; I62-R64 VanDerWaalsContact C-N 3.32Å; I62-R64 PolarHBondContact O-N 2.85Å; R64-S66 VanDerWaalsContact C-N 3.31Å; R64-E67 IonicContact NH1-OE2 3.43Å; R64-E67 PolarHBondContact NH1-OE2 3.4Å; R64-V68 VanDerWaalsContact CZ-CG2 3.4Å; R64-V68 WeakPolarHBondContact O-CG2 3.13Å; R64-V68 PolarHBondContact O-N 2.79Å
65R85.4Confident77.9Confident117 Ų11783.9 Ų83.944%0.44241%0.414SS..Hα-helixtrans-66.4-35.6177-77.5-170.9-67.9171.8-4111.8F61 I62 D63 R69F61-R65 HydrophobicContact CE1-CG 4.42Å; F61-R65 HydrophobicContact CZ-CG 4.34Å; F61-R65 WeakPolarHBondContact O-CG 3.45Å; F61-R65 PolarHBondContact O-N 3.3Å; F61-R65 VanDerWaalsContact O-N 3.07Å; I62-R65 PolarHBondContact O-N 2.85Å; I62-R65 VanDerWaalsContact O-N 3.09Å; D63-R65 VanDerWaalsContact C-N 3.31Å; D63-R65 PolarHBondContact O-N 3.14Å; R65-R69 WeakPolarHBondContact O-CG 3.47Å; R65-R69 PolarHBondContact O-N 3.18Å
66S81.6Confident75.1Confident56 Ų5687.6 Ų87.639%0.39244%0.437SS..Hα-helixtrans-67.7-45.2175.871.10000111.8I62 D63 R64 V68 R69 D70I62-S66 PolarHBondContact O-N 3.45Å; D63-S66 PolarHBondContact O-N 2.95Å; D63-S66 PolarHBondContact O-OG 3.2Å; R64-S66 VanDerWaalsContact C-N 3.31Å; S66-V68 VanDerWaalsContact C-N 3.28Å; S66-V68 PolarHBondContact O-N 2.98Å; S66-R69 PolarHBondContact O-N 2.87Å; S66-D70 PolarHBondContact O-N 2.83Å
67E77.9Confident72.4Confident102 Ų10292.5 Ų92.548%0.47746%0.46SS..Hα-helixtrans-57.9-37.6176.5-70169.4-179.800112.9D63 R64D63-E67 WeakPolarHBondContact O-CG 3.31Å; D63-E67 PolarHBondContact O-N 2.59Å; R64-E67 IonicContact NH1-OE2 3.43Å; R64-E67 PolarHBondContact NH1-OE2 3.4Å
68V77.7Confident69.7Low87 Ų8795.8 Ų95.853%0.52748%0.482SS..Hα-helixtrans-74.1-29.3178.9172.70000112R64 S66R64-V68 VanDerWaalsContact CZ-CG2 3.4Å; R64-V68 WeakPolarHBondContact O-CG2 3.13Å; R64-V68 PolarHBondContact O-N 2.79Å; S66-V68 VanDerWaalsContact C-N 3.28Å; S66-V68 PolarHBondContact O-N 2.98Å
69R72.9Confident67.2Low197 Ų19796.5 Ų96.574%0.74350%0.5SS*.Hα-helixtrans-84.1-22.7-179.8-74.7178.9179.1-171.8-1.4113.2R65 S66 V71R65-R69 WeakPolarHBondContact O-CG 3.47Å; R65-R69 PolarHBondContact O-N 3.18Å; S66-R69 PolarHBondContact O-N 2.87Å; R69-V71 VanDerWaalsContact C-N 3.32Å; R69-V71 WeakPolarHBondContact O-CG2 3.07Å; R69-V71 PolarHBondContact O-N 3.41Å
70D67.7Low64.8Low121 Ų12198 Ų9865%0.64751%0.511SS*.  trans-74.486.8177.4-161-0000110.1S66S66-D70 PolarHBondContact O-N 2.83Å
71V56.4Low62.6Low139 Ų13999.3 Ų99.384%0.84252%0.519SS*.  trans-106.265.3174.2-93.10000109.2R69R69-V71 VanDerWaalsContact C-N 3.32Å; R69-V71 WeakPolarHBondContact O-CG2 3.07Å; R69-V71 PolarHBondContact O-N 3.41Å
72G54.1Low60.5Low23 Ų2395.8 Ų95.824%0.23751%0.506CS..SBendtrans-105.6165.7173.100000113.6H74G72-H74 PolarHBondContact O-N 3.04Å; G72-H74 VanDerWaalsContact O-N 3.12Å
73P50.1Low58.4Low128 Ų128101.8 Ų101.883%0.83153%0.526SS*.SBendtrans-64.2-7.5170.526.6-32.6000113.3R75P73-R75 PolarHBondContact O-N 3.15Å
74H48.2Very low56.8Low133 Ų133106 Ų10662%0.61654%0.542SS*.  trans-70.452166-57.6-71.1000111.9G72 V76G72-H74 PolarHBondContact O-N 3.04Å; G72-H74 VanDerWaalsContact O-N 3.12Å; H74-V76 PolarHBondContact O-N 2.94Å; H74-V76 VanDerWaalsContact O-N 3.16Å
75R46.9Very low55.3Low229 Ų229103.3 Ų103.386%0.86454%0.536SS*.THydrogen-bonded Turntrans-69.4-3.8173.2-69.6-166-172.9-162.24113.3P73P73-R75 PolarHBondContact O-N 3.15Å
76V37Very low54.4Low120 Ų120104 Ų10473%0.72756%0.555SS**THydrogen-bonded Turntrans-132.951.4-173-157.30000110.8H74H74-V76 PolarHBondContact O-N 2.94Å; H74-V76 VanDerWaalsContact O-N 3.16Å
77H40.3Very low54.5Low106 Ų106104.1 Ų104.149%0.49155%0.554SS.*SBendtrans-86.7110.5136.3-65.7-60.3000104.3A79 P80H77-A79 PolarHBondContact O-N 3.17Å; H77-P80 HydrophobicContact CB-CG 4.24Å
78P39.6Very low55Low108 Ų108108.5 Ų108.570%0.70157%0.571SS**  trans-65.683-179.626.8-33.6000108.2P80P78-P80 WeakPolarHBondContact O-CA 3.42Å; P78-P80 WeakPolarHBondContact O-CD 3.22Å
79A40Very low55.6Low95 Ų95106.2 Ų106.279%0.78556%0.556SS**  trans7.165.1-170.400000112.9H77H77-A79 PolarHBondContact O-N 3.17Å
80P41.4Very low56.4Low44 Ų4497.2 Ų97.229%0.28652%0.522SS..  trans-66.3136.5-179.4-8.124000103.6H77 P78 T82H77-P80 HydrophobicContact CB-CG 4.24Å; P78-P80 WeakPolarHBondContact O-CA 3.42Å; P78-P80 WeakPolarHBondContact O-CD 3.22Å; P80-T82 PolarHBondContact O-N 3.27Å
81P45.3Very low57.5Low32 Ų3297.1 Ų97.121%0.20852%0.518CS..THydrogen-bonded Turntrans-53.9104.4-163.326.1-37.1000109.3W229 Q232P81-W229 HydrophobicContact CB-CE3 3.86Å; P81-W229 HydrophobicContact CB-CH2 3.58Å; P81-W229 HydrophobicContact CB-CZ3 3.15Å; P81-W229 HydrophobicContact CG-CE3 3.47Å; P81-W229 VanDerWaalsContact CG-CE3 3.47Å; P81-W229 HydrophobicContact CG-CH2 4.15Å; P81-W229 HydrophobicContact CG-CZ3 3.21Å; P81-Q232 HydrophobicContact CG-CB 4.19Å; P81-Q232 HydrophobicContact CG-CG 3.7Å
82T48Very low59.3Low23 Ų2395.8 Ų95.814%0.14150%0.501CS..THydrogen-bonded Turntrans50.18117511.90000112.5R3 P80 Y84R3-T82 PolarHBondContact NH1-OG1 2.99Å; P80-T82 PolarHBondContact O-N 3.27Å; T82-Y84 PolarHBondContact O-N 3.46Å
83Y45.9Very low61.3Low183 Ų18394.7 Ų94.772%0.71849%0.49SS*.  trans-39.6110154.5-168.2-90.8000108.1P85Y83-P85 WeakPolarHBondContact O-CD 3.38Å; Y83-P85 WeakPolarHBondContact O-CG 3.2Å
84Y50.9Low63.4Low95 Ų9588.9 Ų88.937%0.37345%0.451SS..  trans-42.8101.6-179.6-66.5-91.6000109.9T82 P86 R158 A236T82-Y84 PolarHBondContact O-N 3.46Å; Y84-P86 WeakPolarHBondContact O-CD 3.49Å; Y84-R158 HydrophobicContact CE1-CB 4.38Å; Y84-A236 HydrophobicContact CE2-CB 3.99Å
85P54.5Low65.7Low32 Ų3284.7 Ų84.721%0.20844%0.436CS..  trans-76.8111.2164.3-5.326.8000102.6Y83 T87 H90Y83-P85 WeakPolarHBondContact O-CD 3.38Å; Y83-P85 WeakPolarHBondContact O-CG 3.2Å; P85-T87 HydrophobicContact CB-CG2 4.25Å; P85-T87 PolarHBondContact O-N 3.45Å; P85-H90 WeakPolarHBondContact O-CB 3.29Å; P85-H90 VanDerWaalsContact O-CG 3.26Å; P85-H90 PolarHBondContact O-ND1 2.96Å
86P66.8Low68.1Low130 Ų13075.9 Ų75.984%0.84441%0.406SS*.  trans-76.747.1-173.735.1-36.5000110.4Y84Y84-P86 WeakPolarHBondContact O-CD 3.49Å
87T83.9Confident71Confident59 Ų5970.2 Ų70.236%0.36237%0.372SS..  trans-75.2150.8174.677.90000108.9P85 L89 H90 H91P85-T87 HydrophobicContact CB-CG2 4.25Å; P85-T87 PolarHBondContact O-N 3.45Å; T87-L89 PolarHBondContact O-N 2.83Å; T87-L89 VanDerWaalsContact O-N 3.13Å; T87-H90 PolarHBondContact O-N 3.26Å; T87-H90 VanDerWaalsContact O-N 3.09Å; T87-H90 PolarHBondContact OG1-N 2.94Å; T87-H90 PolarHBondContact OG1-ND1 3.11Å; T87-H91 PolarHBondContact O-N 3.1Å
88K88.2Confident73.7Confident195 Ų19565.2 Ų65.285%0.84835%0.348SS*.Hα-helixtrans-56.2-29.9175.6-63.8-178179.7179.90112.1F92K88-F92 WeakPolarHBondContact O-CB 3.39Å; K88-F92 PolarHBondContact O-N 3.49Å
89L89.9Confident76.5Confident38 Ų3860.6 Ų60.620%0.19932%0.318CS..Hα-helixtrans-64.5-47.2175.8178.563.2000112L55 L58 R59 I62 T87 H91 F92 C93L55-L89 HydrophobicContact CD2-CD1 4.12Å; L58-L89 HydrophobicContact CD2-CD2 4.34Å; L58-L89 HydrophobicContact CG-CD2 4.34Å; R59-L89 HydrophobicContact CB-CD2 4.47Å; I62-L89 HydrophobicContact CD1-CD2 3.76Å; T87-L89 PolarHBondContact O-N 2.83Å; T87-L89 VanDerWaalsContact O-N 3.13Å; L89-H91 PolarHBondContact O-N 2.85Å; L89-F92 PolarHBondContact O-N 2.9Å; L89-C93 PolarHBondContact O-N 3.39Å; L89-C93 PolarHBondContact O-SG 3.26Å; L89-C93 VanDerWaalsContact O-SG 3.33Å
90H89.8Confident79.3Confident9 Ų957.5 Ų57.54%0.04229%0.287CS..Hα-helixtrans-58.9-48.7178.1-77.882.8000111.5R59 D63 P85 T87 F92 C93 D94R59-H90 PolarHBondContact NE-CD2 2.98Å; R59-H90 PolarHBondContact NE-NE2 3.47Å; R59-H90 VanDerWaalsContact NE-NE2 3.17Å; R59-H90 PolarHBondContact NH2-CD2 3.1Å; D63-H90 IonicContact OD1-CE1 3.16Å; D63-H90 PolarHBondContact OD1-CE1 2.98Å; D63-H90 IonicContact OD1-NE2 3.43Å; D63-H90 PolarHBondContact OD1-NE2 3.37Å; D63-H90 VanDerWaalsContact OD1-NE2 3.16Å; D63-H90 IonicContact OD2-NE2 3.76Å; D63-H90 PolarHBondContact OD2-NE2 3.09Å; P85-H90 WeakPolarHBondContact O-CB 3.29Å; P85-H90 VanDerWaalsContact O-CG 3.26Å; P85-H90 PolarHBondContact O-ND1 2.96Å; T87-H90 PolarHBondContact O-N 3.26Å; T87-H90 VanDerWaalsContact O-N 3.09Å; T87-H90 PolarHBondContact OG1-N 2.94Å; T87-H90 PolarHBondContact OG1-ND1 3.11Å; H90-F92 VanDerWaalsContact C-N 3.31Å; H90-F92 PolarHBondContact O-N 3.39Å; H90-C93 PolarHBondContact O-N 2.88Å; H90-D94 WeakPolarHBondContact O-CB 3.44Å; H90-D94 PolarHBondContact O-N 3.42Å
91H90.6Very high82Confident119 Ų11955.4 Ų55.455%0.55127%0.274SS*.Hα-helixtrans-61.8-40.3178.6-174.260.3000112.4T87 L89 C95T87-H91 PolarHBondContact O-N 3.1Å; L89-H91 PolarHBondContact O-N 2.85Å; H91-C95 VanDerWaalsContact O-CB 3.29Å; H91-C95 WeakPolarHBondContact O-CB 3.38Å; H91-C95 PolarHBondContact O-N 2.84Å
92F94.4Very high84.6Confident111 Ų11154.3 Ų54.349%0.48727%0.266SS..Hα-helixtrans-63.7-48.5175.7178.5-102.5000111.9L55 K88 L89 H90 D94 C95 I96L55-F92 HydrophobicContact CD1-CD1 4.22Å; L55-F92 HydrophobicContact CD1-CE1 3.77Å; K88-F92 WeakPolarHBondContact O-CB 3.39Å; K88-F92 PolarHBondContact O-N 3.49Å; L89-F92 PolarHBondContact O-N 2.9Å; H90-F92 VanDerWaalsContact C-N 3.31Å; H90-F92 PolarHBondContact O-N 3.39Å; F92-D94 VanDerWaalsContact C-N 3.34Å; F92-D94 PolarHBondContact O-N 2.85Å; F92-C95 PolarHBondContact O-N 3.08Å; F92-I96 HydrophobicContact CZ-CD1 4.28Å; F92-I96 WeakPolarHBondContact O-CG2 3.32Å; F92-I96 PolarHBondContact O-N 3.24Å
93C94.9Very high87Confident0 Ų053.2 Ų53.20%026%0.259CS..Hα-helixtrans-59.9-43.3177.8-69.80000111.8Y52 L89 H90 C95 I96 Y97Y52-C93 HydrophobicContact CE2-CB 4.16Å; Y52-C93 WeakPolarHBondContact CE2-O 3.41Å; L89-C93 PolarHBondContact O-N 3.39Å; L89-C93 PolarHBondContact O-SG 3.26Å; L89-C93 VanDerWaalsContact O-SG 3.33Å; H90-C93 PolarHBondContact O-N 2.88Å; C93-C95 VanDerWaalsContact C-N 3.35Å; C93-I96 WeakPolarHBondContact O-CG2 3.47Å; C93-Y97 WeakPolarHBondContact O-CB 3.47Å; C93-Y97 PolarHBondContact O-N 2.98Å
94D94.9Very high89.5Confident6 Ų644.6 Ų44.63%0.03223%0.225CC..Hα-helixtrans-67.4-37.1178.6-70.6-7.9000111.9R59 H90 F92 A98 H157 R158R59-D94 IonicContact NH1-OD1 3.11Å; R59-D94 PolarHBondContact NH1-OD1 3.41Å; H90-D94 WeakPolarHBondContact O-CB 3.44Å; H90-D94 PolarHBondContact O-N 3.42Å; F92-D94 VanDerWaalsContact C-N 3.34Å; F92-D94 PolarHBondContact O-N 2.85Å; D94-A98 VanDerWaalsContact O-CB 3.3Å; D94-A98 WeakPolarHBondContact O-CB 3.39Å; D94-A98 PolarHBondContact O-N 3.48Å; D94-H157 IonicContact OD1-CE1 3.92Å; D94-H157 IonicContact OD1-CG 3.82Å; D94-H157 IonicContact OD1-ND1 2.93Å; D94-H157 PolarHBondContact OD1-ND1 3.18Å; D94-R158 HydrophobicContact CB-CB 4.42Å; D94-R158 PolarHBondContact OD2-N 3.06Å
95C95.8Very high91.8Very high44 Ų4440 Ų4030%0.29721%0.207SC..Hα-helixtrans-66.1-51.4177-172.10000112H91 F92 C93 Y97 A98 T99H91-C95 VanDerWaalsContact O-CB 3.29Å; H91-C95 WeakPolarHBondContact O-CB 3.38Å; H91-C95 PolarHBondContact O-N 2.84Å; F92-C95 PolarHBondContact O-N 3.08Å; C93-C95 VanDerWaalsContact C-N 3.35Å; C95-Y97 VanDerWaalsContact C-N 3.3Å; C95-Y97 PolarHBondContact O-N 2.88Å; C95-A98 PolarHBondContact O-N 2.98Å; C95-T99 WeakPolarHBondContact O-CB 3.49Å; C95-T99 WeakPolarHBondContact O-CG2 3.27Å; C95-T99 PolarHBondContact O-N 3.38Å; C95-T99 PolarHBondContact O-OG1 3.27Å
96I97.5Very high93.8Very high45 Ų4540.8 Ų40.823%0.23121%0.209CC..Hα-helixtrans-67.4-34.3179.7-162.9172.8000111.4Y52 F92 C93 F100 I101Y52-I96 HydrophobicContact CD2-CG2 3.57Å; Y52-I96 HydrophobicContact CE2-CG2 3.74Å; F92-I96 HydrophobicContact CZ-CD1 4.28Å; F92-I96 WeakPolarHBondContact O-CG2 3.32Å; F92-I96 PolarHBondContact O-N 3.24Å; C93-I96 WeakPolarHBondContact O-CG2 3.47Å; I96-F100 HydrophobicContact CG1-CB 4.26Å; I96-F100 HydrophobicContact CG1-CD1 4.17Å; I96-F100 WeakPolarHBondContact O-CB 3.44Å; I96-F100 PolarHBondContact O-N 2.82Å; I96-I101 HydrophobicContact CG1-CG1 4.26Å; I96-I101 PolarHBondContact O-N 3.2Å
97Y97.9Very high95.4Very high1 Ų135.1 Ų35.10%0.00417%0.171CC..Iπ-helixtrans-56.9-58.4173175.8-96.6000111.3Y52 C93 C95 T99 I101 F102 V148 D151 S152 H157 Y159Y52-Y97 HydrophobicContact CE1-CD2 4.04Å; Y52-Y97 AromaticContact CZ-CD2 3.82Å; Y52-Y97 WeakPolarHBondContact OH-CB 3.39Å; Y52-Y97 WeakPolarHBondContact OH-CD2 3.3Å; C93-Y97 WeakPolarHBondContact O-CB 3.47Å; C93-Y97 PolarHBondContact O-N 2.98Å; C95-Y97 VanDerWaalsContact C-N 3.3Å; C95-Y97 PolarHBondContact O-N 2.88Å; Y97-T99 PolarHBondContact O-N 3.17Å; Y97-I101 PolarHBondContact O-N 3.31Å; Y97-F102 HydrophobicContact CE1-CB 4.25Å; Y97-F102 HydrophobicContact CE1-CD2 4.42Å; Y97-F102 HydrophobicContact CE2-CB 4.3Å; Y97-F102 HydrophobicContact CE2-CD2 4.46Å; Y97-F102 AromaticContact CZ-CD2 3.82Å; Y97-F102 WeakPolarHBondContact O-CB 3.44Å; Y97-F102 PolarHBondContact O-N 3.02Å; Y97-F102 WeakPolarHBondContact OH-CD2 3.46Å; Y97-V148 HydrophobicContact CE2-CB 4.34Å; Y97-V148 PolarHBondContact OH-O 3.42Å; Y97-D151 VanDerWaalsContact CD2-OD2 3.22Å; Y97-D151 WeakPolarHBondContact CD2-OD2 3.42Å; Y97-D151 HydrophobicContact CE2-CB 4.24Å; Y97-D151 WeakPolarHBondContact CE2-OD2 3.07Å; Y97-S152 PolarHBondContact OH-OG 3.19Å; Y97-H157 HydrophobicContact CD1-CB 3.86Å; Y97-H157 AromaticContact CD1-CD2 3.51Å; Y97-H157 AromaticContact CD1-CE1 3.95Å; Y97-H157 AromaticContact CD1-CG 3.41Å; Y97-H157 VanDerWaalsContact CD1-CG 3.41Å; Y97-H157 AromaticContact CD1-ND1 3.74Å; Y97-H157 AromaticContact CD1-NE2 3.86Å; Y97-H157 AromaticContact CD2-CE1 3.89Å; Y97-H157 AromaticContact CD2-NE2 3.83Å; Y97-H157 HydrophobicContact CE1-CB 4.12Å; Y97-H157 AromaticContact CE1-CD2 3.28Å; Y97-H157 WeakPolarHBondContact CE1-CD2 3.29Å; Y97-H157 AromaticContact CE1-CG 3.66Å; Y97-H157 AromaticContact CE1-NE2 3.78Å; Y97-H157 AromaticContact CE2-NE2 3.76Å; Y97-H157 AromaticContact CG-CE1 3.71Å; Y97-H157 AromaticContact CG-CG 3.96Å; Y97-H157 AromaticContact CG-ND1 3.8Å; Y97-H157 AromaticContact CG-NE2 3.88Å; Y97-H157 AromaticContact CZ-CD2 3.62Å; Y97-H157 AromaticContact CZ-NE2 3.72Å; Y97-Y159 HydrophobicContact CD1-CE2 4.41Å; Y97-Y159 HydrophobicContact CE1-CE2 4.17Å; Y97-Y159 WeakPolarHBondContact CE1-OH 3.37Å
98A98Very high96Very high0 Ų032.7 Ų32.70%016%0.156CC..Iπ-helixtrans-65.5-39.5-174.500000112.4D94 C95 P103 Y159 Y218D94-A98 VanDerWaalsContact O-CB 3.3Å; D94-A98 WeakPolarHBondContact O-CB 3.39Å; D94-A98 PolarHBondContact O-N 3.48Å; C95-A98 PolarHBondContact O-N 2.98Å; A98-P103 VanDerWaalsContact O-CD 3.25Å; A98-P103 WeakPolarHBondContact O-CD 3.35Å; A98-P103 WeakPolarHBondContact O-CG 3.23Å; A98-Y159 HydrophobicContact CB-CD1 3.58Å; A98-Y159 HydrophobicContact CB-CD2 4.28Å; A98-Y159 HydrophobicContact CB-CE1 3.58Å; A98-Y159 HydrophobicContact CB-CE2 4.28Å; A98-Y159 HydrophobicContact CB-CG 3.92Å; A98-Y218 HydrophobicContact CB-CE2 4.35Å; A98-Y218 VanDerWaalsContact O-CD2 3.23Å; A98-Y218 WeakPolarHBondContact O-CD2 3.49Å
99T98.4Very high96.5Very high12 Ų1224.5 Ų24.57%0.07412%0.123CC..Iπ-helixtrans-96.3-13-17059.80000114.7C95 Y97 P160 T168 V169 Y218C95-T99 WeakPolarHBondContact O-CB 3.49Å; C95-T99 WeakPolarHBondContact O-CG2 3.27Å; C95-T99 PolarHBondContact O-N 3.38Å; C95-T99 PolarHBondContact O-OG1 3.27Å; Y97-T99 PolarHBondContact O-N 3.17Å; T99-P160 HydrophobicContact CG2-CG 4.07Å; T99-T168 HydrophobicContact CG2-CG2 4.05Å; T99-V169 WeakPolarHBondContact O-CG2 3.32Å; T99-Y218 HydrophobicContact CG2-CE2 4.39Å
100F98.5Very high96.9Very high30 Ų3024.4 Ų24.413%0.13213%0.131CC..Iπ-helixtrans-139.6-63.2-175.3176.6-108.9000112I44 I96 F102 V104 F172I44-F100 HydrophobicContact CG2-CE2 4.11Å; I44-F100 HydrophobicContact CG2-CZ 3.93Å; I96-F100 HydrophobicContact CG1-CB 4.26Å; I96-F100 HydrophobicContact CG1-CD1 4.17Å; I96-F100 WeakPolarHBondContact O-CB 3.44Å; I96-F100 PolarHBondContact O-N 2.82Å; F100-F102 PolarHBondContact O-N 3.49Å; F100-V104 HydrophobicContact CD2-CB 4.29Å; F100-V104 HydrophobicContact CD2-CG2 3.74Å; F100-V104 HydrophobicContact CE2-CB 4.4Å; F100-V104 HydrophobicContact CE2-CG1 4.37Å; F100-V104 HydrophobicContact CE2-CG2 4.16Å; F100-V104 WeakPolarHBondContact O-CB 3.42Å; F100-V104 WeakPolarHBondContact O-CG2 3.42Å; F100-V104 PolarHBondContact O-N 3.06Å; F100-F172 HydrophobicContact CD2-CD1 4.48Å; F100-F172 HydrophobicContact CD2-CD2 4.2Å; F100-F172 HydrophobicContact CD2-CE1 4.24Å; F100-F172 AromaticContact CD2-CE2 3.94Å; F100-F172 HydrophobicContact CD2-CE2 3.94Å; F100-F172 HydrophobicContact CD2-CG 4.47Å; F100-F172 AromaticContact CD2-CZ 3.98Å; F100-F172 HydrophobicContact CD2-CZ 3.98Å; F100-F172 HydrophobicContact CE2-CD2 4.28Å; F100-F172 HydrophobicContact CE2-CE1 4.11Å; F100-F172 AromaticContact CE2-CE2 3.56Å; F100-F172 HydrophobicContact CE2-CE2 3.56Å; F100-F172 AromaticContact CE2-CZ 3.48Å; F100-F172 HydrophobicContact CE2-CZ 3.48Å; F100-F172 VanDerWaalsContact CE2-CZ 3.48Å
101I98.6Very high97.3Very high0 Ų025.6 Ų25.60%014%0.137CC..Iπ-helixtrans-59.3-47.4-170.3-57.3-64.2000112.2G48 Q49 Y52 I96 Y97 G105 F147 V148G48-I101 WeakPolarHBondContact O-CD1 3.3Å; Q49-I101 PolarHBondContact NE2-O 3.17Å; Q49-I101 VanDerWaalsContact NE2-O 3.09Å; Y52-I101 HydrophobicContact CD1-CB 4.5Å; Y52-I101 HydrophobicContact CD1-CG1 4.13Å; Y52-I101 HydrophobicContact CD1-CG2 3.81Å; Y52-I101 HydrophobicContact CD2-CD1 4.43Å; Y52-I101 HydrophobicContact CD2-CG1 3.88Å; Y52-I101 HydrophobicContact CE1-CG2 4.17Å; Y52-I101 HydrophobicContact CE2-CG1 4.45Å; Y52-I101 HydrophobicContact CG-CD1 3.94Å; Y52-I101 HydrophobicContact CG-CG1 3.69Å; Y52-I101 HydrophobicContact CG-CG2 4.23Å; I96-I101 HydrophobicContact CG1-CG1 4.26Å; I96-I101 PolarHBondContact O-N 3.2Å; Y97-I101 PolarHBondContact O-N 3.31Å; I101-G105 WeakPolarHBondContact O-CA 3.24Å; I101-G105 PolarHBondContact O-N 3.32Å; I101-G105 VanDerWaalsContact O-N 3.17Å; I101-F147 HydrophobicContact CG2-CE1 4.34Å; I101-V148 HydrophobicContact CG2-CG1 3.77Å
102F98.6Very high97.7Very high9 Ų920.5 Ų20.54%0.03911%0.114CC..Hα-helixtrans-70.9-62178.1-173.8-80.8000112.5Y97 F100 V104 G105 M106 V148 L217 Y224Y97-F102 HydrophobicContact CE1-CB 4.25Å; Y97-F102 HydrophobicContact CE1-CD2 4.42Å; Y97-F102 HydrophobicContact CE2-CB 4.3Å; Y97-F102 HydrophobicContact CE2-CD2 4.46Å; Y97-F102 AromaticContact CZ-CD2 3.82Å; Y97-F102 WeakPolarHBondContact O-CB 3.44Å; Y97-F102 PolarHBondContact O-N 3.02Å; Y97-F102 WeakPolarHBondContact OH-CD2 3.46Å; F100-F102 PolarHBondContact O-N 3.49Å; F102-V104 PolarHBondContact O-N 2.99Å; F102-G105 PolarHBondContact O-N 3.41Å; F102-M106 HydrophobicContact CD1-CG 4.37Å; F102-M106 HydrophobicContact CE1-CG 4.11Å; F102-M106 HydrophobicContact CZ-CG 4.22Å; F102-M106 WeakPolarHBondContact O-CB 3.3Å; F102-M106 WeakPolarHBondContact O-CG 3.46Å; F102-M106 PolarHBondContact O-N 3.04Å; F102-V148 HydrophobicContact CD2-CB 3.86Å; F102-V148 HydrophobicContact CD2-CG2 3.72Å; F102-V148 HydrophobicContact CE2-CG2 4.03Å; F102-V148 HydrophobicContact CG-CG2 4.49Å; F102-L217 WeakPolarHBondContact CE1-O 3.32Å; F102-Y224 HydrophobicContact CE2-CD1 4.46Å
103P98.5Very high97.9Very high0 Ų018.7 Ų18.70%010%0.104CC..Hα-helixtrans-66.3-39.8-17226-35.8000112.7A98 L107 V169 V214 L217A98-P103 VanDerWaalsContact O-CD 3.25Å; A98-P103 WeakPolarHBondContact O-CD 3.35Å; A98-P103 WeakPolarHBondContact O-CG 3.23Å; P103-L107 VanDerWaalsContact O-CB 3.24Å; P103-L107 WeakPolarHBondContact O-CB 3.45Å; P103-L107 PolarHBondContact O-N 3.29Å; P103-V169 HydrophobicContact CG-CG2 4.31Å; P103-V214 HydrophobicContact CB-CG2 3.98Å; P103-L217 HydrophobicContact CB-CB 4.14Å; P103-L217 WeakPolarHBondContact O-CD1 3.38Å
104V98.6Very high98Very high1 Ų122.6 Ų22.61%0.00613%0.128CC..Hα-helixtrans-73.6-39.5178.8-176.40000110.8L41 N45 F100 F102 M106 L107 V108 F172 V214L41-V104 HydrophobicContact CD1-CG1 3.88Å; L41-V104 HydrophobicContact CD2-CG1 4.44Å; L41-V104 HydrophobicContact CG-CG1 4.19Å; N45-V104 HydrophobicContact CB-CG1 4.22Å; F100-V104 HydrophobicContact CD2-CB 4.29Å; F100-V104 HydrophobicContact CD2-CG2 3.74Å; F100-V104 HydrophobicContact CE2-CB 4.4Å; F100-V104 HydrophobicContact CE2-CG1 4.37Å; F100-V104 HydrophobicContact CE2-CG2 4.16Å; F100-V104 WeakPolarHBondContact O-CB 3.42Å; F100-V104 WeakPolarHBondContact O-CG2 3.42Å; F100-V104 PolarHBondContact O-N 3.06Å; F102-V104 PolarHBondContact O-N 2.99Å; V104-M106 PolarHBondContact O-N 3.38Å; V104-L107 PolarHBondContact O-N 3.35Å; V104-V108 HydrophobicContact CG1-CG2 4.33Å; V104-V108 WeakPolarHBondContact O-CG2 3.46Å; V104-V108 PolarHBondContact O-N 3.04Å; V104-F172 HydrophobicContact CG1-CE1 4.17Å; V104-F172 HydrophobicContact CG2-CD1 3.88Å; V104-F172 HydrophobicContact CG2-CE1 3.58Å; V104-F172 HydrophobicContact CG2-CZ 4.4Å; V104-V214 HydrophobicContact CG2-CG2 4.5Å
105G98.5Very high98.2Very high0 Ų023.3 Ų23.30%013%0.131CC..Hα-helixtrans-59.8-46.2176.200000112.4N45 I101 F102 V109N45-G105 WeakPolarHBondContact OD1-CA 3.33Å; I101-G105 WeakPolarHBondContact O-CA 3.24Å; I101-G105 PolarHBondContact O-N 3.32Å; I101-G105 VanDerWaalsContact O-N 3.17Å; F102-G105 PolarHBondContact O-N 3.41Å; G105-V109 VanDerWaalsContact O-CG2 3.23Å; G105-V109 WeakPolarHBondContact O-CG2 3.44Å; G105-V109 PolarHBondContact O-N 3.04Å
106M98.5Very high98.3Very high47 Ų4724 Ų2423%0.23213%0.129CC..Hα-helixtrans-68-36175.9-67.3-58.7-65.800112.4F102 V104 G110 A145 V148 L217F102-M106 HydrophobicContact CD1-CG 4.37Å; F102-M106 HydrophobicContact CE1-CG 4.11Å; F102-M106 HydrophobicContact CZ-CG 4.22Å; F102-M106 WeakPolarHBondContact O-CB 3.3Å; F102-M106 WeakPolarHBondContact O-CG 3.46Å; F102-M106 PolarHBondContact O-N 3.04Å; V104-M106 PolarHBondContact O-N 3.38Å; M106-G110 PolarHBondContact O-N 3.4Å; M106-A145 HydrophobicContact SD-CB 3.81Å; M106-V148 HydrophobicContact CG-CG2 4.2Å; M106-V148 HydrophobicContact SD-CG2 3.96Å; M106-L217 HydrophobicContact CB-CD1 4.04Å; M106-L217 HydrophobicContact CB-CD2 3.82Å; M106-L217 HydrophobicContact CB-CG 4.44Å
107L98.5Very high98.3Very high12 Ų1231.6 Ų31.66%0.06316%0.156CC..Hα-helixtrans-63.3-47.4176.3-176.574.9000111.2L41 P103 V104 V109 G110 L111 V213 V214 L217L41-L107 HydrophobicContact CD2-CD2 4.14Å; P103-L107 VanDerWaalsContact O-CB 3.24Å; P103-L107 WeakPolarHBondContact O-CB 3.45Å; P103-L107 PolarHBondContact O-N 3.29Å; V104-L107 PolarHBondContact O-N 3.35Å; L107-V109 VanDerWaalsContact C-N 3.35Å; L107-V109 PolarHBondContact O-N 2.92Å; L107-G110 PolarHBondContact O-N 2.79Å; L107-L111 HydrophobicContact CD1-CD1 3.64Å; L107-L111 HydrophobicContact CD1-CG 3.84Å; L107-L111 HydrophobicContact CD2-CD1 4.29Å; L107-L111 HydrophobicContact CG-CD1 3.73Å; L107-L111 HydrophobicContact CG-CG 4.14Å; L107-L111 VanDerWaalsContact O-CB 3.3Å; L107-L111 WeakPolarHBondContact O-CB 3.48Å; L107-L111 WeakPolarHBondContact O-CG 3.23Å; L107-L111 PolarHBondContact O-N 3.06Å; L107-V213 HydrophobicContact CD1-CB 4.07Å; L107-V213 HydrophobicContact CD1-CG1 3.57Å; L107-V214 HydrophobicContact CD1-CB 4.44Å; L107-V214 HydrophobicContact CD2-CB 4.05Å; L107-V214 HydrophobicContact CD2-CG2 4.1Å; L107-L217 HydrophobicContact CB-CD1 3.73Å; L107-L217 HydrophobicContact CD1-CD1 4.1Å
108V98.3Very high98.3Very high7 Ų737.1 Ų37.14%0.04219%0.185CC..Hα-helixtrans-59-47.7179167.70000110.3L41 T42 N45 V104 F112L41-V108 HydrophobicContact CD2-CG2 4.04Å; L41-V108 HydrophobicContact CG-CG2 3.88Å; T42-V108 HydrophobicContact CG2-CG1 4.25Å; N45-V108 HydrophobicContact CB-CG2 4.02Å; V104-V108 HydrophobicContact CG1-CG2 4.33Å; V104-V108 WeakPolarHBondContact O-CG2 3.46Å; V104-V108 PolarHBondContact O-N 3.04Å; V108-F112 WeakPolarHBondContact O-CB 3.36Å; V108-F112 PolarHBondContact O-N 3.49Å
109V98.5Very high98.3Very high24 Ų2440.7 Ų40.715%0.14520%0.204CC..Hα-helixtrans-62.4-50.7178.7176.60000110.7G105 L107 W113 H141 A145G105-V109 VanDerWaalsContact O-CG2 3.23Å; G105-V109 WeakPolarHBondContact O-CG2 3.44Å; G105-V109 PolarHBondContact O-N 3.04Å; L107-V109 VanDerWaalsContact C-N 3.35Å; L107-V109 PolarHBondContact O-N 2.92Å; V109-W113 VanDerWaalsContact O-CD1 3.29Å; V109-W113 PolarHBondContact O-N 3.02Å; V109-H141 WeakPolarHBondContact CA-O 3.35Å; V109-H141 WeakPolarHBondContact CG2-O 3.37Å; V109-A145 HydrophobicContact CB-CB 4.45Å; V109-A145 HydrophobicContact CG1-CB 4.17Å; V109-A145 HydrophobicContact CG2-CB 3.99Å
110G98.1Very high98.3Very high36 Ų3643.1 Ų43.137%0.37121%0.212SC..Hα-helixtrans-63.9-50.2-176.400000113M106 L107 T114M106-G110 PolarHBondContact O-N 3.4Å; L107-G110 PolarHBondContact O-N 2.79Å; G110-T114 WeakPolarHBondContact O-CB 3.24Å; G110-T114 PolarHBondContact O-N 3.19Å; G110-T114 VanDerWaalsContact O-N 3.11Å; G110-T114 PolarHBondContact O-OG1 2.88Å
111L97.8Very high98.2Very high33 Ų3345.3 Ų45.317%0.17322%0.222CC..Hα-helixtrans-67.5-45-179.8-71.5-175.7000112L107 T114 L115 F209L107-L111 HydrophobicContact CD1-CD1 3.64Å; L107-L111 HydrophobicContact CD1-CG 3.84Å; L107-L111 HydrophobicContact CD2-CD1 4.29Å; L107-L111 HydrophobicContact CG-CD1 3.73Å; L107-L111 HydrophobicContact CG-CG 4.14Å; L107-L111 VanDerWaalsContact O-CB 3.3Å; L107-L111 WeakPolarHBondContact O-CB 3.48Å; L107-L111 WeakPolarHBondContact O-CG 3.23Å; L107-L111 PolarHBondContact O-N 3.06Å; L111-T114 PolarHBondContact O-N 2.93Å; L111-L115 WeakPolarHBondContact O-CB 3.21Å; L111-L115 WeakPolarHBondContact O-CG 3.38Å; L111-L115 PolarHBondContact O-N 3.03Å; L111-F209 HydrophobicContact CD2-CE1 3.71Å; L111-F209 HydrophobicContact CD2-CZ 4.48Å
112F98.5Very high98.2Very high13 Ų1346.4 Ų46.46%0.05723%0.228CC..Hα-helixtrans-59.1-54.3-177.3179.6-92.8000110.8V108 L115 F116 V123 Y124 H141V108-F112 WeakPolarHBondContact O-CB 3.36Å; V108-F112 PolarHBondContact O-N 3.49Å; F112-L115 PolarHBondContact O-N 3.12Å; F112-F116 HydrophobicContact CE1-CD2 4.26Å; F112-F116 HydrophobicContact CZ-CD2 4.19Å; F112-F116 WeakPolarHBondContact O-CB 3.45Å; F112-F116 PolarHBondContact O-N 2.83Å; F112-V123 HydrophobicContact CD2-CB 4.36Å; F112-V123 HydrophobicContact CD2-CG2 4.23Å; F112-V123 HydrophobicContact CE2-CG2 4.36Å; F112-Y124 HydrophobicContact CE2-CD2 4.1Å; F112-Y124 HydrophobicContact CE2-CG 4.25Å; F112-Y124 HydrophobicContact CZ-CD2 4.04Å; F112-Y124 HydrophobicContact CZ-CG 4.04Å; F112-H141 HydrophobicContact CB-CB 4.38Å; F112-H141 HydrophobicContact CD1-CB 3.46Å; F112-H141 VanDerWaalsContact CD1-CB 3.46Å; F112-H141 AromaticContact CD1-CD2 3.84Å; F112-H141 AromaticContact CD1-CG 3.59Å; F112-H141 HydrophobicContact CD2-CB 4.45Å; F112-H141 AromaticContact CD2-CD2 3.2Å; F112-H141 WeakPolarHBondContact CD2-CD2 3.49Å; F112-H141 AromaticContact CD2-CE1 3.8Å; F112-H141 AromaticContact CD2-CG 3.7Å; F112-H141 AromaticContact CD2-NE2 3.29Å; F112-H141 VanDerWaalsContact CD2-NE2 3.29Å; F112-H141 WeakPolarHBondContact CD2-NE2 3.3Å; F112-H141 HydrophobicContact CE1-CB 3.74Å; F112-H141 AromaticContact CE1-CG 3.7Å; F112-H141 AromaticContact CE1-ND1 3.87Å; F112-H141 AromaticContact CE2-CD2 3.63Å; F112-H141 AromaticContact CE2-CE1 3.39Å; F112-H141 WeakPolarHBondContact CE2-CE1 3.39Å; F112-H141 AromaticContact CE2-CG 3.79Å; F112-H141 AromaticContact CE2-ND1 3.66Å; F112-H141 AromaticContact CE2-NE2 3.38Å; F112-H141 WeakPolarHBondContact CE2-NE2 3.23Å; F112-H141 HydrophobicContact CG-CB 3.85Å; F112-H141 AromaticContact CG-CD2 3.31Å; F112-H141 WeakPolarHBondContact CG-CD2 3.37Å; F112-H141 AromaticContact CG-CG 3.59Å; F112-H141 AromaticContact CG-NE2 3.93Å; F112-H141 HydrophobicContact CZ-CB 4.33Å; F112-H141 AromaticContact CZ-CE1 3.74Å; F112-H141 AromaticContact CZ-CG 3.79Å; F112-H141 AromaticContact CZ-ND1 3.57Å
113W98.3Very high98.1Very high73 Ų7347.1 Ų47.128%0.27723%0.233SC..Hα-helixtrans-73.6-29.6-175.8-69.6108.1000113.5V109 F116 Y117 H141 V142V109-W113 VanDerWaalsContact O-CD1 3.29Å; V109-W113 PolarHBondContact O-N 3.02Å; W113-F116 HydrophobicContact CE3-CB 4.3Å; W113-F116 AromaticContact CE3-CD1 3.97Å; W113-F116 HydrophobicContact CE3-CD1 3.97Å; W113-F116 HydrophobicContact CE3-CG 4.18Å; W113-F116 AromaticContact CZ3-CD1 3.89Å; W113-F116 HydrophobicContact CZ3-CD1 3.89Å; W113-F116 HydrophobicContact CZ3-CE1 4.09Å; W113-F116 HydrophobicContact CZ3-CG 4.25Å; W113-Y117 VanDerWaalsContact O-CB 3.23Å; W113-Y117 WeakPolarHBondContact O-CB 3.37Å; W113-Y117 PolarHBondContact O-N 2.72Å; W113-H141 HydrophobicContact CZ2-CB 4.45Å; W113-H141 PolarHBondContact NE1-O 3.01Å; W113-V142 HydrophobicContact CZ2-CG2 3.6Å; W113-V142 VanDerWaalsContact NE1-CG2 3.3Å
114T98.3Very high98Very high82 Ų8247.4 Ų47.450%0.50323%0.234SC..Hα-helixtrans-64.5-49.4172.9-59.20000110.7G110 L111 Y117 I118G110-T114 WeakPolarHBondContact O-CB 3.24Å; G110-T114 PolarHBondContact O-N 3.19Å; G110-T114 VanDerWaalsContact O-N 3.11Å; G110-T114 PolarHBondContact O-OG1 2.88Å; L111-T114 PolarHBondContact O-N 2.93Å; T114-Y117 PolarHBondContact O-N 3.05Å; T114-I118 HydrophobicContact CG2-CD1 4.07Å; T114-I118 WeakPolarHBondContact O-CG1 3.38Å; T114-I118 PolarHBondContact O-N 2.87Å; T114-I118 VanDerWaalsContact O-N 3.12Å
115L98.2Very high97.9Very high20 Ų2048.7 Ų48.711%0.10524%0.242CC..Hα-helixtrans-67.2-41.9178.6-69170.7000111L111 F112 Y117 I118 D119 L122 V123 I194 F206L111-L115 WeakPolarHBondContact O-CB 3.21Å; L111-L115 WeakPolarHBondContact O-CG 3.38Å; L111-L115 PolarHBondContact O-N 3.03Å; F112-L115 PolarHBondContact O-N 3.12Å; L115-Y117 VanDerWaalsContact C-N 3.28Å; L115-Y117 PolarHBondContact O-N 2.95Å; L115-I118 PolarHBondContact O-N 3.35Å; L115-D119 CarbonylContact O-C 3.27Å; L115-D119 VanDerWaalsContact O-C 3.27Å; L115-D119 PolarHBondContact O-N 3.36Å; L115-L122 HydrophobicContact CB-CB 4.44Å; L115-L122 HydrophobicContact CD2-CD1 4.19Å; L115-V123 HydrophobicContact CB-CB 4.4Å; L115-V123 HydrophobicContact CB-CG1 3.62Å; L115-V123 HydrophobicContact CB-CG2 3.85Å; L115-V123 HydrophobicContact CD1-CG1 3.39Å; L115-V123 HydrophobicContact CG-CG1 4.13Å; L115-I194 HydrophobicContact CD1-CG2 4.45Å; L115-I194 HydrophobicContact CD2-CD1 4.36Å; L115-I194 HydrophobicContact CD2-CG1 4.37Å; L115-F206 HydrophobicContact CD1-CE2 4.37Å; L115-F206 HydrophobicContact CD1-CZ 4.31Å
116F97.9Very high97.8Very high58 Ų5853.3 Ų53.325%0.25427%0.267SS..Hα-helixtrans-57.9-40176.2-173-83.8000112.5F112 W113 R120 V123 Y124F112-F116 HydrophobicContact CE1-CD2 4.26Å; F112-F116 HydrophobicContact CZ-CD2 4.19Å; F112-F116 WeakPolarHBondContact O-CB 3.45Å; F112-F116 PolarHBondContact O-N 2.83Å; W113-F116 HydrophobicContact CE3-CB 4.3Å; W113-F116 AromaticContact CE3-CD1 3.97Å; W113-F116 HydrophobicContact CE3-CD1 3.97Å; W113-F116 HydrophobicContact CE3-CG 4.18Å; W113-F116 AromaticContact CZ3-CD1 3.89Å; W113-F116 HydrophobicContact CZ3-CD1 3.89Å; W113-F116 HydrophobicContact CZ3-CE1 4.09Å; W113-F116 HydrophobicContact CZ3-CG 4.25Å; F116-R120 HydrophobicContact CD2-CB 3.87Å; F116-R120 HydrophobicContact CE2-CB 3.81Å; F116-R120 HydrophobicContact CG-CB 4.34Å; F116-R120 HydrophobicContact CZ-CB 4.24Å; F116-R120 PolarHBondContact O-N 3.36Å; F116-V123 HydrophobicContact CB-CG2 4.23Å; F116-Y124 AromaticContact CE2-CD1 3.91Å; F116-Y124 HydrophobicContact CE2-CD1 3.91Å; F116-Y124 HydrophobicContact CE2-CG 4.41Å
117Y98.1Very high97.6Very high206 Ų20657.1 Ų57.181%0.80828%0.28SS*.Hα-helixtrans-69.9-38.5177.4177.6-99.9000112.9W113 T114 L115W113-Y117 VanDerWaalsContact O-CB 3.23Å; W113-Y117 WeakPolarHBondContact O-CB 3.37Å; W113-Y117 PolarHBondContact O-N 2.72Å; T114-Y117 PolarHBondContact O-N 3.05Å; L115-Y117 VanDerWaalsContact C-N 3.28Å; L115-Y117 PolarHBondContact O-N 2.95Å
118I97.9Very high97.4Very high116 Ų11657.3 Ų57.360%0.59528%0.281SS*.Hα-helixtrans-67.8-55.1177.2-68.2166000110.2T114 L115 L122T114-I118 HydrophobicContact CG2-CD1 4.07Å; T114-I118 WeakPolarHBondContact O-CG1 3.38Å; T114-I118 PolarHBondContact O-N 2.87Å; T114-I118 VanDerWaalsContact O-N 3.12Å; L115-I118 PolarHBondContact O-N 3.35Å; I118-L122 HydrophobicContact CG2-CD1 4.22Å
119D98Very high97.3Very high75 Ų7561.3 Ų61.340%0.40130%0.302SS..  trans-162115.4174.6177.11.1000108.9L115 E121 L122L115-D119 CarbonylContact O-C 3.27Å; L115-D119 VanDerWaalsContact O-C 3.27Å; L115-D119 PolarHBondContact O-N 3.36Å; D119-E121 PolarHBondContact O-N 3.47Å; D119-E121 VanDerWaalsContact O-N 3.15Å; D119-E121 WeakPolarHBondContact OD1-CB 3.45Å; D119-E121 PolarHBondContact OD1-N 3.04Å; D119-L122 HydrophobicContact CB-CD1 3.85Å; D119-L122 HydrophobicContact CB-CG 3.9Å; D119-L122 VanDerWaalsContact O-CB 3.26Å; D119-L122 WeakPolarHBondContact O-CB 3.19Å; D119-L122 VanDerWaalsContact O-CG 3.31Å; D119-L122 WeakPolarHBondContact O-CG 3.3Å; D119-L122 PolarHBondContact O-N 3.15Å; D119-L122 VanDerWaalsContact O-N 3.07Å
120R97.5Very high97.2Very high64 Ų6464.5 Ų64.524%0.24233%0.331CS..G310 helixtrans-56.1-32.5-178.570174.9-63.2174.36.3113.2F116 L122 V123 Y124 D129F116-R120 HydrophobicContact CD2-CB 3.87Å; F116-R120 HydrophobicContact CE2-CB 3.81Å; F116-R120 HydrophobicContact CG-CB 4.34Å; F116-R120 HydrophobicContact CZ-CB 4.24Å; F116-R120 PolarHBondContact O-N 3.36Å; R120-L122 PolarHBondContact O-N 3.41Å; R120-V123 PolarHBondContact O-N 3.1Å; R120-V123 VanDerWaalsContact O-N 3.13Å; R120-Y124 CarbonylContact C-O 3.6Å; R120-Y124 PolarHBondContact NE-O 2.89Å; R120-Y124 CarbonylContact O-C 3.28Å; R120-Y124 WeakPolarHBondContact O-CA 3.25Å; R120-Y124 PolarHBondContact O-N 2.85Å; R120-Y124 VanDerWaalsContact O-O 3.08Å; R120-D129 IonicContact CZ-OD2 3.26Å; R120-D129 VanDerWaalsContact CZ-OD2 3.26Å; R120-D129 IonicContact NH1-OD2 2.81Å; R120-D129 PolarHBondContact NH1-OD2 3.43Å; R120-D129 IonicContact NH2-OD1 3.07Å; R120-D129 PolarHBondContact NH2-OD1 3.23Å; R120-D129 IonicContact NH2-OD2 2.8Å; R120-D129 PolarHBondContact NH2-OD2 3.37Å
121E97.6Very high97Very high76 Ų7665.1 Ų65.136%0.35533%0.325SS..G310 helixtrans-64.6-16.9-177.9-65.6-57.3130.700112.6D119 V123 P125 D126D119-E121 PolarHBondContact O-N 3.47Å; D119-E121 VanDerWaalsContact O-N 3.15Å; D119-E121 WeakPolarHBondContact OD1-CB 3.45Å; D119-E121 PolarHBondContact OD1-N 3.04Å; E121-V123 VanDerWaalsContact C-N 3.29Å; E121-V123 PolarHBondContact O-N 3.08Å; E121-P125 WeakPolarHBondContact OE1-CA 3.39Å; E121-P125 WeakPolarHBondContact OE2-CA 3.39Å; E121-P125 VanDerWaalsContact OE2-CB 3.28Å; E121-P125 WeakPolarHBondContact OE2-CB 3.2Å; E121-D126 PolarHBondContact OE1-N 3.08Å
122L98Very high96.9Very high22 Ų2264.7 Ų64.712%0.11532%0.323CS..G310 helixtrans-69.5-24.4177.1-61175.4000113.4L115 I118 D119 R120 G193 I194 A197L115-L122 HydrophobicContact CB-CB 4.44Å; L115-L122 HydrophobicContact CD2-CD1 4.19Å; I118-L122 HydrophobicContact CG2-CD1 4.22Å; D119-L122 HydrophobicContact CB-CD1 3.85Å; D119-L122 HydrophobicContact CB-CG 3.9Å; D119-L122 VanDerWaalsContact O-CB 3.26Å; D119-L122 WeakPolarHBondContact O-CB 3.19Å; D119-L122 VanDerWaalsContact O-CG 3.31Å; D119-L122 WeakPolarHBondContact O-CG 3.3Å; D119-L122 PolarHBondContact O-N 3.15Å; D119-L122 VanDerWaalsContact O-N 3.07Å; R120-L122 PolarHBondContact O-N 3.41Å; L122-G193 CarbonylContact O-C 3.59Å; L122-G193 WeakPolarHBondContact O-CA 3.41Å; L122-G193 PolarHBondContact O-N 3.4Å; L122-I194 HydrophobicContact CB-CB 4.21Å; L122-I194 HydrophobicContact CD1-CD1 4.28Å; L122-I194 HydrophobicContact CD2-CB 4.38Å; L122-I194 HydrophobicContact CD2-CD1 4.05Å; L122-I194 PolarHBondContact O-N 3.05Å; L122-A197 HydrophobicContact CD2-CB 4.11Å
123V97.3Very high96.8Very high25 Ų2565.9 Ų65.915%0.15233%0.332CS..THydrogen-bonded Turntrans-141.3-29.1-174.8-72.70000114.6F112 L115 F116 R120 E121F112-V123 HydrophobicContact CD2-CB 4.36Å; F112-V123 HydrophobicContact CD2-CG2 4.23Å; F112-V123 HydrophobicContact CE2-CG2 4.36Å; L115-V123 HydrophobicContact CB-CB 4.4Å; L115-V123 HydrophobicContact CB-CG1 3.62Å; L115-V123 HydrophobicContact CB-CG2 3.85Å; L115-V123 HydrophobicContact CD1-CG1 3.39Å; L115-V123 HydrophobicContact CG-CG1 4.13Å; F116-V123 HydrophobicContact CB-CG2 4.23Å; R120-V123 PolarHBondContact O-N 3.1Å; R120-V123 VanDerWaalsContact O-N 3.13Å; E121-V123 VanDerWaalsContact C-N 3.29Å; E121-V123 PolarHBondContact O-N 3.08Å
124Y96.2Very high96.7Very high6 Ų666 Ų662%0.02434%0.344CS..SBendtrans-146.682.4-174.3-168.1-91000110.9F112 F116 R120 L128 D129 I132F112-Y124 HydrophobicContact CE2-CD2 4.1Å; F112-Y124 HydrophobicContact CE2-CG 4.25Å; F112-Y124 HydrophobicContact CZ-CD2 4.04Å; F112-Y124 HydrophobicContact CZ-CG 4.04Å; F116-Y124 AromaticContact CE2-CD1 3.91Å; F116-Y124 HydrophobicContact CE2-CD1 3.91Å; F116-Y124 HydrophobicContact CE2-CG 4.41Å; R120-Y124 CarbonylContact C-O 3.6Å; R120-Y124 PolarHBondContact NE-O 2.89Å; R120-Y124 CarbonylContact O-C 3.28Å; R120-Y124 WeakPolarHBondContact O-CA 3.25Å; R120-Y124 PolarHBondContact O-N 2.85Å; R120-Y124 VanDerWaalsContact O-O 3.08Å; Y124-L128 HydrophobicContact CD1-CB 4.3Å; Y124-L128 HydrophobicContact CD2-CB 4.22Å; Y124-L128 HydrophobicContact CD2-CD1 3.53Å; Y124-L128 HydrophobicContact CE1-CB 3.8Å; Y124-L128 HydrophobicContact CE2-CB 3.71Å; Y124-L128 HydrophobicContact CE2-CD1 3.75Å; Y124-L128 HydrophobicContact CE2-CG 4.39Å; Y124-L128 HydrophobicContact CG-CB 4.49Å; Y124-L128 HydrophobicContact CG-CD1 3.95Å; Y124-L128 VanDerWaalsContact CZ-CB 3.47Å; Y124-L128 PolarHBondContact OH-O 2.88Å; Y124-D129 WeakPolarHBondContact CE1-OD1 3.29Å; Y124-I132 HydrophobicContact CE2-CD1 4.08Å
125P95.6Very high96.7Very high27 Ų2766.6 Ų66.618%0.17534%0.337CS..  trans-53.4151.2176.4-30.837.7000114.3E121 Y127 L128E121-P125 WeakPolarHBondContact OE1-CA 3.39Å; E121-P125 WeakPolarHBondContact OE2-CA 3.39Å; E121-P125 VanDerWaalsContact OE2-CB 3.28Å; E121-P125 WeakPolarHBondContact OE2-CB 3.2Å; P125-Y127 VanDerWaalsContact C-N 3.32Å; P125-Y127 HydrophobicContact CB-CD1 3.54Å; P125-Y127 HydrophobicContact CB-CE1 3.38Å; P125-Y127 HydrophobicContact CG-CE1 3.91Å; P125-Y127 PolarHBondContact O-N 3.19Å; P125-L128 WeakPolarHBondContact O-CB 3.17Å; P125-L128 PolarHBondContact O-N 3.14Å; P125-L128 VanDerWaalsContact O-N 3.09Å
126D96.3Very high96.6Very high98 Ų9865.7 Ų65.752%0.52433%0.332SS..G310 helixtrans-53.4-40.2-178.468.7-10000115E121 L128 D129E121-D126 PolarHBondContact OE1-N 3.08Å; D126-L128 PolarHBondContact O-N 3.3Å; D126-D129 WeakPolarHBondContact O-CB 3.35Å; D126-D129 PolarHBondContact O-N 3.49Å
127Y94.7Very high96.6Very high127 Ų12763.3 Ų63.350%0.49832%0.322SS..G310 helixtrans-62-20.3-17977.9-95.5000112.9L28 P125 D129 A130 L131L28-Y127 HydrophobicContact CD1-CE2 4.13Å; P125-Y127 VanDerWaalsContact C-N 3.32Å; P125-Y127 HydrophobicContact CB-CD1 3.54Å; P125-Y127 HydrophobicContact CB-CE1 3.38Å; P125-Y127 HydrophobicContact CG-CE1 3.91Å; P125-Y127 PolarHBondContact O-N 3.19Å; Y127-D129 PolarHBondContact O-N 2.92Å; Y127-A130 PolarHBondContact O-N 3.36Å; Y127-L131 HydrophobicContact CD2-CD1 3.93Å; Y127-L131 HydrophobicContact CE2-CD1 4Å
128L95.1Very high96.5Very high16 Ų1657.5 Ų57.58%0.08430%0.302CS..G310 helixtrans-68-23.1176.5-66178.8000112.6L28 Y124 P125 D126 A130 L131 I132L28-L128 HydrophobicContact CD1-CD2 3.51Å; Y124-L128 HydrophobicContact CD1-CB 4.3Å; Y124-L128 HydrophobicContact CD2-CB 4.22Å; Y124-L128 HydrophobicContact CD2-CD1 3.53Å; Y124-L128 HydrophobicContact CE1-CB 3.8Å; Y124-L128 HydrophobicContact CE2-CB 3.71Å; Y124-L128 HydrophobicContact CE2-CD1 3.75Å; Y124-L128 HydrophobicContact CE2-CG 4.39Å; Y124-L128 HydrophobicContact CG-CB 4.49Å; Y124-L128 HydrophobicContact CG-CD1 3.95Å; Y124-L128 VanDerWaalsContact CZ-CB 3.47Å; Y124-L128 PolarHBondContact OH-O 2.88Å; P125-L128 WeakPolarHBondContact O-CB 3.17Å; P125-L128 PolarHBondContact O-N 3.14Å; P125-L128 VanDerWaalsContact O-N 3.09Å; D126-L128 PolarHBondContact O-N 3.3Å; L128-A130 PolarHBondContact O-N 2.76Å; L128-L131 HydrophobicContact CD2-CD1 4.35Å; L128-L131 PolarHBondContact O-N 2.96Å; L128-I132 HydrophobicContact CD2-CD1 4.32Å; L128-I132 PolarHBondContact O-N 3.38Å
129D96.3Very high96.5Very high90 Ų9052.9 Ų52.948%0.48128%0.279SS..G310 helixtrans-60.3-31.3175.9-71-29.9000111.6R120 Y124 D126 Y127 L131R120-D129 IonicContact CZ-OD2 3.26Å; R120-D129 VanDerWaalsContact CZ-OD2 3.26Å; R120-D129 IonicContact NH1-OD2 2.81Å; R120-D129 PolarHBondContact NH1-OD2 3.43Å; R120-D129 IonicContact NH2-OD1 3.07Å; R120-D129 PolarHBondContact NH2-OD1 3.23Å; R120-D129 IonicContact NH2-OD2 2.8Å; R120-D129 PolarHBondContact NH2-OD2 3.37Å; Y124-D129 WeakPolarHBondContact CE1-OD1 3.29Å; D126-D129 WeakPolarHBondContact O-CB 3.35Å; D126-D129 PolarHBondContact O-N 3.49Å; Y127-D129 PolarHBondContact O-N 2.92Å; D129-L131 VanDerWaalsContact C-N 3.33Å
130A95.5Very high96.5Very high91 Ų9149.5 Ų49.575%0.75226%0.261SS*.G310 helixtrans-78.5-16.6177.100000113.3Y127 L128Y127-A130 PolarHBondContact O-N 3.36Å; L128-A130 PolarHBondContact O-N 2.76Å
131L94.2Very high96.5Very high50 Ų5047 Ų4726%0.26225%0.253SS..THydrogen-bonded Turntrans-108.4-34.7-173-57.7-178.2000113.1P26 L28 Y127 L128 D129P26-L131 HydrophobicContact CG-CB 4.12Å; P26-L131 HydrophobicContact CG-CD2 4.12Å; L28-L131 HydrophobicContact CD1-CD1 4.26Å; L28-L131 HydrophobicContact CD2-CD1 3.95Å; Y127-L131 HydrophobicContact CD2-CD1 3.93Å; Y127-L131 HydrophobicContact CE2-CD1 4Å; L128-L131 HydrophobicContact CD2-CD1 4.35Å; L128-L131 PolarHBondContact O-N 2.96Å; D129-L131 VanDerWaalsContact C-N 3.33Å
132I95.4Very high96.5Very high23 Ų2346.1 Ų46.112%0.11825%0.252CS..SBendtrans-118.7111.5-174.8-57.4172.2000107.5V25 Y124 L128 S134 V136 N137V25-I132 HydrophobicContact CG1-CG1 3.94Å; Y124-I132 HydrophobicContact CE2-CD1 4.08Å; L128-I132 HydrophobicContact CD2-CD1 4.32Å; L128-I132 PolarHBondContact O-N 3.38Å; I132-S134 PolarHBondContact O-N 3.44Å; I132-V136 HydrophobicContact CG2-CB 4.12Å; I132-V136 HydrophobicContact CG2-CG1 4.15Å; I132-N137 HydrophobicContact CG2-CB 4.23Å
133P96.5Very high96.4Very high38 Ų3847.1 Ų47.125%0.24726%0.255CS..  trans-56.2140176.9-2635.1000111.5Y20 W135 V136 N137Y20-P133 HydrophobicContact CE1-CG 3.91Å; P133-W135 HydrophobicContact CB-CG 4.49Å; P133-W135 PolarHBondContact O-N 3.5Å; P133-W135 VanDerWaalsContact O-N 3.1Å; P133-V136 HydrophobicContact CB-CG2 4.2Å; P133-V136 HydrophobicContact CG-CG2 4.31Å; P133-V136 WeakPolarHBondContact O-CB 3.37Å; P133-V136 PolarHBondContact O-N 3.27Å; P133-N137 PolarHBondContact O-N 3.5Å; P133-N137 VanDerWaalsContact O-N 3.08Å
134S96.4Very high96.4Very high76 Ų7646 Ų4653%0.53125%0.247SC..Hα-helixtrans-51.7-39.9-177.2176.60000112.9I132 V136 N137 H138I132-S134 PolarHBondContact O-N 3.44Å; S134-V136 PolarHBondContact O-N 2.98Å; S134-N137 WeakPolarHBondContact O-CB 3.21Å; S134-N137 PolarHBondContact O-N 3.47Å; S134-H138 PolarHBondContact O-N 3.49Å; S134-H138 PolarHBondContact O-ND1 3.41Å; S134-H138 PolarHBondContact OG-CE1 2.87Å; S134-H138 VanDerWaalsContact OG-CE1 3.29Å; S134-H138 PolarHBondContact OG-ND1 3.22Å
135W97.1Very high96.5Very high95 Ų9546.3 Ų46.336%0.3625%0.251SS..Hα-helixtrans-64.8-36.7178.572-95.6000112.9F16 T17 Y20 P133 H138 V139F16-W135 HydrophobicContact CD1-CH2 4.13Å; F16-W135 HydrophobicContact CD1-CZ3 4.28Å; F16-W135 AromaticContact CE1-CH2 3.65Å; F16-W135 HydrophobicContact CE1-CH2 3.65Å; F16-W135 HydrophobicContact CE1-CZ2 4.31Å; F16-W135 HydrophobicContact CE1-CZ3 4.09Å; T17-W135 HydrophobicContact CG2-CZ3 4.17Å; Y20-W135 AromaticContact CD1-CH2 3.75Å; Y20-W135 HydrophobicContact CD1-CH2 3.75Å; Y20-W135 AromaticContact CD1-CZ2 3.46Å; Y20-W135 HydrophobicContact CD1-CZ2 3.46Å; Y20-W135 VanDerWaalsContact CD1-CZ2 3.46Å; Y20-W135 AromaticContact CD2-CH2 3.99Å; Y20-W135 HydrophobicContact CD2-CH2 3.99Å; Y20-W135 AromaticContact CD2-CZ2 3.59Å; Y20-W135 HydrophobicContact CD2-CZ2 3.59Å; Y20-W135 HydrophobicContact CE1-CH2 4.36Å; Y20-W135 AromaticContact CE1-CZ2 3.61Å; Y20-W135 HydrophobicContact CE1-CZ2 3.61Å; Y20-W135 AromaticContact CE2-CZ2 3.74Å; Y20-W135 HydrophobicContact CE2-CZ2 3.74Å; Y20-W135 AromaticContact CG-CH2 3.54Å; Y20-W135 HydrophobicContact CG-CH2 3.54Å; Y20-W135 AromaticContact CG-CZ2 3.45Å; Y20-W135 HydrophobicContact CG-CZ2 3.45Å; Y20-W135 VanDerWaalsContact CG-CZ2 3.45Å; Y20-W135 AromaticContact CZ-CZ2 3.74Å; P133-W135 HydrophobicContact CB-CG 4.49Å; P133-W135 PolarHBondContact O-N 3.5Å; P133-W135 VanDerWaalsContact O-N 3.1Å; W135-H138 PolarHBondContact O-N 3.45Å; W135-V139 HydrophobicContact CE3-CG2 4.31Å; W135-V139 WeakPolarHBondContact O-CG2 3.19Å; W135-V139 PolarHBondContact O-N 3.49Å
136V97.5Very high96.6Very high0 Ų047.4 Ų47.40%026%0.259CS..Hα-helixtrans-65.2-46.1174.5178.90000109.1T17 Y20 I132 P133 S134 H138 V139 L140T17-V136 HydrophobicContact CG2-CG1 4.17Å; Y20-V136 HydrophobicContact CD1-CG2 3.75Å; Y20-V136 HydrophobicContact CE1-CG2 3.9Å; I132-V136 HydrophobicContact CG2-CB 4.12Å; I132-V136 HydrophobicContact CG2-CG1 4.15Å; P133-V136 HydrophobicContact CB-CG2 4.2Å; P133-V136 HydrophobicContact CG-CG2 4.31Å; P133-V136 WeakPolarHBondContact O-CB 3.37Å; P133-V136 PolarHBondContact O-N 3.27Å; S134-V136 PolarHBondContact O-N 2.98Å; V136-H138 VanDerWaalsContact C-N 3.28Å; V136-H138 PolarHBondContact O-N 2.96Å; V136-V139 PolarHBondContact O-N 3.4Å; V136-V139 VanDerWaalsContact O-N 3.14Å; V136-L140 HydrophobicContact CG1-CD1 3.85Å; V136-L140 HydrophobicContact CG1-CG 4.2Å; V136-L140 WeakPolarHBondContact O-CB 3.49Å; V136-L140 VanDerWaalsContact O-CG 3.29Å; V136-L140 WeakPolarHBondContact O-CG 3.42Å; V136-L140 PolarHBondContact O-N 3.45Å
137N96.7Very high96.6Very high9 Ų942.7 Ų42.75%0.04823%0.234CC..Hα-helixtrans-55.5-44.4176.3-175.638.7000111.7I132 P133 S134 L140 H141I132-N137 HydrophobicContact CG2-CB 4.23Å; P133-N137 PolarHBondContact O-N 3.5Å; P133-N137 VanDerWaalsContact O-N 3.08Å; S134-N137 WeakPolarHBondContact O-CB 3.21Å; S134-N137 PolarHBondContact O-N 3.47Å; N137-L140 PolarHBondContact O-N 3.31Å; N137-H141 WeakPolarHBondContact O-CB 3.36Å; N137-H141 PolarHBondContact O-N 2.82Å; N137-H141 PolarHBondContact O-ND1 2.99Å; N137-H141 VanDerWaalsContact O-ND1 3.16Å; N137-H141 PolarHBondContact OD1-CE1 3.41Å; N137-H141 VanDerWaalsContact OD1-CE1 3.31Å; N137-H141 PolarHBondContact OD1-ND1 3.26Å
138H97.3Very high96.7Very high83 Ų8336.7 Ų36.738%0.38421%0.21SC..Hα-helixtrans-66.1-41.1176.2-75.380.7000112.7S134 W135 V136 L140 H141 V142 Y143S134-H138 PolarHBondContact O-N 3.49Å; S134-H138 PolarHBondContact O-ND1 3.41Å; S134-H138 PolarHBondContact OG-CE1 2.87Å; S134-H138 VanDerWaalsContact OG-CE1 3.29Å; S134-H138 PolarHBondContact OG-ND1 3.22Å; W135-H138 PolarHBondContact O-N 3.45Å; V136-H138 VanDerWaalsContact C-N 3.28Å; V136-H138 PolarHBondContact O-N 2.96Å; H138-L140 VanDerWaalsContact C-N 3.32Å; H138-L140 PolarHBondContact O-N 3.3Å; H138-H141 PolarHBondContact O-N 3.37Å; H138-V142 WeakPolarHBondContact O-CA 3.16Å; H138-V142 WeakPolarHBondContact O-CB 3.47Å; H138-V142 PolarHBondContact O-N 3.01Å; H138-Y143 PolarHBondContact O-N 2.96Å
139V97.7Very high96.8Very high19 Ų1938.9 Ų38.912%0.11522%0.221CC..Hα-helixtrans-61.3-44.4175.2174.90000110.6I13 W14 T17 W135 V136 H141 Y143I13-V139 HydrophobicContact CG2-CG1 4.3Å; I13-V139 HydrophobicContact CG2-CG2 4.38Å; W14-V139 HydrophobicContact CE3-CG1 3.93Å; W14-V139 HydrophobicContact CH2-CG1 4.4Å; W14-V139 HydrophobicContact CZ3-CG1 3.66Å; T17-V139 HydrophobicContact CG2-CB 4.06Å; T17-V139 HydrophobicContact CG2-CG1 3.81Å; W135-V139 HydrophobicContact CE3-CG2 4.31Å; W135-V139 WeakPolarHBondContact O-CG2 3.19Å; W135-V139 PolarHBondContact O-N 3.49Å; V136-V139 PolarHBondContact O-N 3.4Å; V136-V139 VanDerWaalsContact O-N 3.14Å; V139-H141 PolarHBondContact O-N 3.12Å; V139-Y143 HydrophobicContact CG1-CD1 4.26Å; V139-Y143 VanDerWaalsContact O-CB 3.22Å; V139-Y143 WeakPolarHBondContact O-CB 3.21Å; V139-Y143 PolarHBondContact O-N 3.25Å
140L97.7Very high96.8Very high4 Ų437.8 Ų37.82%0.02122%0.215CC..Hα-helixtrans-66.6-36.5-178.9-68.5177000113.7T42 F46 V136 N137 H138T42-L140 HydrophobicContact CG2-CB 3.74Å; F46-L140 HydrophobicContact CB-CD2 3.61Å; F46-L140 HydrophobicContact CD1-CD2 3.52Å; F46-L140 HydrophobicContact CD2-CD2 3.59Å; F46-L140 HydrophobicContact CE1-CD2 3.94Å; F46-L140 HydrophobicContact CE2-CD2 4Å; F46-L140 HydrophobicContact CG-CD2 3.29Å; F46-L140 HydrophobicContact CZ-CD2 4.12Å; V136-L140 HydrophobicContact CG1-CD1 3.85Å; V136-L140 HydrophobicContact CG1-CG 4.2Å; V136-L140 WeakPolarHBondContact O-CB 3.49Å; V136-L140 VanDerWaalsContact O-CG 3.29Å; V136-L140 WeakPolarHBondContact O-CG 3.42Å; V136-L140 PolarHBondContact O-N 3.45Å; N137-L140 PolarHBondContact O-N 3.31Å; H138-L140 VanDerWaalsContact C-N 3.32Å; H138-L140 PolarHBondContact O-N 3.3Å
141H97.9Very high96.8Very high13 Ų1333.4 Ų33.46%0.0618%0.179CC..Hα-helixtrans-114.9-5.1-170.3-60.4108000115.5T42 V109 F112 W113 N137 H138 V139T42-H141 WeakPolarHBondContact CG2-NE2 3.48Å; T42-H141 PolarHBondContact OG1-CD2 3.34Å; T42-H141 PolarHBondContact OG1-NE2 3.37Å; V109-H141 WeakPolarHBondContact CA-O 3.35Å; V109-H141 WeakPolarHBondContact CG2-O 3.37Å; F112-H141 HydrophobicContact CB-CB 4.38Å; F112-H141 HydrophobicContact CD1-CB 3.46Å; F112-H141 VanDerWaalsContact CD1-CB 3.46Å; F112-H141 AromaticContact CD1-CD2 3.84Å; F112-H141 AromaticContact CD1-CG 3.59Å; F112-H141 HydrophobicContact CD2-CB 4.45Å; F112-H141 AromaticContact CD2-CD2 3.2Å; F112-H141 WeakPolarHBondContact CD2-CD2 3.49Å; F112-H141 AromaticContact CD2-CE1 3.8Å; F112-H141 AromaticContact CD2-CG 3.7Å; F112-H141 AromaticContact CD2-NE2 3.29Å; F112-H141 VanDerWaalsContact CD2-NE2 3.29Å; F112-H141 WeakPolarHBondContact CD2-NE2 3.3Å; F112-H141 HydrophobicContact CE1-CB 3.74Å; F112-H141 AromaticContact CE1-CG 3.7Å; F112-H141 AromaticContact CE1-ND1 3.87Å; F112-H141 AromaticContact CE2-CD2 3.63Å; F112-H141 AromaticContact CE2-CE1 3.39Å; F112-H141 WeakPolarHBondContact CE2-CE1 3.39Å; F112-H141 AromaticContact CE2-CG 3.79Å; F112-H141 AromaticContact CE2-ND1 3.66Å; F112-H141 AromaticContact CE2-NE2 3.38Å; F112-H141 WeakPolarHBondContact CE2-NE2 3.23Å; F112-H141 HydrophobicContact CG-CB 3.85Å; F112-H141 AromaticContact CG-CD2 3.31Å; F112-H141 WeakPolarHBondContact CG-CD2 3.37Å; F112-H141 AromaticContact CG-CG 3.59Å; F112-H141 AromaticContact CG-NE2 3.93Å; F112-H141 HydrophobicContact CZ-CB 4.33Å; F112-H141 AromaticContact CZ-CE1 3.74Å; F112-H141 AromaticContact CZ-CG 3.79Å; F112-H141 AromaticContact CZ-ND1 3.57Å; W113-H141 HydrophobicContact CZ2-CB 4.45Å; W113-H141 PolarHBondContact NE1-O 3.01Å; N137-H141 WeakPolarHBondContact O-CB 3.36Å; N137-H141 PolarHBondContact O-N 2.82Å; N137-H141 PolarHBondContact O-ND1 2.99Å; N137-H141 VanDerWaalsContact O-ND1 3.16Å; N137-H141 PolarHBondContact OD1-CE1 3.41Å; N137-H141 VanDerWaalsContact OD1-CE1 3.31Å; N137-H141 PolarHBondContact OD1-ND1 3.26Å; H138-H141 PolarHBondContact O-N 3.37Å; V139-H141 PolarHBondContact O-N 3.12Å
142V97.8Very high96.8Very high56 Ų5631.1 Ų31.134%0.33917%0.167SC..THydrogen-bonded Turntrans-117.2-47.5174.5-178.20000110.5W113 H138 S144 A145 P146W113-V142 HydrophobicContact CZ2-CG2 3.6Å; W113-V142 VanDerWaalsContact NE1-CG2 3.3Å; H138-V142 WeakPolarHBondContact O-CA 3.16Å; H138-V142 WeakPolarHBondContact O-CB 3.47Å; H138-V142 PolarHBondContact O-N 3.01Å; V142-S144 VanDerWaalsContact C-N 3.25Å; V142-S144 PolarHBondContact O-N 2.91Å; V142-S144 VanDerWaalsContact O-N 3.11Å; V142-A145 PolarHBondContact O-N 3.46Å; V142-P146 WeakPolarHBondContact O-CD 3.4Å
143Y96.5Very high96.7Very high44 Ų4434.4 Ų34.417%0.17318%0.184CC..THydrogen-bonded Turntrans-66.5-20.6-162.6-168.5-119.8000114.9M10 I13 W14 H138 V139 A145 P146 F147M10-Y143 WeakPolarHBondContact CA-OH 3.35Å; M10-Y143 WeakPolarHBondContact CG-OH 3.28Å; I13-Y143 HydrophobicContact CB-CE1 3.87Å; I13-Y143 HydrophobicContact CD1-CE1 4.35Å; I13-Y143 HydrophobicContact CD1-CE2 4.16Å; I13-Y143 WeakPolarHBondContact CD1-OH 3.47Å; I13-Y143 HydrophobicContact CG2-CD1 3.81Å; I13-Y143 HydrophobicContact CG2-CE1 3.49Å; I13-Y143 VanDerWaalsContact CG2-CE1 3.49Å; I13-Y143 HydrophobicContact CG2-CG 4.48Å; W14-Y143 AromaticContact CD2-CD1 3.99Å; W14-Y143 HydrophobicContact CD2-CD1 3.99Å; W14-Y143 HydrophobicContact CD2-CE1 4.22Å; W14-Y143 AromaticContact CE2-CD1 3.47Å; W14-Y143 VanDerWaalsContact CE2-CD1 3.47Å; W14-Y143 AromaticContact CE2-CE1 3.74Å; W14-Y143 HydrophobicContact CE3-CD1 4.34Å; W14-Y143 HydrophobicContact CG-CE1 4.46Å; W14-Y143 AromaticContact CH2-CD1 3.79Å; W14-Y143 HydrophobicContact CH2-CD1 3.79Å; W14-Y143 HydrophobicContact CH2-CG 4.41Å; W14-Y143 AromaticContact CZ2-CD1 3.39Å; W14-Y143 HydrophobicContact CZ2-CD1 3.39Å; W14-Y143 HydrophobicContact CZ2-CE1 4.09Å; W14-Y143 HydrophobicContact CZ2-CG 4.21Å; W14-Y143 HydrophobicContact CZ3-CD1 4.25Å; W14-Y143 AromaticContact NE1-CD1 3.92Å; W14-Y143 AromaticContact NE1-CE1 3.69Å; H138-Y143 PolarHBondContact O-N 2.96Å; V139-Y143 HydrophobicContact CG1-CD1 4.26Å; V139-Y143 VanDerWaalsContact O-CB 3.22Å; V139-Y143 WeakPolarHBondContact O-CB 3.21Å; V139-Y143 PolarHBondContact O-N 3.25Å; Y143-A145 VanDerWaalsContact C-N 3.27Å; Y143-A145 PolarHBondContact O-N 3.36Å; Y143-P146 HydrophobicContact CD2-CG 3.96Å; Y143-P146 VanDerWaalsContact O-CD 3.31Å; Y143-P146 WeakPolarHBondContact O-CD 3.5Å; Y143-P146 WeakPolarHBondContact O-CG 3.44Å; Y143-F147 WeakPolarHBondContact O-CB 3.41Å; Y143-F147 PolarHBondContact O-N 3.27Å; Y143-F147 VanDerWaalsContact O-N 3.12Å
144S97Very high96.4Very high0 Ų034 Ų340%018%0.18CC..Hα-helixtrans-56.9-39.9170.6-60.10000112.5N45 V142 V148N45-S144 PolarHBondContact ND2-OG 3.11Å; V142-S144 VanDerWaalsContact C-N 3.25Å; V142-S144 PolarHBondContact O-N 2.91Å; V142-S144 VanDerWaalsContact O-N 3.11Å; S144-V148 WeakPolarHBondContact O-CG1 3.43Å; S144-V148 WeakPolarHBondContact O-CG2 3.28Å; S144-V148 PolarHBondContact O-N 3.49Å
145A98Very high96.1Very high13 Ų1330.4 Ų30.411%0.10716%0.155CC..Hα-helixtrans-65.1-58-17900000113.8M106 V109 V142 Y143 F147 V148 L149M106-A145 HydrophobicContact SD-CB 3.81Å; V109-A145 HydrophobicContact CB-CB 4.45Å; V109-A145 HydrophobicContact CG1-CB 4.17Å; V109-A145 HydrophobicContact CG2-CB 3.99Å; V142-A145 PolarHBondContact O-N 3.46Å; Y143-A145 VanDerWaalsContact C-N 3.27Å; Y143-A145 PolarHBondContact O-N 3.36Å; A145-F147 PolarHBondContact O-N 2.82Å; A145-V148 WeakPolarHBondContact O-CG2 3.45Å; A145-V148 PolarHBondContact O-N 2.87Å; A145-L149 WeakPolarHBondContact O-CB 3.42Å; A145-L149 WeakPolarHBondContact O-CG 3.2Å; A145-L149 PolarHBondContact O-N 3.3Å
146P96.9Very high95.7Very high50 Ų5026.5 Ų26.533%0.32514%0.142SC..Hα-helixtrans-61.8-33.7177.325.7-33.5000111.8V142 Y143 I150V142-P146 WeakPolarHBondContact O-CD 3.4Å; Y143-P146 HydrophobicContact CD2-CG 3.96Å; Y143-P146 VanDerWaalsContact O-CD 3.31Å; Y143-P146 WeakPolarHBondContact O-CD 3.5Å; Y143-P146 WeakPolarHBondContact O-CG 3.44Å; P146-I150 WeakPolarHBondContact O-CB 3.16Å; P146-I150 WeakPolarHBondContact O-CD1 3.21Å; P146-I150 WeakPolarHBondContact O-CG1 3.25Å; P146-I150 PolarHBondContact O-N 2.96Å
147F97.1Very high95.4Very high0 Ų026.6 Ų26.60%014%0.142CC..Hα-helixtrans-59.8-55176.3175.3-99.9000112.1M10 W14 Q49 Y52 I101 Y143 A145 L149 I150 D151M10-F147 HydrophobicContact CB-CD2 3.68Å; M10-F147 HydrophobicContact CB-CE2 3.68Å; M10-F147 HydrophobicContact CE-CD2 4.15Å; M10-F147 HydrophobicContact CG-CD2 3.75Å; M10-F147 HydrophobicContact CG-CE2 4.08Å; M10-F147 HydrophobicContact SD-CD2 3.43Å; M10-F147 WeakPolarHBondContact SD-CD2 3.47Å; M10-F147 HydrophobicContact SD-CE2 3.54Å; M10-F147 VanDerWaalsContact SD-CE2 3.54Å; W14-F147 HydrophobicContact CZ2-CB 4.48Å; W14-F147 AromaticContact NE1-CD2 3.72Å; W14-F147 AromaticContact NE1-CG 3.74Å; Q49-F147 VanDerWaalsContact OE1-CE1 3.27Å; Y52-F147 AromaticContact CD1-CE1 3.7Å; Y52-F147 HydrophobicContact CD1-CE1 3.7Å; Y52-F147 AromaticContact CD1-CZ 3.85Å; Y52-F147 HydrophobicContact CD1-CZ 3.85Å; Y52-F147 HydrophobicContact CE1-CE1 4.08Å; Y52-F147 HydrophobicContact CE1-CZ 4.2Å; I101-F147 HydrophobicContact CG2-CE1 4.34Å; Y143-F147 WeakPolarHBondContact O-CB 3.41Å; Y143-F147 PolarHBondContact O-N 3.27Å; Y143-F147 VanDerWaalsContact O-N 3.12Å; A145-F147 PolarHBondContact O-N 2.82Å; F147-L149 VanDerWaalsContact C-N 3.34Å; F147-L149 PolarHBondContact O-N 2.96Å; F147-I150 PolarHBondContact O-N 3.42Å; F147-D151 WeakPolarHBondContact O-CB 3.44Å; F147-D151 PolarHBondContact O-N 2.88Å
148V97Very high95.1Very high0 Ų033.8 Ų33.80%017%0.169CC..Hα-helixtrans-69.7-31.1-177.7-57.80000112.9Y97 I101 F102 M106 S144 A145 D151 S152Y97-V148 HydrophobicContact CE2-CB 4.34Å; Y97-V148 PolarHBondContact OH-O 3.42Å; I101-V148 HydrophobicContact CG2-CG1 3.77Å; F102-V148 HydrophobicContact CD2-CB 3.86Å; F102-V148 HydrophobicContact CD2-CG2 3.72Å; F102-V148 HydrophobicContact CE2-CG2 4.03Å; F102-V148 HydrophobicContact CG-CG2 4.49Å; M106-V148 HydrophobicContact CG-CG2 4.2Å; M106-V148 HydrophobicContact SD-CG2 3.96Å; S144-V148 WeakPolarHBondContact O-CG1 3.43Å; S144-V148 WeakPolarHBondContact O-CG2 3.28Å; S144-V148 PolarHBondContact O-N 3.49Å; A145-V148 WeakPolarHBondContact O-CG2 3.45Å; A145-V148 PolarHBondContact O-N 2.87Å; V148-D151 PolarHBondContact O-N 2.94Å; V148-S152 PolarHBondContact O-N 3.34Å; V148-S152 PolarHBondContact O-OG 2.97Å
149L97.1Very high94.9Very high62 Ų6230.9 Ų30.933%0.32516%0.155SC..Hα-helixtrans-69.6-41.5175.8-69.6173.8000111.9A145 F147 S152 L153 Y224A145-L149 WeakPolarHBondContact O-CB 3.42Å; A145-L149 WeakPolarHBondContact O-CG 3.2Å; A145-L149 PolarHBondContact O-N 3.3Å; F147-L149 VanDerWaalsContact C-N 3.34Å; F147-L149 PolarHBondContact O-N 2.96Å; L149-S152 WeakPolarHBondContact O-CB 3.38Å; L149-L153 WeakPolarHBondContact O-CG 3.23Å; L149-L153 PolarHBondContact O-N 3.49Å; L149-Y224 HydrophobicContact CD2-CD1 4.29Å; L149-Y224 HydrophobicContact CD2-CE1 3.68Å
150I96.1Very high94.7Very high67 Ų6731 Ų3134%0.34416%0.155SC..Hα-helixtrans-68.6-40.2174.2-65.7163.7000110.2I6 M10 P146 F147 S152 L153 L154I6-I150 HydrophobicContact CG2-CG2 3.99Å; M10-I150 HydrophobicContact CE-CB 3.44Å; M10-I150 VanDerWaalsContact CE-CB 3.44Å; M10-I150 HydrophobicContact CE-CD1 3.67Å; M10-I150 HydrophobicContact CE-CG1 4.16Å; M10-I150 HydrophobicContact CE-CG2 3.29Å; P146-I150 WeakPolarHBondContact O-CB 3.16Å; P146-I150 WeakPolarHBondContact O-CD1 3.21Å; P146-I150 WeakPolarHBondContact O-CG1 3.25Å; P146-I150 PolarHBondContact O-N 2.96Å; F147-I150 PolarHBondContact O-N 3.42Å; I150-S152 VanDerWaalsContact C-N 3.32Å; I150-S152 PolarHBondContact O-N 3.44Å; I150-L153 WeakPolarHBondContact O-CA 3.46Å; I150-L153 WeakPolarHBondContact O-CB 3.43Å; I150-L153 PolarHBondContact O-N 3.09Å; I150-L154 HydrophobicContact CG2-CD1 3.92Å; I150-L154 HydrophobicContact CG2-CG 4.2Å; I150-L154 WeakPolarHBondContact O-CG 3.44Å; I150-L154 PolarHBondContact O-N 2.98Å
151D95.5Very high94.5Very high0 Ų034.9 Ų34.90%018%0.181CC..Hα-helixtrans-57.4-45.3175.6-169.238.3000111.8Y7 Y52 Y97 F147 V148 L153 L154 V155 H157Y7-D151 HydrophobicContact CE1-CB 4.48Å; Y7-D151 WeakPolarHBondContact CE1-OD1 3.33Å; Y7-D151 PolarHBondContact OH-OD1 2.61Å; Y52-D151 VanDerWaalsContact CE1-OD2 3.27Å; Y52-D151 WeakPolarHBondContact CE1-OD2 3.14Å; Y52-D151 PolarHBondContact OH-OD2 2.68Å; Y97-D151 VanDerWaalsContact CD2-OD2 3.22Å; Y97-D151 WeakPolarHBondContact CD2-OD2 3.42Å; Y97-D151 HydrophobicContact CE2-CB 4.24Å; Y97-D151 WeakPolarHBondContact CE2-OD2 3.07Å; F147-D151 WeakPolarHBondContact O-CB 3.44Å; F147-D151 PolarHBondContact O-N 2.88Å; V148-D151 PolarHBondContact O-N 2.94Å; D151-L153 PolarHBondContact O-N 2.76Å; D151-L154 PolarHBondContact O-N 3.4Å; D151-V155 PolarHBondContact O-N 3.36Å; D151-H157 IonicContact OD1-NE2 3.93Å; D151-H157 IonicContact OD2-CE1 3.55Å; D151-H157 IonicContact OD2-NE2 3.34Å; D151-H157 PolarHBondContact OD2-NE2 2.92Å
152S94.3Very high94.5Very high1 Ų141.2 Ų41.21%0.00720%0.204CC..Hα-helixtrans-55.7-32.5172.4-57.40000113.6Y97 V148 L149 I150 Y224 W229Y97-S152 PolarHBondContact OH-OG 3.19Å; V148-S152 PolarHBondContact O-N 3.34Å; V148-S152 PolarHBondContact O-OG 2.97Å; L149-S152 WeakPolarHBondContact O-CB 3.38Å; I150-S152 VanDerWaalsContact C-N 3.32Å; I150-S152 PolarHBondContact O-N 3.44Å; S152-Y224 WeakPolarHBondContact OG-CD1 3.33Å; S152-Y224 WeakPolarHBondContact OG-CE1 3.33Å; S152-W229 PolarHBondContact O-NE1 2.92Å
153L92.6Very high94.5Very high93 Ų9344.1 Ų44.149%0.48722%0.222SC..Hα-helixtrans-81.2-22178.7-66.8170.4000112.5L149 I150 D151 I228 W229L149-L153 WeakPolarHBondContact O-CG 3.23Å; L149-L153 PolarHBondContact O-N 3.49Å; I150-L153 WeakPolarHBondContact O-CA 3.46Å; I150-L153 WeakPolarHBondContact O-CB 3.43Å; I150-L153 PolarHBondContact O-N 3.09Å; D151-L153 PolarHBondContact O-N 2.76Å; L153-I228 HydrophobicContact CD2-CD1 3.7Å; L153-I228 HydrophobicContact CD2-CG1 4.32Å; L153-I228 HydrophobicContact CG-CD1 4.46Å; L153-W229 WeakPolarHBondContact O-CH2 3.47Å; L153-W229 VanDerWaalsContact O-CZ2 3.23Å; L153-W229 WeakPolarHBondContact O-CZ2 3.19Å
154L91.3Very high94.5Very high29 Ų2948.9 Ų48.915%0.15224%0.243CC..Hα-helixtrans-91.1-28.3-179.3-67.2177000112.5R3 I6 Y7 I150 D151R3-L154 HydrophobicContact CG-CB 4.43Å; R3-L154 HydrophobicContact CG-CD1 4.47Å; R3-L154 VanDerWaalsContact CZ-O 3.27Å; R3-L154 PolarHBondContact NH1-O 3.04Å; I6-L154 HydrophobicContact CB-CD1 4.15Å; I6-L154 HydrophobicContact CD1-CD1 4.27Å; I6-L154 HydrophobicContact CD1-CD2 3.9Å; I6-L154 HydrophobicContact CG2-CD1 3.77Å; Y7-L154 HydrophobicContact CE1-CD1 3.98Å; Y7-L154 HydrophobicContact CE2-CD1 4.27Å; I150-L154 HydrophobicContact CG2-CD1 3.92Å; I150-L154 HydrophobicContact CG2-CG 4.2Å; I150-L154 WeakPolarHBondContact O-CG 3.44Å; I150-L154 PolarHBondContact O-N 2.98Å; D151-L154 PolarHBondContact O-N 3.4Å
155V89.1Confident94.6Very high1 Ų148.9 Ų48.91%0.00624%0.243CC..  trans-136.7130.9-172.1171.10000111.2Y7 R59 D151 H157 W229Y7-V155 WeakPolarHBondContact OH-CG2 3.37Å; R59-V155 VanDerWaalsContact NH2-CG1 3.27Å; D151-V155 PolarHBondContact O-N 3.36Å; V155-H157 PolarHBondContact O-CD2 3.31Å; V155-H157 PolarHBondContact O-N 2.98Å; V155-W229 PolarHBondContact O-NE1 3.05Å; V155-W229 VanDerWaalsContact O-NE1 3.12Å
156C89.3Confident94.6Very high12 Ų1250.5 Ų50.58%0.08125%0.25CC..  trans-75107.7161.6175.90000109.2W229C156-W229 HydrophobicContact CB-CB 3.86Å; C156-W229 HydrophobicContact CB-CD2 3.72Å; C156-W229 HydrophobicContact CB-CE3 4.36Å; C156-W229 HydrophobicContact CB-CG 3.52Å
157H91Very high94.7Very high2 Ų251.9 Ų51.91%0.00926%0.257CS..  trans-85.6137.4178.8-67.9-75000111.4Y52 D94 Y97 D151 V155 Y159 N225Y52-H157 PolarHBondContact OH-CE1 3.41Å; D94-H157 IonicContact OD1-CE1 3.92Å; D94-H157 IonicContact OD1-CG 3.82Å; D94-H157 IonicContact OD1-ND1 2.93Å; D94-H157 PolarHBondContact OD1-ND1 3.18Å; Y97-H157 HydrophobicContact CD1-CB 3.86Å; Y97-H157 AromaticContact CD1-CD2 3.51Å; Y97-H157 AromaticContact CD1-CE1 3.95Å; Y97-H157 AromaticContact CD1-CG 3.41Å; Y97-H157 VanDerWaalsContact CD1-CG 3.41Å; Y97-H157 AromaticContact CD1-ND1 3.74Å; Y97-H157 AromaticContact CD1-NE2 3.86Å; Y97-H157 AromaticContact CD2-CE1 3.89Å; Y97-H157 AromaticContact CD2-NE2 3.83Å; Y97-H157 HydrophobicContact CE1-CB 4.12Å; Y97-H157 AromaticContact CE1-CD2 3.28Å; Y97-H157 WeakPolarHBondContact CE1-CD2 3.29Å; Y97-H157 AromaticContact CE1-CG 3.66Å; Y97-H157 AromaticContact CE1-NE2 3.78Å; Y97-H157 AromaticContact CE2-NE2 3.76Å; Y97-H157 AromaticContact CG-CE1 3.71Å; Y97-H157 AromaticContact CG-CG 3.96Å; Y97-H157 AromaticContact CG-ND1 3.8Å; Y97-H157 AromaticContact CG-NE2 3.88Å; Y97-H157 AromaticContact CZ-CD2 3.62Å; Y97-H157 AromaticContact CZ-NE2 3.72Å; D151-H157 IonicContact OD1-NE2 3.93Å; D151-H157 IonicContact OD2-CE1 3.55Å; D151-H157 IonicContact OD2-NE2 3.34Å; D151-H157 PolarHBondContact OD2-NE2 2.92Å; V155-H157 PolarHBondContact O-CD2 3.31Å; V155-H157 PolarHBondContact O-N 2.98Å; H157-Y159 HydrophobicContact CB-CD2 4.29Å; H157-Y159 HydrophobicContact CB-CE2 4.07Å; H157-Y159 PolarHBondContact O-N 3.38Å; H157-N225 PolarHBondContact N-OD1 3.43Å; H157-N225 PolarHBondContact O-ND2 3.32Å; H157-N225 PolarHBondContact O-OD1 3Å
158R89.4Confident94.8Very high160 Ų16055 Ų5560%0.60428%0.277SS*.  trans-85.299170-171.9174.7179.7165.81.6110.9Y84 D94Y84-R158 HydrophobicContact CE1-CB 4.38Å; D94-R158 HydrophobicContact CB-CB 4.42Å; D94-R158 PolarHBondContact OD2-N 3.06Å
159Y93Very high94.8Very high23 Ų2355 Ų559%0.0928%0.277CS..PPolyproline II helixtrans-62.8139.5173.7-83.1-113.8000111Y97 A98 H157 Y218 G221 E222 N225Y97-Y159 HydrophobicContact CD1-CE2 4.41Å; Y97-Y159 HydrophobicContact CE1-CE2 4.17Å; Y97-Y159 WeakPolarHBondContact CE1-OH 3.37Å; A98-Y159 HydrophobicContact CB-CD1 3.58Å; A98-Y159 HydrophobicContact CB-CD2 4.28Å; A98-Y159 HydrophobicContact CB-CE1 3.58Å; A98-Y159 HydrophobicContact CB-CE2 4.28Å; A98-Y159 HydrophobicContact CB-CG 3.92Å; H157-Y159 HydrophobicContact CB-CD2 4.29Å; H157-Y159 HydrophobicContact CB-CE2 4.07Å; H157-Y159 PolarHBondContact O-N 3.38Å; Y159-Y218 AromaticContact CD1-CE2 3.97Å; Y159-Y218 HydrophobicContact CD1-CE2 3.97Å; Y159-Y218 HydrophobicContact CE1-CE2 4.3Å; Y159-G221 VanDerWaalsContact CZ-C 3.44Å; Y159-G221 WeakPolarHBondContact OH-CA 3.26Å; Y159-G221 PolarHBondContact OH-O 2.99Å; Y159-E222 HydrophobicContact CD1-CB 3.64Å; Y159-E222 HydrophobicContact CD1-CG 4.08Å; Y159-E222 HydrophobicContact CE1-CB 3.86Å; Y159-E222 VanDerWaalsContact CE1-N 3.31Å; Y159-E222 HydrophobicContact CG-CB 4.16Å; Y159-E222 HydrophobicContact CG-CG 4.15Å; Y159-N225 HydrophobicContact CD2-CB 4.26Å; Y159-N225 HydrophobicContact CE2-CB 3.78Å
160P94.2Very high94.9Very high20 Ų2054 Ų5413%0.1327%0.273CS..PPolyproline II helixtrans-59.2158.9168.7-22.933.5000111.3T99 R162 Y218T99-P160 HydrophobicContact CG2-CG 4.07Å; P160-R162 PolarHBondContact O-N 2.78Å; P160-Y218 PolarHBondContact O-OH 2.9Å; P160-Y218 VanDerWaalsContact O-OH 3.11Å
161P94.5Very high95Very high86 Ų8654.1 Ų54.156%0.55828%0.277SS*.PPolyproline II helixtrans-52.2135.1169.7-24.333.5000110.8V163 K164 G165P161-V163 VanDerWaalsContact C-N 3.29Å; P161-V163 PolarHBondContact O-N 2.93Å; P161-V163 VanDerWaalsContact O-N 3.1Å; P161-K164 HydrophobicContact CG-CD 4.4Å; P161-K164 WeakPolarHBondContact O-CA 3.41Å; P161-K164 WeakPolarHBondContact O-CB 3.49Å; P161-K164 PolarHBondContact O-N 2.83Å; P161-G165 PolarHBondContact O-N 3.28Å
162R96.7Very high95.2Very high147 Ų14756.6 Ų56.656%0.55529%0.288SS*.Hα-helixtrans-47.2-46.4-171-71.9-178.1173172.1-4.2114.4P160 K164 G165 L166 E222P160-R162 PolarHBondContact O-N 2.78Å; R162-K164 VanDerWaalsContact C-N 3.3Å; R162-K164 PolarHBondContact O-N 2.92Å; R162-G165 PolarHBondContact O-N 3.35Å; R162-L166 VanDerWaalsContact O-CB 3.32Å; R162-L166 WeakPolarHBondContact O-CB 3.43Å; R162-L166 VanDerWaalsContact O-CG 3.26Å; R162-L166 WeakPolarHBondContact O-CG 3.41Å; R162-L166 PolarHBondContact O-N 2.85Å; R162-E222 IonicContact CZ-OE2 3.21Å; R162-E222 IonicContact NE-OE1 3.44Å; R162-E222 PolarHBondContact NE-OE1 3.46Å; R162-E222 IonicContact NE-OE2 2.75Å; R162-E222 PolarHBondContact NE-OE2 3.27Å; R162-E222 IonicContact NH2-OE2 2.8Å; R162-E222 PolarHBondContact NH2-OE2 2.84Å
163V97.7Very high95.4Very high116 Ų11657.1 Ų57.170%0.70329%0.293SS*.Hα-helixtrans-57.8-44.2178.4177.50000111.2P161 T167P161-V163 VanDerWaalsContact C-N 3.29Å; P161-V163 PolarHBondContact O-N 2.93Å; P161-V163 VanDerWaalsContact O-N 3.1Å; V163-T167 WeakPolarHBondContact O-CB 3.27Å; V163-T167 PolarHBondContact O-N 3.48Å; V163-T167 PolarHBondContact O-OG1 3.28Å
164K97.7Very high95.7Very high144 Ų14456.3 Ų56.363%0.62629%0.288SS*.Hα-helixtrans-68.1-48.1178.3-66.7-173.8178.8-178.20110.7P161 R162 T167 T168P161-K164 HydrophobicContact CG-CD 4.4Å; P161-K164 WeakPolarHBondContact O-CA 3.41Å; P161-K164 WeakPolarHBondContact O-CB 3.49Å; P161-K164 PolarHBondContact O-N 2.83Å; R162-K164 VanDerWaalsContact C-N 3.3Å; R162-K164 PolarHBondContact O-N 2.92Å; K164-T167 PolarHBondContact O-N 3.39Å; K164-T168 PolarHBondContact O-N 3.4Å; K164-T168 PolarHBondContact O-OG1 3.47Å
165G98.1Very high96Very high0 Ų059.9 Ų59.90%031%0.307CS..Hα-helixtrans-58.7-53.7179.800000112.8P161 R162 T167 T168 V169P161-G165 PolarHBondContact O-N 3.28Å; R162-G165 PolarHBondContact O-N 3.35Å; G165-T167 VanDerWaalsContact C-N 3.32Å; G165-T167 PolarHBondContact O-N 3Å; G165-T168 WeakPolarHBondContact O-CB 3.34Å; G165-T168 PolarHBondContact O-N 2.95Å; G165-T168 VanDerWaalsContact O-N 3.12Å; G165-V169 VanDerWaalsContact O-CG2 3.28Å; G165-V169 WeakPolarHBondContact O-CG2 3.4Å; G165-V169 PolarHBondContact O-N 3.32Å
166L98.6Very high96.5Very high47 Ų4760.7 Ų60.725%0.24631%0.31CS..Hα-helixtrans-60.8-39.9178.2-65.8170000112R162 V169 T170 N215 Y218 L219R162-L166 VanDerWaalsContact O-CB 3.32Å; R162-L166 WeakPolarHBondContact O-CB 3.43Å; R162-L166 VanDerWaalsContact O-CG 3.26Å; R162-L166 WeakPolarHBondContact O-CG 3.41Å; R162-L166 PolarHBondContact O-N 2.85Å; L166-V169 PolarHBondContact O-N 3.45Å; L166-T170 WeakPolarHBondContact O-CB 3.5Å; L166-T170 PolarHBondContact O-N 2.99Å; L166-T170 PolarHBondContact O-OG1 2.8Å; L166-N215 HydrophobicContact CD2-CB 4.02Å; L166-N215 WeakPolarHBondContact CD2-OD1 3.21Å; L166-N215 PolarHBondContact O-OD1 3.01Å; L166-Y218 HydrophobicContact CD2-CD1 3.53Å; L166-Y218 HydrophobicContact CD2-CE1 4.1Å; L166-Y218 HydrophobicContact CD2-CG 4.27Å; L166-Y218 HydrophobicContact CG-CD1 4.05Å; L166-Y218 HydrophobicContact CG-CE1 4.11Å; L166-L219 HydrophobicContact CD2-CD2 4.26Å; L166-L219 HydrophobicContact CD2-CG 4.22Å
167T98.6Very high96.9Very high79 Ų7961.4 Ų61.449%0.48531%0.312SS..Hα-helixtrans-61.6-44.2174.2-60.50000111.3V163 K164 G165 T171V163-T167 WeakPolarHBondContact O-CB 3.27Å; V163-T167 PolarHBondContact O-N 3.48Å; V163-T167 PolarHBondContact O-OG1 3.28Å; K164-T167 PolarHBondContact O-N 3.39Å; G165-T167 VanDerWaalsContact C-N 3.32Å; G165-T167 PolarHBondContact O-N 3Å; T167-T171 VanDerWaalsContact O-CB 3.31Å; T167-T171 WeakPolarHBondContact O-CB 3.32Å; T167-T171 PolarHBondContact O-N 2.75Å; T167-T171 PolarHBondContact O-OG1 2.84Å
168T98.6Very high97.2Very high67 Ų6765.8 Ų65.841%0.41133%0.334SS..Hα-helixtrans-63.3-48.6178.2-60.70000111.8T99 K164 G165 T170 T171 F172T99-T168 HydrophobicContact CG2-CG2 4.05Å; K164-T168 PolarHBondContact O-N 3.4Å; K164-T168 PolarHBondContact O-OG1 3.47Å; G165-T168 WeakPolarHBondContact O-CB 3.34Å; G165-T168 PolarHBondContact O-N 2.95Å; G165-T168 VanDerWaalsContact O-N 3.12Å; T168-T170 PolarHBondContact O-N 3.33Å; T168-T171 PolarHBondContact O-N 3.44Å; T168-F172 PolarHBondContact O-N 3.28Å
169V98.6Very high97.6Very high0 Ų061.3 Ų61.30%032%0.322CS..Hα-helixtrans-61.6-45.1178.8-179.40000110.9T99 P103 G165 L166 T171 F172 A173 V214 Y218T99-V169 WeakPolarHBondContact O-CG2 3.32Å; P103-V169 HydrophobicContact CG-CG2 4.31Å; G165-V169 VanDerWaalsContact O-CG2 3.28Å; G165-V169 WeakPolarHBondContact O-CG2 3.4Å; G165-V169 PolarHBondContact O-N 3.32Å; L166-V169 PolarHBondContact O-N 3.45Å; V169-T171 PolarHBondContact O-N 3.5Å; V169-F172 PolarHBondContact O-N 3.23Å; V169-A173 PolarHBondContact O-N 3.35Å; V169-V214 HydrophobicContact CG1-CB 4.16Å; V169-V214 HydrophobicContact CG1-CG1 3.71Å; V169-V214 HydrophobicContact CG1-CG2 3.59Å; V169-Y218 HydrophobicContact CG2-CD2 3.76Å; V169-Y218 HydrophobicContact CG2-CG 4.16Å
170T98.8Very high97.8Very high40 Ų4060.6 Ų60.625%0.24532%0.32CS..Hα-helixtrans-63.6-42.2178.2-59.10000111.8L166 T168 F172 A173 I174 I211 N215L166-T170 WeakPolarHBondContact O-CB 3.5Å; L166-T170 PolarHBondContact O-N 2.99Å; L166-T170 PolarHBondContact O-OG1 2.8Å; T168-T170 PolarHBondContact O-N 3.33Å; T170-F172 VanDerWaalsContact C-N 3.34Å; T170-F172 PolarHBondContact O-N 2.92Å; T170-A173 PolarHBondContact O-N 2.9Å; T170-I174 HydrophobicContact CG2-CD1 3.87Å; T170-I174 HydrophobicContact CG2-CG1 4.46Å; T170-I174 WeakPolarHBondContact O-CG1 3.3Å; T170-I174 PolarHBondContact O-N 2.92Å; T170-I211 HydrophobicContact CG2-CG2 4.15Å; T170-N215 PolarHBondContact OG1-ND2 3.33Å; T170-N215 PolarHBondContact OG1-OD1 2.93Å
171T98.7Very high97.9Very high70 Ų7062.7 Ų62.743%0.42933%0.33SS..Hα-helixtrans-61.6-44.3176.8-58.20000110.9T167 T168 V169 A173 I174 L175T167-T171 VanDerWaalsContact O-CB 3.31Å; T167-T171 WeakPolarHBondContact O-CB 3.32Å; T167-T171 PolarHBondContact O-N 2.75Å; T167-T171 PolarHBondContact O-OG1 2.84Å; T168-T171 PolarHBondContact O-N 3.44Å; V169-T171 PolarHBondContact O-N 3.5Å; T171-A173 PolarHBondContact O-N 3.48Å; T171-I174 PolarHBondContact O-N 3.4Å; T171-L175 HydrophobicContact CG2-CD1 4.02Å; T171-L175 HydrophobicContact CG2-CG 4.39Å; T171-L175 WeakPolarHBondContact O-CB 3.43Å; T171-L175 VanDerWaalsContact O-CG 3.25Å; T171-L175 WeakPolarHBondContact O-CG 3.39Å; T171-L175 PolarHBondContact O-N 3.5Å
172F98.5Very high98Very high52 Ų5260.6 Ų60.623%0.22832%0.319CS..Hα-helixtrans-59.8-46.1175.4172.6-94.4000111.9L41 I44 F100 V104 T168 V169 T170 I174 L175 Y176L41-F172 HydrophobicContact CD1-CE1 3.96Å; L41-F172 HydrophobicContact CD1-CZ 3.89Å; I44-F172 HydrophobicContact CG2-CE2 4.29Å; I44-F172 HydrophobicContact CG2-CZ 4.16Å; F100-F172 HydrophobicContact CD2-CD1 4.48Å; F100-F172 HydrophobicContact CD2-CD2 4.2Å; F100-F172 HydrophobicContact CD2-CE1 4.24Å; F100-F172 AromaticContact CD2-CE2 3.94Å; F100-F172 HydrophobicContact CD2-CE2 3.94Å; F100-F172 HydrophobicContact CD2-CG 4.47Å; F100-F172 AromaticContact CD2-CZ 3.98Å; F100-F172 HydrophobicContact CD2-CZ 3.98Å; F100-F172 HydrophobicContact CE2-CD2 4.28Å; F100-F172 HydrophobicContact CE2-CE1 4.11Å; F100-F172 AromaticContact CE2-CE2 3.56Å; F100-F172 HydrophobicContact CE2-CE2 3.56Å; F100-F172 AromaticContact CE2-CZ 3.48Å; F100-F172 HydrophobicContact CE2-CZ 3.48Å; F100-F172 VanDerWaalsContact CE2-CZ 3.48Å; V104-F172 HydrophobicContact CG1-CE1 4.17Å; V104-F172 HydrophobicContact CG2-CD1 3.88Å; V104-F172 HydrophobicContact CG2-CE1 3.58Å; V104-F172 HydrophobicContact CG2-CZ 4.4Å; T168-F172 PolarHBondContact O-N 3.28Å; V169-F172 PolarHBondContact O-N 3.23Å; T170-F172 VanDerWaalsContact C-N 3.34Å; T170-F172 PolarHBondContact O-N 2.92Å; F172-I174 PolarHBondContact O-N 3.36Å; F172-L175 PolarHBondContact O-N 2.92Å; F172-Y176 PolarHBondContact O-N 2.7Å
173A98.6Very high97.9Very high12 Ų1254 Ų5410%0.09930%0.295CS..Hα-helixtrans-59.8-47.7178.700000111.9V169 T170 T171 L175 Y176 E177 I211 V214V169-A173 PolarHBondContact O-N 3.35Å; T170-A173 PolarHBondContact O-N 2.9Å; T171-A173 PolarHBondContact O-N 3.48Å; A173-L175 PolarHBondContact O-N 2.99Å; A173-Y176 PolarHBondContact O-N 3.12Å; A173-E177 WeakPolarHBondContact O-CG 3.41Å; A173-E177 PolarHBondContact O-N 2.86Å; A173-I211 HydrophobicContact CB-CG1 3.92Å; A173-V214 HydrophobicContact CB-CG1 4.11Å
174I98.6Very high97.8Very high75 Ų7552.7 Ų52.739%0.38528%0.278SS..Hα-helixtrans-60.8-44.3176.8-68.3168.7000111.2T170 T171 F172 Y176 E177 I178 I211T170-I174 HydrophobicContact CG2-CD1 3.87Å; T170-I174 HydrophobicContact CG2-CG1 4.46Å; T170-I174 WeakPolarHBondContact O-CG1 3.3Å; T170-I174 PolarHBondContact O-N 2.92Å; T171-I174 PolarHBondContact O-N 3.4Å; F172-I174 PolarHBondContact O-N 3.36Å; I174-Y176 VanDerWaalsContact C-N 3.3Å; I174-Y176 PolarHBondContact O-N 3.04Å; I174-E177 PolarHBondContact O-N 2.97Å; I174-I178 HydrophobicContact CG2-CD1 3.87Å; I174-I178 HydrophobicContact CG2-CG1 4.43Å; I174-I178 VanDerWaalsContact O-CG1 3.28Å; I174-I178 WeakPolarHBondContact O-CG1 3.33Å; I174-I178 PolarHBondContact O-N 2.95Å; I174-I211 HydrophobicContact CG1-CD1 4.03Å
175L98.5Very high97.8Very high105 Ų10553.7 Ų53.755%0.5528%0.283SS..Hα-helixtrans-62-39178-73.1173.2000112T171 F172 A173 I178 L179T171-L175 HydrophobicContact CG2-CD1 4.02Å; T171-L175 HydrophobicContact CG2-CG 4.39Å; T171-L175 WeakPolarHBondContact O-CB 3.43Å; T171-L175 VanDerWaalsContact O-CG 3.25Å; T171-L175 WeakPolarHBondContact O-CG 3.39Å; T171-L175 PolarHBondContact O-N 3.5Å; F172-L175 PolarHBondContact O-N 2.92Å; A173-L175 PolarHBondContact O-N 2.99Å; L175-I178 PolarHBondContact O-N 3.27Å; L175-L179 PolarHBondContact O-N 3.03Å; L175-L179 VanDerWaalsContact O-N 3.09Å
176Y98.4Very high97.5Very high18 Ų1860.4 Ų60.47%0.07132%0.317CS..Hα-helixtrans-68.4-39.9176-176-107.3000112.1R39 L41 I44 F172 A173 I174 L179 L180 Y192R39-Y176 WeakPolarHBondContact O-CE2 3.38Å; R39-Y176 PolarHBondContact O-OH 2.87Å; L41-Y176 HydrophobicContact CB-CD1 4.34Å; L41-Y176 HydrophobicContact CB-CE1 3.62Å; L41-Y176 HydrophobicContact CB-CE2 4.09Å; L41-Y176 HydrophobicContact CD1-CD1 4.05Å; L41-Y176 HydrophobicContact CD1-CD2 4.15Å; L41-Y176 HydrophobicContact CD1-CE1 4.19Å; L41-Y176 HydrophobicContact CD1-CE2 4.31Å; L41-Y176 HydrophobicContact CD1-CG 4.04Å; L41-Y176 HydrophobicContact CD2-CD1 4.4Å; L41-Y176 HydrophobicContact CD2-CE1 4.25Å; L41-Y176 HydrophobicContact CG-CD1 4.5Å; L41-Y176 HydrophobicContact CG-CE1 4.23Å; L41-Y176 PolarHBondContact N-OH 3.32Å; I44-Y176 HydrophobicContact CD1-CD2 3.62Å; I44-Y176 HydrophobicContact CD1-CE2 3.67Å; F172-Y176 PolarHBondContact O-N 2.7Å; A173-Y176 PolarHBondContact O-N 3.12Å; I174-Y176 VanDerWaalsContact C-N 3.3Å; I174-Y176 PolarHBondContact O-N 3.04Å; Y176-L179 HydrophobicContact CE2-CD2 4.13Å; Y176-L179 WeakPolarHBondContact O-CA 3.24Å; Y176-L179 VanDerWaalsContact O-CB 3.3Å; Y176-L179 WeakPolarHBondContact O-CB 3.27Å; Y176-L179 PolarHBondContact O-N 3.41Å; Y176-L179 VanDerWaalsContact O-N 3.1Å; Y176-L180 HydrophobicContact CD1-CD1 4.22Å; Y176-L180 HydrophobicContact CD1-CG 4.38Å; Y176-L180 HydrophobicContact CE1-CD1 3.74Å; Y176-L180 HydrophobicContact CE1-CD2 4.06Å; Y176-L180 HydrophobicContact CE1-CG 3.87Å; Y176-L180 PolarHBondContact O-N 2.68Å; Y176-L180 WeakPolarHBondContact OH-CD2 3.28Å; Y176-Y192 HydrophobicContact CE1-CE2 4.44Å; Y176-Y192 WeakPolarHBondContact OH-CE2 3.2Å; Y176-Y192 PolarHBondContact OH-OH 3.11Å; Y176-Y192 VanDerWaalsContact OH-OH 3.08Å
177E98.2Very high97.2Very high26 Ų2660.6 Ų60.612%0.12132%0.32CS..Hα-helixtrans-64.9-38.8174.8-71.817717800112.5A173 I174 L179 L180 L181 F207A173-E177 WeakPolarHBondContact O-CG 3.41Å; A173-E177 PolarHBondContact O-N 2.86Å; I174-E177 PolarHBondContact O-N 2.97Å; E177-L179 PolarHBondContact O-N 3.01Å; E177-L180 WeakPolarHBondContact O-CB 3.32Å; E177-L180 PolarHBondContact O-N 3.44Å; E177-L180 VanDerWaalsContact O-N 3.11Å; E177-L181 WeakPolarHBondContact O-CG 3.47Å; E177-L181 PolarHBondContact O-N 2.76Å; E177-F207 HydrophobicContact CG-CD1 3.96Å; E177-F207 HydrophobicContact CG-CE1 4.44Å; E177-F207 HydrophobicContact CG-CG 4.28Å; E177-F207 VanDerWaalsContact OE1-CA 3.3Å; E177-F207 WeakPolarHBondContact OE1-CA 3.27Å; E177-F207 WeakPolarHBondContact OE1-CB 3.15Å; E177-F207 VanDerWaalsContact OE1-O 3.06Å
178I98Very high97Very high95 Ų9559.6 Ų59.649%0.48733%0.326SS..Hα-helixtrans-58.1-40.7170.7-70.3166.2000110.3I174 L175 L181 A182I174-I178 HydrophobicContact CG2-CD1 3.87Å; I174-I178 HydrophobicContact CG2-CG1 4.43Å; I174-I178 VanDerWaalsContact O-CG1 3.28Å; I174-I178 WeakPolarHBondContact O-CG1 3.33Å; I174-I178 PolarHBondContact O-N 2.95Å; L175-I178 PolarHBondContact O-N 3.27Å; I178-L181 PolarHBondContact O-N 2.92Å; I178-A182 VanDerWaalsContact O-CB 3.3Å; I178-A182 WeakPolarHBondContact O-CB 3.48Å; I178-A182 PolarHBondContact O-N 3.06Å
179L96.8Very high96.7Very high65 Ų6561 Ų6134%0.3432%0.324SS..Hα-helixtrans-63.2-40.5175.4-178.1152.5000111.9R39 L175 Y176 E177 A182 N183R39-L179 HydrophobicContact CB-CD2 4.2Å; R39-L179 WeakPolarHBondContact O-CD2 3.26Å; L175-L179 PolarHBondContact O-N 3.03Å; L175-L179 VanDerWaalsContact O-N 3.09Å; Y176-L179 HydrophobicContact CE2-CD2 4.13Å; Y176-L179 WeakPolarHBondContact O-CA 3.24Å; Y176-L179 VanDerWaalsContact O-CB 3.3Å; Y176-L179 WeakPolarHBondContact O-CB 3.27Å; Y176-L179 PolarHBondContact O-N 3.41Å; Y176-L179 VanDerWaalsContact O-N 3.1Å; E177-L179 PolarHBondContact O-N 3.01Å; L179-A182 PolarHBondContact O-N 3.4Å; L179-N183 WeakPolarHBondContact O-CB 3.23Å; L179-N183 PolarHBondContact O-N 3.32Å
180L96.8Very high96.5Very high8 Ų862.8 Ų62.84%0.04233%0.331CS..Hα-helixtrans-62.4-45.4175.6-67.8177.9000112Y176 E177 N183 Y184 M191 Y192 L195 F207Y176-L180 HydrophobicContact CD1-CD1 4.22Å; Y176-L180 HydrophobicContact CD1-CG 4.38Å; Y176-L180 HydrophobicContact CE1-CD1 3.74Å; Y176-L180 HydrophobicContact CE1-CD2 4.06Å; Y176-L180 HydrophobicContact CE1-CG 3.87Å; Y176-L180 PolarHBondContact O-N 2.68Å; Y176-L180 WeakPolarHBondContact OH-CD2 3.28Å; E177-L180 WeakPolarHBondContact O-CB 3.32Å; E177-L180 PolarHBondContact O-N 3.44Å; E177-L180 VanDerWaalsContact O-N 3.11Å; L180-N183 PolarHBondContact O-N 2.99Å; L180-Y184 PolarHBondContact O-N 3.12Å; L180-Y184 VanDerWaalsContact O-N 3.08Å; L180-M191 HydrophobicContact CD2-CB 4.2Å; L180-M191 HydrophobicContact CD2-CG 3.86Å; L180-M191 HydrophobicContact CD2-SD 3.88Å; L180-Y192 HydrophobicContact CD1-CE2 4.39Å; L180-Y192 HydrophobicContact CD2-CD2 4.11Å; L180-Y192 HydrophobicContact CD2-CE2 3.81Å; L180-L195 HydrophobicContact CD1-CD1 4.25Å; L180-F207 HydrophobicContact CD1-CE1 4.14Å
181L97.2Very high96.2Very high65 Ų6561.8 Ų61.834%0.3432%0.324SS..Hα-helixtrans-62-47.7176-67.9173.6000110.9E177 I178 N183 Y184 F185 W190 F207E177-L181 WeakPolarHBondContact O-CG 3.47Å; E177-L181 PolarHBondContact O-N 2.76Å; I178-L181 PolarHBondContact O-N 2.92Å; L181-N183 VanDerWaalsContact C-N 3.31Å; L181-N183 PolarHBondContact O-N 3.34Å; L181-Y184 WeakPolarHBondContact O-CB 3.14Å; L181-Y184 PolarHBondContact O-N 2.9Å; L181-Y184 VanDerWaalsContact O-N 3.11Å; L181-F185 HydrophobicContact CB-CE2 4.38Å; L181-F185 WeakPolarHBondContact O-CD2 3.4Å; L181-F185 PolarHBondContact O-N 2.96Å; L181-W190 HydrophobicContact CD2-CH2 3.92Å; L181-W190 HydrophobicContact CD2-CZ3 4.2Å; L181-F207 HydrophobicContact CD2-CE2 4.12Å; L181-F207 HydrophobicContact CD2-CZ 4.45Å
182A96.7Very high96Very high41 Ų4160.1 Ų60.134%0.33931%0.31SS..Hα-helixtrans-58.9-4217700000111.7I178 L179 Y184 F185 I186I178-A182 VanDerWaalsContact O-CB 3.3Å; I178-A182 WeakPolarHBondContact O-CB 3.48Å; I178-A182 PolarHBondContact O-N 3.06Å; L179-A182 PolarHBondContact O-N 3.4Å; A182-Y184 VanDerWaalsContact C-N 3.34Å; A182-Y184 PolarHBondContact O-N 2.86Å; A182-F185 PolarHBondContact O-N 2.94Å; A182-I186 WeakPolarHBondContact O-CB 3.31Å; A182-I186 WeakPolarHBondContact O-CD1 3.36Å; A182-I186 VanDerWaalsContact O-CG1 3.23Å; A182-I186 WeakPolarHBondContact O-CG1 3.25Å; A182-I186 PolarHBondContact O-N 2.97Å
183N94.4Very high95.9Very high10 Ų1059 Ų595%0.05331%0.312CS..Hα-helixtrans-58.6-45.8174.3179.888.9000111.4R39 L179 L180 L181 I186 T187 Y189 M191R39-N183 WeakPolarHBondContact CD-OD1 3.43Å; R39-N183 PolarHBondContact NH1-OD1 2.98Å; L179-N183 WeakPolarHBondContact O-CB 3.23Å; L179-N183 PolarHBondContact O-N 3.32Å; L180-N183 PolarHBondContact O-N 2.99Å; L181-N183 VanDerWaalsContact C-N 3.31Å; L181-N183 PolarHBondContact O-N 3.34Å; N183-I186 PolarHBondContact O-N 2.52Å; N183-T187 PolarHBondContact ND2-OG1 3.39Å; N183-T187 WeakPolarHBondContact O-CB 3.37Å; N183-T187 WeakPolarHBondContact O-CG2 3.49Å; N183-T187 PolarHBondContact O-N 3.34Å; N183-T187 PolarHBondContact O-OG1 3.42Å; N183-Y189 PolarHBondContact ND2-O 3.31Å; N183-M191 HydrophobicContact CB-CG 4.14Å; N183-M191 HydrophobicContact CB-SD 3.88Å; N183-M191 WeakPolarHBondContact ND2-CG 3.28Å
184Y95.6Very high95.9Very high87 Ų8759.4 Ų59.434%0.34131%0.313SS..Hα-helixtrans-60.1-46.2177.6176.6-98.8000111.7L180 L181 A182 I186 T187 G188 W190L180-Y184 PolarHBondContact O-N 3.12Å; L180-Y184 VanDerWaalsContact O-N 3.08Å; L181-Y184 WeakPolarHBondContact O-CB 3.14Å; L181-Y184 PolarHBondContact O-N 2.9Å; L181-Y184 VanDerWaalsContact O-N 3.11Å; A182-Y184 VanDerWaalsContact C-N 3.34Å; A182-Y184 PolarHBondContact O-N 2.86Å; Y184-I186 VanDerWaalsContact C-N 3.3Å; Y184-I186 PolarHBondContact O-N 3.38Å; Y184-T187 PolarHBondContact O-N 3.45Å; Y184-G188 VanDerWaalsContact O-CA 3.31Å; Y184-G188 WeakPolarHBondContact O-CA 3.42Å; Y184-G188 PolarHBondContact O-N 2.87Å; Y184-W190 HydrophobicContact CD1-CH2 4.23Å; Y184-W190 AromaticContact CD1-CZ2 3.98Å; Y184-W190 HydrophobicContact CD1-CZ2 3.98Å; Y184-W190 AromaticContact CD2-CD1 3.91Å; Y184-W190 AromaticContact CD2-CD2 3.67Å; Y184-W190 HydrophobicContact CD2-CD2 3.67Å; Y184-W190 AromaticContact CD2-CE2 3.38Å; Y184-W190 HydrophobicContact CD2-CE3 4.25Å; Y184-W190 AromaticContact CD2-CG 3.98Å; Y184-W190 HydrophobicContact CD2-CG 3.98Å; Y184-W190 HydrophobicContact CD2-CH2 4.34Å; Y184-W190 AromaticContact CD2-CZ2 3.75Å; Y184-W190 HydrophobicContact CD2-CZ2 3.75Å; Y184-W190 AromaticContact CD2-NE1 3.53Å; Y184-W190 HydrophobicContact CE1-CZ2 4.27Å; Y184-W190 AromaticContact CE2-CD1 3.94Å; Y184-W190 HydrophobicContact CE2-CD2 4.33Å; Y184-W190 AromaticContact CE2-CE2 3.68Å; Y184-W190 HydrophobicContact CE2-CG 4.46Å; Y184-W190 HydrophobicContact CE2-CZ2 4.05Å; Y184-W190 AromaticContact CE2-NE1 3.39Å; Y184-W190 HydrophobicContact CG-CD2 4.13Å; Y184-W190 AromaticContact CG-CE2 3.82Å; Y184-W190 HydrophobicContact CG-CE3 4.29Å; Y184-W190 AromaticContact CG-CH2 3.92Å; Y184-W190 HydrophobicContact CG-CH2 3.92Å; Y184-W190 AromaticContact CG-CZ2 3.71Å; Y184-W190 HydrophobicContact CG-CZ2 3.71Å; Y184-W190 HydrophobicContact CG-CZ3 4.2Å
185F96.5Very high95.8Very high165 Ų16555.8 Ų55.872%0.72429%0.294SS*.Hα-helixtrans-64.8-31.9178.8-73.4-64.7000113.6L181 A182L181-F185 HydrophobicContact CB-CE2 4.38Å; L181-F185 WeakPolarHBondContact O-CD2 3.4Å; L181-F185 PolarHBondContact O-N 2.96Å; A182-F185 PolarHBondContact O-N 2.94Å
186I93.5Very high95.7Very high142 Ų14254.4 Ų54.473%0.72829%0.293SS*.Hα-helixtrans-80.8-39.8179.6-67.7165.4000111.7A182 N183 Y184A182-I186 WeakPolarHBondContact O-CB 3.31Å; A182-I186 WeakPolarHBondContact O-CD1 3.36Å; A182-I186 VanDerWaalsContact O-CG1 3.23Å; A182-I186 WeakPolarHBondContact O-CG1 3.25Å; A182-I186 PolarHBondContact O-N 2.97Å; N183-I186 PolarHBondContact O-N 2.52Å; Y184-I186 VanDerWaalsContact C-N 3.3Å; Y184-I186 PolarHBondContact O-N 3.38Å
187T91.2Very high95.7Very high50 Ų5057 Ų5731%0.30732%0.318SS..Hα-helixtrans-107.8-17.5-166.967.30000114.4N183 Y184 Y189N183-T187 PolarHBondContact ND2-OG1 3.39Å; N183-T187 WeakPolarHBondContact O-CB 3.37Å; N183-T187 WeakPolarHBondContact O-CG2 3.49Å; N183-T187 PolarHBondContact O-N 3.34Å; N183-T187 PolarHBondContact O-OG1 3.42Å; Y184-T187 PolarHBondContact O-N 3.45Å; T187-Y189 VanDerWaalsContact C-N 3.26Å; T187-Y189 HydrophobicContact CG2-CE1 4.14Å; T187-Y189 WeakPolarHBondContact O-CD1 3.3Å; T187-Y189 PolarHBondContact O-N 2.99Å; T187-Y189 PolarHBondContact OG1-O 3.45Å
188G93.7Very high95.6Very high58 Ų5858.2 Ų58.260%0.59833%0.325SS*.SBendtrans77.53.5-176.800000114.9Y184Y184-G188 VanDerWaalsContact O-CA 3.31Å; Y184-G188 WeakPolarHBondContact O-CA 3.42Å; Y184-G188 PolarHBondContact O-N 2.87Å
189Y93Very high95.6Very high97 Ų9758.5 Ų58.538%0.3833%0.328SS..SBendtrans-133.9154178.565.5-97.2000112.5R39 N183 T187R39-Y189 PolarHBondContact NH1-OH 3.1Å; N183-Y189 PolarHBondContact ND2-O 3.31Å; T187-Y189 VanDerWaalsContact C-N 3.26Å; T187-Y189 HydrophobicContact CG2-CE1 4.14Å; T187-Y189 WeakPolarHBondContact O-CD1 3.3Å; T187-Y189 PolarHBondContact O-N 2.99Å; T187-Y189 PolarHBondContact OG1-O 3.45Å
190W95Very high95.6Very high37 Ų3762.3 Ų62.314%0.1435%0.348CS..  trans-82.7145.2175-66104.3000111.5L181 Y184 Y192 L195 K203L181-W190 HydrophobicContact CD2-CH2 3.92Å; L181-W190 HydrophobicContact CD2-CZ3 4.2Å; Y184-W190 HydrophobicContact CD1-CH2 4.23Å; Y184-W190 AromaticContact CD1-CZ2 3.98Å; Y184-W190 HydrophobicContact CD1-CZ2 3.98Å; Y184-W190 AromaticContact CD2-CD1 3.91Å; Y184-W190 AromaticContact CD2-CD2 3.67Å; Y184-W190 HydrophobicContact CD2-CD2 3.67Å; Y184-W190 AromaticContact CD2-CE2 3.38Å; Y184-W190 HydrophobicContact CD2-CE3 4.25Å; Y184-W190 AromaticContact CD2-CG 3.98Å; Y184-W190 HydrophobicContact CD2-CG 3.98Å; Y184-W190 HydrophobicContact CD2-CH2 4.34Å; Y184-W190 AromaticContact CD2-CZ2 3.75Å; Y184-W190 HydrophobicContact CD2-CZ2 3.75Å; Y184-W190 AromaticContact CD2-NE1 3.53Å; Y184-W190 HydrophobicContact CE1-CZ2 4.27Å; Y184-W190 AromaticContact CE2-CD1 3.94Å; Y184-W190 HydrophobicContact CE2-CD2 4.33Å; Y184-W190 AromaticContact CE2-CE2 3.68Å; Y184-W190 HydrophobicContact CE2-CG 4.46Å; Y184-W190 HydrophobicContact CE2-CZ2 4.05Å; Y184-W190 AromaticContact CE2-NE1 3.39Å; Y184-W190 HydrophobicContact CG-CD2 4.13Å; Y184-W190 AromaticContact CG-CE2 3.82Å; Y184-W190 HydrophobicContact CG-CE3 4.29Å; Y184-W190 AromaticContact CG-CH2 3.92Å; Y184-W190 HydrophobicContact CG-CH2 3.92Å; Y184-W190 AromaticContact CG-CZ2 3.71Å; Y184-W190 HydrophobicContact CG-CZ2 3.71Å; Y184-W190 HydrophobicContact CG-CZ3 4.2Å; W190-Y192 VanDerWaalsContact C-N 3.33Å; W190-L195 HydrophobicContact CB-CB 3.9Å; W190-L195 HydrophobicContact CD2-CB 3.7Å; W190-L195 HydrophobicContact CD2-CD1 4.32Å; W190-L195 HydrophobicContact CE3-CB 3.82Å; W190-L195 HydrophobicContact CE3-CD1 3.57Å; W190-L195 HydrophobicContact CE3-CG 4.32Å; W190-L195 HydrophobicContact CG-CB 3.72Å; W190-L195 HydrophobicContact CZ3-CD1 4.08Å; W190-K203 HydrophobicContact CH2-CD 4.26Å; W190-K203 HydrophobicContact CZ2-CD 3.84Å
191M92.2Very high95.7Very high19 Ų1966.2 Ų66.29%0.09437%0.372CS..SBendtrans-72.1-30.9179.3-43.8-149.872.900112.7R39 F40 L180 N183R39-M191 HydrophobicContact CB-CE 3.16Å; R39-M191 HydrophobicContact CB-SD 3.52Å; R39-M191 VanDerWaalsContact CB-SD 3.52Å; R39-M191 HydrophobicContact CG-CE 4.13Å; R39-M191 VanDerWaalsContact O-SD 3.37Å; F40-M191 HydrophobicContact CD1-CB 4.4Å; F40-M191 HydrophobicContact CD2-CE 4.38Å; F40-M191 HydrophobicContact CE1-CB 4Å; F40-M191 HydrophobicContact CE1-CE 4.28Å; F40-M191 WeakPolarHBondContact CE1-O 3.43Å; F40-M191 HydrophobicContact CE2-CE 4.05Å; F40-M191 HydrophobicContact CZ-CE 4Å; L180-M191 HydrophobicContact CD2-CB 4.2Å; L180-M191 HydrophobicContact CD2-CG 3.86Å; L180-M191 HydrophobicContact CD2-SD 3.88Å; N183-M191 HydrophobicContact CB-CG 4.14Å; N183-M191 HydrophobicContact CB-SD 3.88Å; N183-M191 WeakPolarHBondContact ND2-CG 3.28Å
192Y95.4Very high95.7Very high36 Ų3663.7 Ų63.714%0.14136%0.362CS..SBendtrans-118133.6-178-59.6-69.7000109.5F40 L41 Y176 L180 W190 I194 L195F40-Y192 AromaticContact CD1-CE1 3.96Å; F40-Y192 HydrophobicContact CD1-CE1 3.96Å; L41-Y192 PolarHBondContact N-OH 3.34Å; Y176-Y192 HydrophobicContact CE1-CE2 4.44Å; Y176-Y192 WeakPolarHBondContact OH-CE2 3.2Å; Y176-Y192 PolarHBondContact OH-OH 3.11Å; Y176-Y192 VanDerWaalsContact OH-OH 3.08Å; L180-Y192 HydrophobicContact CD1-CE2 4.39Å; L180-Y192 HydrophobicContact CD2-CD2 4.11Å; L180-Y192 HydrophobicContact CD2-CE2 3.81Å; W190-Y192 VanDerWaalsContact C-N 3.33Å; Y192-I194 PolarHBondContact O-N 3.34Å; Y192-L195 HydrophobicContact CD2-CD1 4.47Å; Y192-L195 PolarHBondContact O-N 3.26Å
193G96.3Very high95.8Very high27 Ų2763.1 Ų63.128%0.27835%0.352SS..Hα-helixtrans-56.8-34.1179.700000113.2L122 L195 S196 A197L122-G193 CarbonylContact O-C 3.59Å; L122-G193 WeakPolarHBondContact O-CA 3.41Å; L122-G193 PolarHBondContact O-N 3.4Å; G193-L195 PolarHBondContact O-N 3.24Å; G193-S196 WeakPolarHBondContact O-CA 3.22Å; G193-S196 WeakPolarHBondContact O-CB 3.47Å; G193-S196 PolarHBondContact O-N 2.78Å; G193-A197 PolarHBondContact O-N 3.28Å
194I97.5Very high96Very high21 Ų2165.4 Ų65.411%0.10837%0.372CS..Hα-helixtrans-55.8-38175.6-172.158.5000112.8L115 L122 Y192 S196 A197 L198 F206L115-I194 HydrophobicContact CD1-CG2 4.45Å; L115-I194 HydrophobicContact CD2-CD1 4.36Å; L115-I194 HydrophobicContact CD2-CG1 4.37Å; L122-I194 HydrophobicContact CB-CB 4.21Å; L122-I194 HydrophobicContact CD1-CD1 4.28Å; L122-I194 HydrophobicContact CD2-CB 4.38Å; L122-I194 HydrophobicContact CD2-CD1 4.05Å; L122-I194 PolarHBondContact O-N 3.05Å; Y192-I194 PolarHBondContact O-N 3.34Å; I194-S196 VanDerWaalsContact C-N 3.35Å; I194-A197 PolarHBondContact O-N 3.14Å; I194-L198 HydrophobicContact CD1-CD1 4Å; I194-L198 HydrophobicContact CD1-CG 4.16Å; I194-L198 HydrophobicContact CG1-CD1 3.89Å; I194-L198 HydrophobicContact CG1-CG 4.46Å; I194-L198 VanDerWaalsContact O-CG 3.25Å; I194-L198 WeakPolarHBondContact O-CG 3.03Å; I194-L198 PolarHBondContact O-N 3.35Å; I194-F206 HydrophobicContact CG1-CD2 4.14Å; I194-F206 HydrophobicContact CG1-CE2 3.96Å; I194-F206 HydrophobicContact CG1-CZ 4.4Å; I194-F206 HydrophobicContact CG2-CE1 4.16Å; I194-F206 HydrophobicContact CG2-CE2 4.28Å; I194-F206 HydrophobicContact CG2-CZ 3.88Å
195L97.5Very high96.1Very high0 Ų066.4 Ų66.40%038%0.383CS..Hα-helixtrans-72.5-32.1178.3-61178.9000111L180 W190 Y192 G193 K203 F206 F207L180-L195 HydrophobicContact CD1-CD1 4.25Å; W190-L195 HydrophobicContact CB-CB 3.9Å; W190-L195 HydrophobicContact CD2-CB 3.7Å; W190-L195 HydrophobicContact CD2-CD1 4.32Å; W190-L195 HydrophobicContact CE3-CB 3.82Å; W190-L195 HydrophobicContact CE3-CD1 3.57Å; W190-L195 HydrophobicContact CE3-CG 4.32Å; W190-L195 HydrophobicContact CG-CB 3.72Å; W190-L195 HydrophobicContact CZ3-CD1 4.08Å; Y192-L195 HydrophobicContact CD2-CD1 4.47Å; Y192-L195 PolarHBondContact O-N 3.26Å; G193-L195 PolarHBondContact O-N 3.24Å; L195-K203 HydrophobicContact CD2-CG 4.39Å; L195-K203 WeakPolarHBondContact O-CE 3.23Å; L195-K203 PolarHBondContact O-NZ 3.48Å; L195-F206 HydrophobicContact CD2-CD1 3.76Å; L195-F206 HydrophobicContact CD2-CE1 4.21Å; L195-F207 HydrophobicContact CD1-CE1 4.12Å; L195-F207 HydrophobicContact CD1-CZ 4.26Å; L195-F207 HydrophobicContact CD2-CE1 3.73Å; L195-F207 HydrophobicContact CD2-CZ 4.04Å
196S96.5Very high96.2Very high75 Ų7560.2 Ų60.252%0.52436%0.356SS..Hα-helixtrans-68.4-35.7172-63.20000112.4G193 I194G193-S196 WeakPolarHBondContact O-CA 3.22Å; G193-S196 WeakPolarHBondContact O-CB 3.47Å; G193-S196 PolarHBondContact O-N 2.78Å; I194-S196 VanDerWaalsContact C-N 3.35Å
197A97Very high96.4Very high72 Ų7254.8 Ų54.860%0.59533%0.327SS*.Hα-helixtrans-75.1-25.5-176.500000114.1L122 G193 I194L122-A197 HydrophobicContact CD2-CB 4.11Å; G193-A197 PolarHBondContact O-N 3.28Å; I194-A197 PolarHBondContact O-N 3.14Å
198L97.3Very high96.7Very high52 Ų5257.3 Ų57.327%0.27234%0.338SS..SBendtrans-88.7151.2-177.7-66.5170.5000112.1I194 K203 F206I194-L198 HydrophobicContact CD1-CD1 4Å; I194-L198 HydrophobicContact CD1-CG 4.16Å; I194-L198 HydrophobicContact CG1-CD1 3.89Å; I194-L198 HydrophobicContact CG1-CG 4.46Å; I194-L198 VanDerWaalsContact O-CG 3.25Å; I194-L198 WeakPolarHBondContact O-CG 3.03Å; I194-L198 PolarHBondContact O-N 3.35Å; L198-K203 HydrophobicContact CB-CG 4.14Å; L198-K203 PolarHBondContact O-NZ 3.19Å; L198-F206 HydrophobicContact CD1-CB 3.93Å; L198-F206 HydrophobicContact CD1-CD2 4.5Å; L198-F206 HydrophobicContact CD1-CG 4.33Å
199D97.4Very high97Very high102 Ų10259.4 Ų59.455%0.54533%0.331SS..  trans-76.1-174.8166.273.8-29.8000111.1T201 G202 K203D199-T201 VanDerWaalsContact C-N 3.33Å; D199-T201 PolarHBondContact O-N 2.93Å; D199-G202 PolarHBondContact O-N 3.1Å; D199-G202 WeakPolarHBondContact OD1-CA 3.45Å; D199-G202 PolarHBondContact OD1-N 3.14Å; D199-K203 VanDerWaalsContact O-CG 3.32Å; D199-K203 WeakPolarHBondContact O-CG 3.22Å; D199-K203 PolarHBondContact O-N 3.37Å
200L96.9Very high97.2Very high145 Ų14555.5 Ų55.576%0.75932%0.319SS*.Hα-helixtrans-61.9-42.2-179.3-17960.7000111.9K203 A204L200-K203 PolarHBondContact O-N 3.09Å; L200-A204 PolarHBondContact O-N 3.49Å; L200-A204 VanDerWaalsContact O-N 3.1Å
201T98.1Very high97.4Very high90 Ų9055.2 Ų55.255%0.55232%0.319SS*.Hα-helixtrans-64.5-46.4178.2-55.40000110.8D199 K203 A204 L205D199-T201 VanDerWaalsContact C-N 3.33Å; D199-T201 PolarHBondContact O-N 2.93Å; T201-K203 PolarHBondContact O-N 2.66Å; T201-A204 PolarHBondContact O-N 2.97Å; T201-L205 HydrophobicContact CG2-CD1 4.25Å; T201-L205 WeakPolarHBondContact O-CG 3.49Å; T201-L205 PolarHBondContact O-N 2.83Å
202G98.2Very high97.7Very high12 Ų1257.6 Ų57.612%0.12434%0.335CS..Hα-helixtrans-59.5-43.117700000112.6D199 A204 L205 F206D199-G202 PolarHBondContact O-N 3.1Å; D199-G202 WeakPolarHBondContact OD1-CA 3.45Å; D199-G202 PolarHBondContact OD1-N 3.14Å; G202-A204 PolarHBondContact O-N 3.34Å; G202-L205 PolarHBondContact O-N 3.01Å; G202-F206 WeakPolarHBondContact O-CB 3.47Å; G202-F206 PolarHBondContact O-N 2.92Å
203K98.1Very high97.9Very high29 Ų2957.5 Ų57.513%0.12634%0.338CS..Hα-helixtrans-59.7-46.3174.4-73.1174176.169.70112.1W190 L195 L198 D199 L200 T201 L205 F206 F207W190-K203 HydrophobicContact CH2-CD 4.26Å; W190-K203 HydrophobicContact CZ2-CD 3.84Å; L195-K203 HydrophobicContact CD2-CG 4.39Å; L195-K203 WeakPolarHBondContact O-CE 3.23Å; L195-K203 PolarHBondContact O-NZ 3.48Å; L198-K203 HydrophobicContact CB-CG 4.14Å; L198-K203 PolarHBondContact O-NZ 3.19Å; D199-K203 VanDerWaalsContact O-CG 3.32Å; D199-K203 WeakPolarHBondContact O-CG 3.22Å; D199-K203 PolarHBondContact O-N 3.37Å; L200-K203 PolarHBondContact O-N 3.09Å; T201-K203 PolarHBondContact O-N 2.66Å; K203-L205 VanDerWaalsContact C-N 3.33Å; K203-L205 PolarHBondContact O-N 3.31Å; K203-F206 PolarHBondContact O-N 3.03Å; K203-F207 WeakPolarHBondContact O-CD2 3.26Å; K203-F207 WeakPolarHBondContact O-CG 3.2Å; K203-F207 PolarHBondContact O-N 3.49Å
204A98.2Very high98Very high58 Ų5856.3 Ų56.348%0.47933%0.325SS..Hα-helixtrans-62.2-41.317900000111.9L200 T201 G202 L208L200-A204 PolarHBondContact O-N 3.49Å; L200-A204 VanDerWaalsContact O-N 3.1Å; T201-A204 PolarHBondContact O-N 2.97Å; G202-A204 PolarHBondContact O-N 3.34Å; A204-L208 WeakPolarHBondContact O-CB 3.36Å; A204-L208 PolarHBondContact O-N 3Å
205L98.4Very high98Very high107 Ų10756.4 Ų56.456%0.5633%0.326SS*.Hα-helixtrans-66.2-38.1174.7-69.6175.4000112.3T201 G202 K203 L208 F209T201-L205 HydrophobicContact CG2-CD1 4.25Å; T201-L205 WeakPolarHBondContact O-CG 3.49Å; T201-L205 PolarHBondContact O-N 2.83Å; G202-L205 PolarHBondContact O-N 3.01Å; K203-L205 VanDerWaalsContact C-N 3.33Å; K203-L205 PolarHBondContact O-N 3.31Å; L205-L208 PolarHBondContact O-N 3.25Å; L205-F209 WeakPolarHBondContact O-CB 3.43Å; L205-F209 PolarHBondContact O-N 3.05Å
206F98.1Very high98.1Very high36 Ų3660.5 Ų60.516%0.15835%0.347CS..Hα-helixtrans-64.8-43177.4-176-96.3000112.2L115 I194 L195 L198 G202 K203 F209 A210L115-F206 HydrophobicContact CD1-CE2 4.37Å; L115-F206 HydrophobicContact CD1-CZ 4.31Å; I194-F206 HydrophobicContact CG1-CD2 4.14Å; I194-F206 HydrophobicContact CG1-CE2 3.96Å; I194-F206 HydrophobicContact CG1-CZ 4.4Å; I194-F206 HydrophobicContact CG2-CE1 4.16Å; I194-F206 HydrophobicContact CG2-CE2 4.28Å; I194-F206 HydrophobicContact CG2-CZ 3.88Å; L195-F206 HydrophobicContact CD2-CD1 3.76Å; L195-F206 HydrophobicContact CD2-CE1 4.21Å; L198-F206 HydrophobicContact CD1-CB 3.93Å; L198-F206 HydrophobicContact CD1-CD2 4.5Å; L198-F206 HydrophobicContact CD1-CG 4.33Å; G202-F206 WeakPolarHBondContact O-CB 3.47Å; G202-F206 PolarHBondContact O-N 2.92Å; K203-F206 PolarHBondContact O-N 3.03Å; F206-F209 WeakPolarHBondContact O-CB 3.47Å; F206-F209 PolarHBondContact O-N 3.26Å; F206-A210 PolarHBondContact O-N 2.88Å
207F98.3Very high98.2Very high27 Ų2758.1 Ų58.112%0.11833%0.328CS..Hα-helixtrans-62.6-48.8173.6-67.7-26.3000111.8E177 L180 L181 L195 K203 F209 A210 I211E177-F207 HydrophobicContact CG-CD1 3.96Å; E177-F207 HydrophobicContact CG-CE1 4.44Å; E177-F207 HydrophobicContact CG-CG 4.28Å; E177-F207 VanDerWaalsContact OE1-CA 3.3Å; E177-F207 WeakPolarHBondContact OE1-CA 3.27Å; E177-F207 WeakPolarHBondContact OE1-CB 3.15Å; E177-F207 VanDerWaalsContact OE1-O 3.06Å; L180-F207 HydrophobicContact CD1-CE1 4.14Å; L181-F207 HydrophobicContact CD2-CE2 4.12Å; L181-F207 HydrophobicContact CD2-CZ 4.45Å; L195-F207 HydrophobicContact CD1-CE1 4.12Å; L195-F207 HydrophobicContact CD1-CZ 4.26Å; L195-F207 HydrophobicContact CD2-CE1 3.73Å; L195-F207 HydrophobicContact CD2-CZ 4.04Å; K203-F207 WeakPolarHBondContact O-CD2 3.26Å; K203-F207 WeakPolarHBondContact O-CG 3.2Å; K203-F207 PolarHBondContact O-N 3.49Å; F207-F209 VanDerWaalsContact C-N 3.28Å; F207-F209 PolarHBondContact O-N 2.93Å; F207-A210 PolarHBondContact O-N 2.95Å; F207-A210 VanDerWaalsContact O-N 3.15Å; F207-I211 PolarHBondContact O-N 3.46Å
208L98.5Very high98.3Very high104 Ų10454.7 Ų54.755%0.54530%0.3SS..Hα-helixtrans-57-43.7175179.761.3000111.8A204 L205 I211 V212A204-L208 WeakPolarHBondContact O-CB 3.36Å; A204-L208 PolarHBondContact O-N 3Å; L205-L208 PolarHBondContact O-N 3.25Å; L208-I211 PolarHBondContact O-N 2.88Å; L208-V212 HydrophobicContact CD1-CG2 4.32Å; L208-V212 VanDerWaalsContact O-CG2 3.3Å; L208-V212 WeakPolarHBondContact O-CG2 3.49Å; L208-V212 PolarHBondContact O-N 3.12Å
209F98.5Very high98.3Very high102 Ų10255.7 Ų55.745%0.44731%0.305SS..Hα-helixtrans-59.7-47.6176.3169.1-102.6000111.9L111 L205 F206 F207 I211 V212 V213L111-F209 HydrophobicContact CD2-CE1 3.71Å; L111-F209 HydrophobicContact CD2-CZ 4.48Å; L205-F209 WeakPolarHBondContact O-CB 3.43Å; L205-F209 PolarHBondContact O-N 3.05Å; F206-F209 WeakPolarHBondContact O-CB 3.47Å; F206-F209 PolarHBondContact O-N 3.26Å; F207-F209 VanDerWaalsContact C-N 3.28Å; F207-F209 PolarHBondContact O-N 2.93Å; F209-I211 VanDerWaalsContact C-N 3.35Å; F209-I211 PolarHBondContact O-N 3.22Å; F209-V212 PolarHBondContact O-N 2.92Å; F209-V213 HydrophobicContact CD1-CG2 4.36Å; F209-V213 HydrophobicContact CD2-CG2 3.81Å; F209-V213 HydrophobicContact CE1-CG2 4.03Å; F209-V213 HydrophobicContact CE2-CG2 3.42Å; F209-V213 VanDerWaalsContact CE2-CG2 3.42Å; F209-V213 HydrophobicContact CG-CG2 4.27Å; F209-V213 HydrophobicContact CZ-CG2 3.55Å; F209-V213 WeakPolarHBondContact O-CB 3.29Å; F209-V213 VanDerWaalsContact O-CG2 3.29Å; F209-V213 WeakPolarHBondContact O-CG2 3.42Å; F209-V213 PolarHBondContact O-N 3.44Å
210A98.4Very high98.3Very high15 Ų1555.7 Ų55.712%0.12431%0.305CS..Hα-helixtrans-60-43.6178.900000112F206 F207 V213 V214F206-A210 PolarHBondContact O-N 2.88Å; F207-A210 PolarHBondContact O-N 2.95Å; F207-A210 VanDerWaalsContact O-N 3.15Å; A210-V213 PolarHBondContact O-N 3.12Å; A210-V214 WeakPolarHBondContact O-CG1 3.45Å; A210-V214 PolarHBondContact O-N 3.38Å
211I98.7Very high98.4Very high30 Ų3048.8 Ų48.815%0.15427%0.269CS..Hα-helixtrans-61.2-45175.1-67.3172000111.3T170 A173 I174 F207 L208 F209 V214 N215T170-I211 HydrophobicContact CG2-CG2 4.15Å; A173-I211 HydrophobicContact CB-CG1 3.92Å; I174-I211 HydrophobicContact CG1-CD1 4.03Å; F207-I211 PolarHBondContact O-N 3.46Å; L208-I211 PolarHBondContact O-N 2.88Å; F209-I211 VanDerWaalsContact C-N 3.35Å; F209-I211 PolarHBondContact O-N 3.22Å; I211-V214 VanDerWaalsContact O-CG1 3.27Å; I211-V214 WeakPolarHBondContact O-CG1 3.21Å; I211-N215 PolarHBondContact O-N 3.3Å; I211-N215 PolarHBondContact O-ND2 2.98Å
212V98.7Very high98.3Very high70 Ų7045.6 Ų45.642%0.42425%0.247SC..Hα-helixtrans-64.4-47.8179.3169.50000110.7L208 F209 V214 N215 I216L208-V212 HydrophobicContact CD1-CG2 4.32Å; L208-V212 VanDerWaalsContact O-CG2 3.3Å; L208-V212 WeakPolarHBondContact O-CG2 3.49Å; L208-V212 PolarHBondContact O-N 3.12Å; F209-V212 PolarHBondContact O-N 2.92Å; V212-V214 PolarHBondContact O-N 3.38Å; V212-N215 PolarHBondContact O-N 3.17Å; V212-I216 HydrophobicContact CG1-CD1 3.81Å; V212-I216 HydrophobicContact CG1-CG1 4.44Å; V212-I216 WeakPolarHBondContact O-CG1 3.23Å; V212-I216 PolarHBondContact O-N 3.03Å
213V98.6Very high98.2Very high33 Ų3346.8 Ų46.820%0.226%0.26CS..Hα-helixtrans-62.4-43.9-178.6173.20000111.4L107 F209 A210 N215 I216 L217L107-V213 HydrophobicContact CD1-CB 4.07Å; L107-V213 HydrophobicContact CD1-CG1 3.57Å; F209-V213 HydrophobicContact CD1-CG2 4.36Å; F209-V213 HydrophobicContact CD2-CG2 3.81Å; F209-V213 HydrophobicContact CE1-CG2 4.03Å; F209-V213 HydrophobicContact CE2-CG2 3.42Å; F209-V213 VanDerWaalsContact CE2-CG2 3.42Å; F209-V213 HydrophobicContact CG-CG2 4.27Å; F209-V213 HydrophobicContact CZ-CG2 3.55Å; F209-V213 WeakPolarHBondContact O-CB 3.29Å; F209-V213 VanDerWaalsContact O-CG2 3.29Å; F209-V213 WeakPolarHBondContact O-CG2 3.42Å; F209-V213 PolarHBondContact O-N 3.44Å; A210-V213 PolarHBondContact O-N 3.12Å; V213-N215 VanDerWaalsContact C-N 3.28Å; V213-N215 PolarHBondContact O-N 2.87Å; V213-I216 WeakPolarHBondContact O-CB 3.5Å; V213-I216 PolarHBondContact O-N 3.22Å; V213-I216 VanDerWaalsContact O-N 3.17Å; V213-L217 HydrophobicContact CG1-CD1 3.97Å; V213-L217 HydrophobicContact CG1-CG 4.33Å; V213-L217 WeakPolarHBondContact O-CG 3.29Å; V213-L217 PolarHBondContact O-N 2.97Å
214V98.7Very high98.1Very high3 Ų348.4 Ų48.42%0.01827%0.265CS..Hα-helixtrans-65.4-33.1-179.974.20000112.4P103 V104 L107 V169 A173 A210 I211 V212 L217 Y218P103-V214 HydrophobicContact CB-CG2 3.98Å; V104-V214 HydrophobicContact CG2-CG2 4.5Å; L107-V214 HydrophobicContact CD1-CB 4.44Å; L107-V214 HydrophobicContact CD2-CB 4.05Å; L107-V214 HydrophobicContact CD2-CG2 4.1Å; V169-V214 HydrophobicContact CG1-CB 4.16Å; V169-V214 HydrophobicContact CG1-CG1 3.71Å; V169-V214 HydrophobicContact CG1-CG2 3.59Å; A173-V214 HydrophobicContact CB-CG1 4.11Å; A210-V214 WeakPolarHBondContact O-CG1 3.45Å; A210-V214 PolarHBondContact O-N 3.38Å; I211-V214 VanDerWaalsContact O-CG1 3.27Å; I211-V214 WeakPolarHBondContact O-CG1 3.21Å; V212-V214 PolarHBondContact O-N 3.38Å; V214-L217 PolarHBondContact O-N 3.42Å; V214-Y218 PolarHBondContact O-N 2.88Å
215N98.8Very high97.9Very high23 Ų2345.7 Ų45.712%0.12324%0.243CC..Hα-helixtrans-71.4-38173.1-82.2-80000112.1L166 T170 I211 V212 V213 L217 Y218 L219L166-N215 HydrophobicContact CD2-CB 4.02Å; L166-N215 WeakPolarHBondContact CD2-OD1 3.21Å; L166-N215 PolarHBondContact O-OD1 3.01Å; T170-N215 PolarHBondContact OG1-ND2 3.33Å; T170-N215 PolarHBondContact OG1-OD1 2.93Å; I211-N215 PolarHBondContact O-N 3.3Å; I211-N215 PolarHBondContact O-ND2 2.98Å; V212-N215 PolarHBondContact O-N 3.17Å; V213-N215 VanDerWaalsContact C-N 3.28Å; V213-N215 PolarHBondContact O-N 2.87Å; N215-L217 VanDerWaalsContact C-N 3.31Å; N215-L217 PolarHBondContact O-N 3.46Å; N215-Y218 WeakPolarHBondContact O-CB 3.42Å; N215-Y218 PolarHBondContact O-N 2.84Å; N215-L219 WeakPolarHBondContact O-CG 3.4Å; N215-L219 PolarHBondContact O-N 3.49Å; N215-L219 VanDerWaalsContact O-N 3.14Å
216I98.6Very high97.6Very high85 Ų8544.8 Ų44.844%0.43624%0.236SC..Hα-helixtrans-60.4-44171-69.6169.1000109.9V212 V213 Y218 L219 L220V212-I216 HydrophobicContact CG1-CD1 3.81Å; V212-I216 HydrophobicContact CG1-CG1 4.44Å; V212-I216 WeakPolarHBondContact O-CG1 3.23Å; V212-I216 PolarHBondContact O-N 3.03Å; V213-I216 WeakPolarHBondContact O-CB 3.5Å; V213-I216 PolarHBondContact O-N 3.22Å; V213-I216 VanDerWaalsContact O-N 3.17Å; I216-Y218 VanDerWaalsContact C-N 3.32Å; I216-Y218 PolarHBondContact O-N 3.43Å; I216-L219 PolarHBondContact O-N 3.28Å; I216-L219 VanDerWaalsContact O-N 3.12Å; I216-L220 HydrophobicContact CG2-CD1 3.88Å; I216-L220 HydrophobicContact CG2-CG 4.14Å; I216-L220 WeakPolarHBondContact O-CG 3.44Å; I216-L220 PolarHBondContact O-N 3.4Å
217L98.6Very high97.3Very high25 Ų2550 Ų5013%0.13126%0.264CS..Hα-helixtrans-63.1-35.9177.6-71.1169.6000112.7F102 P103 M106 L107 V213 V214 N215 L220 G221F102-L217 WeakPolarHBondContact CE1-O 3.32Å; P103-L217 HydrophobicContact CB-CB 4.14Å; P103-L217 WeakPolarHBondContact O-CD1 3.38Å; M106-L217 HydrophobicContact CB-CD1 4.04Å; M106-L217 HydrophobicContact CB-CD2 3.82Å; M106-L217 HydrophobicContact CB-CG 4.44Å; L107-L217 HydrophobicContact CB-CD1 3.73Å; L107-L217 HydrophobicContact CD1-CD1 4.1Å; V213-L217 HydrophobicContact CG1-CD1 3.97Å; V213-L217 HydrophobicContact CG1-CG 4.33Å; V213-L217 WeakPolarHBondContact O-CG 3.29Å; V213-L217 PolarHBondContact O-N 2.97Å; V214-L217 PolarHBondContact O-N 3.42Å; N215-L217 VanDerWaalsContact C-N 3.31Å; N215-L217 PolarHBondContact O-N 3.46Å; L217-L220 HydrophobicContact CD2-CD1 4.31Å; L217-L220 PolarHBondContact O-N 3.26Å; L217-G221 PolarHBondContact O-N 2.88Å
218Y98.6Very high96.9Very high0 Ų050.9 Ų50.90%027%0.27CS..Hα-helixtrans-58.7-48.6170.4170-88.6000111.4A98 T99 Y159 P160 L166 V169 V214 N215 I216 G221 E222A98-Y218 HydrophobicContact CB-CE2 4.35Å; A98-Y218 VanDerWaalsContact O-CD2 3.23Å; A98-Y218 WeakPolarHBondContact O-CD2 3.49Å; T99-Y218 HydrophobicContact CG2-CE2 4.39Å; Y159-Y218 AromaticContact CD1-CE2 3.97Å; Y159-Y218 HydrophobicContact CD1-CE2 3.97Å; Y159-Y218 HydrophobicContact CE1-CE2 4.3Å; P160-Y218 PolarHBondContact O-OH 2.9Å; P160-Y218 VanDerWaalsContact O-OH 3.11Å; L166-Y218 HydrophobicContact CD2-CD1 3.53Å; L166-Y218 HydrophobicContact CD2-CE1 4.1Å; L166-Y218 HydrophobicContact CD2-CG 4.27Å; L166-Y218 HydrophobicContact CG-CD1 4.05Å; L166-Y218 HydrophobicContact CG-CE1 4.11Å; V169-Y218 HydrophobicContact CG2-CD2 3.76Å; V169-Y218 HydrophobicContact CG2-CG 4.16Å; V214-Y218 PolarHBondContact O-N 2.88Å; N215-Y218 WeakPolarHBondContact O-CB 3.42Å; N215-Y218 PolarHBondContact O-N 2.84Å; I216-Y218 VanDerWaalsContact C-N 3.32Å; I216-Y218 PolarHBondContact O-N 3.43Å; Y218-G221 PolarHBondContact O-N 3.4Å; Y218-E222 PolarHBondContact O-N 3.33Å
219L98.5Very high96.5Very high73 Ų7347 Ų4738%0.38225%0.248SC..Hα-helixtrans-66.4-37.8179.4-65.4173.7000112.2L166 N215 I216 G221 E222 G223L166-L219 HydrophobicContact CD2-CD2 4.26Å; L166-L219 HydrophobicContact CD2-CG 4.22Å; N215-L219 WeakPolarHBondContact O-CG 3.4Å; N215-L219 PolarHBondContact O-N 3.49Å; N215-L219 VanDerWaalsContact O-N 3.14Å; I216-L219 PolarHBondContact O-N 3.28Å; I216-L219 VanDerWaalsContact O-N 3.12Å; L219-G221 VanDerWaalsContact C-N 3.33Å; L219-E222 PolarHBondContact O-N 3.47Å; L219-G223 PolarHBondContact O-N 2.91Å
220L98Very high95.7Very high103 Ų10342.9 Ų42.954%0.53923%0.234SC..Hα-helixtrans-64.4-39.1174.1-71.8175.6000111.4I216 L217 G223 Y224I216-L220 HydrophobicContact CG2-CD1 3.88Å; I216-L220 HydrophobicContact CG2-CG 4.14Å; I216-L220 WeakPolarHBondContact O-CG 3.44Å; I216-L220 PolarHBondContact O-N 3.4Å; L217-L220 HydrophobicContact CD2-CD1 4.31Å; L217-L220 PolarHBondContact O-N 3.26Å; L220-G223 PolarHBondContact O-N 2.76Å; L220-Y224 VanDerWaalsContact O-CB 3.28Å; L220-Y224 WeakPolarHBondContact O-CB 3.23Å; L220-Y224 PolarHBondContact O-N 3.29Å
221G97.8Very high94.6Very high0 Ų049.7 Ų49.70%026%0.263CS..Hα-helixtrans-63.1-45.4173.400000112.5Y159 L217 Y218 L219 G223 Y224 N225Y159-G221 VanDerWaalsContact CZ-C 3.44Å; Y159-G221 WeakPolarHBondContact OH-CA 3.26Å; Y159-G221 PolarHBondContact OH-O 2.99Å; L217-G221 PolarHBondContact O-N 2.88Å; Y218-G221 PolarHBondContact O-N 3.4Å; L219-G221 VanDerWaalsContact C-N 3.33Å; G221-G223 PolarHBondContact O-N 3.43Å; G221-Y224 PolarHBondContact O-N 2.85Å; G221-N225 WeakPolarHBondContact O-CB 3.29Å; G221-N225 PolarHBondContact O-N 3.33Å
222E96.4Very high93.3Very high22 Ų2251.3 Ų51.310%0.10327%0.27CS..Hα-helixtrans-58.7-48.5174.2-173.9-170.5-134.700110.6Y159 R162 Y218 L219 Y224 N225 Q226Y159-E222 HydrophobicContact CD1-CB 3.64Å; Y159-E222 HydrophobicContact CD1-CG 4.08Å; Y159-E222 HydrophobicContact CE1-CB 3.86Å; Y159-E222 VanDerWaalsContact CE1-N 3.31Å; Y159-E222 HydrophobicContact CG-CB 4.16Å; Y159-E222 HydrophobicContact CG-CG 4.15Å; R162-E222 IonicContact CZ-OE2 3.21Å; R162-E222 IonicContact NE-OE1 3.44Å; R162-E222 PolarHBondContact NE-OE1 3.46Å; R162-E222 IonicContact NE-OE2 2.75Å; R162-E222 PolarHBondContact NE-OE2 3.27Å; R162-E222 IonicContact NH2-OE2 2.8Å; R162-E222 PolarHBondContact NH2-OE2 2.84Å; Y218-E222 PolarHBondContact O-N 3.33Å; L219-E222 PolarHBondContact O-N 3.47Å; E222-Y224 PolarHBondContact O-N 3.43Å; E222-N225 PolarHBondContact O-N 3.21Å; E222-Q226 WeakPolarHBondContact O-CG 3.47Å; E222-Q226 PolarHBondContact O-N 3.19Å
223G96.1Very high91.9Very high37 Ų3749.1 Ų49.138%0.38126%0.256SS..Hα-helixtrans-60.6-42.1178.200000113L219 L220 G221 Q226 L227L219-G223 PolarHBondContact O-N 2.91Å; L220-G223 PolarHBondContact O-N 2.76Å; G221-G223 PolarHBondContact O-N 3.43Å; G223-Q226 PolarHBondContact O-N 3.16Å; G223-L227 WeakPolarHBondContact O-CB 2.86Å; G223-L227 PolarHBondContact O-N 3.11Å
224Y95.7Very high90.4Very high63 Ų6352 Ų5225%0.24727%0.269CS..Hα-helixtrans-63.9-42176.3-176.7-127.2000111.8F102 L149 S152 L220 G221 E222 Q226 L227 I228F102-Y224 HydrophobicContact CE2-CD1 4.46Å; L149-Y224 HydrophobicContact CD2-CD1 4.29Å; L149-Y224 HydrophobicContact CD2-CE1 3.68Å; S152-Y224 WeakPolarHBondContact OG-CD1 3.33Å; S152-Y224 WeakPolarHBondContact OG-CE1 3.33Å; L220-Y224 VanDerWaalsContact O-CB 3.28Å; L220-Y224 WeakPolarHBondContact O-CB 3.23Å; L220-Y224 PolarHBondContact O-N 3.29Å; G221-Y224 PolarHBondContact O-N 2.85Å; E222-Y224 PolarHBondContact O-N 3.43Å; Y224-Q226 PolarHBondContact O-N 2.68Å; Y224-L227 WeakPolarHBondContact O-CB 3.38Å; Y224-L227 PolarHBondContact O-N 2.85Å; Y224-I228 HydrophobicContact CD1-CD1 4.02Å; Y224-I228 HydrophobicContact CD2-CD1 3.92Å; Y224-I228 HydrophobicContact CD2-CG1 4.4Å; Y224-I228 HydrophobicContact CE1-CD1 3.63Å; Y224-I228 HydrophobicContact CE2-CD1 3.48Å; Y224-I228 VanDerWaalsContact CE2-CD1 3.48Å; Y224-I228 HydrophobicContact CE2-CG1 4.11Å; Y224-I228 HydrophobicContact CG-CD1 4.17Å; Y224-I228 WeakPolarHBondContact O-CG1 3.39Å; Y224-I228 PolarHBondContact O-N 3.04Å; Y224-I228 VanDerWaalsContact O-N 3.11Å
225N93.4Very high88.9Confident2 Ų257.3 Ų57.31%0.01129%0.292CS..Hα-helixtrans-63-41.3174.8-176.385.4000111.9H157 Y159 G221 E222 W229H157-N225 PolarHBondContact N-OD1 3.43Å; H157-N225 PolarHBondContact O-ND2 3.32Å; H157-N225 PolarHBondContact O-OD1 3Å; Y159-N225 HydrophobicContact CD2-CB 4.26Å; Y159-N225 HydrophobicContact CE2-CB 3.78Å; G221-N225 WeakPolarHBondContact O-CB 3.29Å; G221-N225 PolarHBondContact O-N 3.33Å; E222-N225 PolarHBondContact O-N 3.21Å; N225-W229 WeakPolarHBondContact O-CB 3.31Å; N225-W229 PolarHBondContact O-N 2.96Å
226Q91.8Very high87.3Confident87 Ų8757.7 Ų57.741%0.40730%0.299SS..Hα-helixtrans-67.5-34.8174.8-65.2-60.1-28.600112.7E222 G223 Y224 G230E222-Q226 WeakPolarHBondContact O-CG 3.47Å; E222-Q226 PolarHBondContact O-N 3.19Å; G223-Q226 PolarHBondContact O-N 3.16Å; Y224-Q226 PolarHBondContact O-N 2.68Å; Q226-G230 WeakPolarHBondContact O-CA 3.33Å; Q226-G230 PolarHBondContact O-N 3.3Å
227L92.5Very high85.8Confident145 Ų14558 Ų5876%0.75930%0.301SS*.Hα-helixtrans-64.5-40.8177.9-177.967000111.8G223 Y224G223-L227 WeakPolarHBondContact O-CB 2.86Å; G223-L227 PolarHBondContact O-N 3.11Å; Y224-L227 WeakPolarHBondContact O-CB 3.38Å; Y224-L227 PolarHBondContact O-N 2.85Å
228I90.7Very high84.2Confident46 Ų4662 Ų6224%0.23632%0.319CS..Hα-helixtrans-80.4-43.1-179-62.5163000111.4L153 Y224L153-I228 HydrophobicContact CD2-CD1 3.7Å; L153-I228 HydrophobicContact CD2-CG1 4.32Å; L153-I228 HydrophobicContact CG-CD1 4.46Å; Y224-I228 HydrophobicContact CD1-CD1 4.02Å; Y224-I228 HydrophobicContact CD2-CD1 3.92Å; Y224-I228 HydrophobicContact CD2-CG1 4.4Å; Y224-I228 HydrophobicContact CE1-CD1 3.63Å; Y224-I228 HydrophobicContact CE2-CD1 3.48Å; Y224-I228 VanDerWaalsContact CE2-CD1 3.48Å; Y224-I228 HydrophobicContact CE2-CG1 4.11Å; Y224-I228 HydrophobicContact CG-CD1 4.17Å; Y224-I228 WeakPolarHBondContact O-CG1 3.39Å; Y224-I228 PolarHBondContact O-N 3.04Å; Y224-I228 VanDerWaalsContact O-N 3.11Å
229W89Confident82.4Confident24 Ų2464.4 Ų64.49%0.09133%0.333CS..Hα-helixtrans-113.85.9-166.4-55108.6000114.8P81 S152 L153 V155 C156 N225 E231 Q232 I233P81-W229 HydrophobicContact CB-CE3 3.86Å; P81-W229 HydrophobicContact CB-CH2 3.58Å; P81-W229 HydrophobicContact CB-CZ3 3.15Å; P81-W229 HydrophobicContact CG-CE3 3.47Å; P81-W229 VanDerWaalsContact CG-CE3 3.47Å; P81-W229 HydrophobicContact CG-CH2 4.15Å; P81-W229 HydrophobicContact CG-CZ3 3.21Å; S152-W229 PolarHBondContact O-NE1 2.92Å; L153-W229 WeakPolarHBondContact O-CH2 3.47Å; L153-W229 VanDerWaalsContact O-CZ2 3.23Å; L153-W229 WeakPolarHBondContact O-CZ2 3.19Å; V155-W229 PolarHBondContact O-NE1 3.05Å; V155-W229 VanDerWaalsContact O-NE1 3.12Å; C156-W229 HydrophobicContact CB-CB 3.86Å; C156-W229 HydrophobicContact CB-CD2 3.72Å; C156-W229 HydrophobicContact CB-CE3 4.36Å; C156-W229 HydrophobicContact CB-CG 3.52Å; N225-W229 WeakPolarHBondContact O-CB 3.31Å; N225-W229 PolarHBondContact O-N 2.96Å; W229-E231 VanDerWaalsContact C-N 3.3Å; W229-E231 PolarHBondContact O-N 2.95Å; W229-Q232 PolarHBondContact O-N 3.47Å; W229-Q232 PolarHBondContact O-OE1 3.16Å; W229-Q232 VanDerWaalsContact O-OE1 3.12Å; W229-I233 HydrophobicContact CB-CD1 4.21Å; W229-I233 HydrophobicContact CB-CG1 4.43Å; W229-I233 VanDerWaalsContact O-CG1 3.32Å; W229-I233 WeakPolarHBondContact O-CG1 3.4Å; W229-I233 PolarHBondContact O-N 2.99Å
230G81.2Confident80.5Confident14 Ų1468.6 Ų68.614%0.14435%0.345CS..Hα-helixtrans-56.3-40.9-172.400000113.5Q226 Q232 I233 I234Q226-G230 WeakPolarHBondContact O-CA 3.33Å; Q226-G230 PolarHBondContact O-N 3.3Å; G230-Q232 PolarHBondContact O-N 3.09Å; G230-I233 PolarHBondContact O-N 3.07Å; G230-I234 WeakPolarHBondContact O-CD1 3.38Å; G230-I234 VanDerWaalsContact O-CG1 3.23Å; G230-I234 WeakPolarHBondContact O-CG1 3.39Å; G230-I234 PolarHBondContact O-N 3.41Å
231E77.2Confident78.4Confident158 Ų15871.6 Ų71.674%0.73835%0.351SS*.Hα-helixtrans-63.8-40.8176.7-64.4-172.4166.700112W229 I234 F235W229-E231 VanDerWaalsContact C-N 3.3Å; W229-E231 PolarHBondContact O-N 2.95Å; E231-I234 PolarHBondContact O-N 2.93Å; E231-F235 WeakPolarHBondContact O-CB 3.34Å; E231-F235 PolarHBondContact O-N 3.28Å
232Q70.1Confident76.3Confident65 Ų6580.4 Ų80.430%0.30439%0.389SS..Hα-helixtrans-72.5-34.4179.2-61.486.3-7.900111.6P81 W229 G230 A236P81-Q232 HydrophobicContact CG-CB 4.19Å; P81-Q232 HydrophobicContact CG-CG 3.7Å; W229-Q232 PolarHBondContact O-N 3.47Å; W229-Q232 PolarHBondContact O-OE1 3.16Å; W229-Q232 VanDerWaalsContact O-OE1 3.12Å; G230-Q232 PolarHBondContact O-N 3.09Å; Q232-A236 VanDerWaalsContact O-CB 3.31Å; Q232-A236 WeakPolarHBondContact O-CB 3.38Å; Q232-A236 PolarHBondContact O-N 2.88Å
233I69.5Low74.1Confident24 Ų2488.4 Ų88.412%0.12342%0.42CS..Hα-helixtrans-63.9-46.6172-67.3166.6000109.9W229 G230 A236 L237W229-I233 HydrophobicContact CB-CD1 4.21Å; W229-I233 HydrophobicContact CB-CG1 4.43Å; W229-I233 VanDerWaalsContact O-CG1 3.32Å; W229-I233 WeakPolarHBondContact O-CG1 3.4Å; W229-I233 PolarHBondContact O-N 2.99Å; G230-I233 PolarHBondContact O-N 3.07Å; I233-A236 PolarHBondContact O-N 3.44Å; I233-L237 HydrophobicContact CG2-CD1 4.2Å; I233-L237 WeakPolarHBondContact O-CG 3.33Å; I233-L237 PolarHBondContact O-N 3.09Å
234I67.1Low71.4Confident94 Ų9490.9 Ų90.948%0.48242%0.424SS..Hα-helixtrans-60.9-47.5176.6-69.2164.3000110.5G230 E231 A236 L237 Q238G230-I234 WeakPolarHBondContact O-CD1 3.38Å; G230-I234 VanDerWaalsContact O-CG1 3.23Å; G230-I234 WeakPolarHBondContact O-CG1 3.39Å; G230-I234 PolarHBondContact O-N 3.41Å; E231-I234 PolarHBondContact O-N 2.93Å; I234-A236 VanDerWaalsContact C-N 3.34Å; I234-A236 PolarHBondContact O-N 2.94Å; I234-L237 PolarHBondContact O-N 3.13Å; I234-Q238 HydrophobicContact CG2-CG 4.3Å; I234-Q238 WeakPolarHBondContact O-CG 3.08Å; I234-Q238 PolarHBondContact O-N 3.31Å
235F66.9Low68.8Low113 Ų11393.6 Ų93.650%0.49645%0.449SS..Hα-helixtrans-57.9-46.2176.9177.7-100.5000111.7E231 L237 Q238 V239E231-F235 WeakPolarHBondContact O-CB 3.34Å; E231-F235 PolarHBondContact O-N 3.28Å; F235-L237 VanDerWaalsContact C-N 3.33Å; F235-L237 PolarHBondContact O-N 2.7Å; F235-Q238 PolarHBondContact O-N 3.16Å; F235-V239 HydrophobicContact CD1-CG2 4.21Å; F235-V239 HydrophobicContact CD2-CG2 4.37Å; F235-V239 HydrophobicContact CE1-CG2 3.8Å; F235-V239 HydrophobicContact CE2-CG2 3.98Å; F235-V239 HydrophobicContact CG-CG2 4.49Å; F235-V239 HydrophobicContact CZ-CG2 3.67Å; F235-V239 WeakPolarHBondContact O-CB 3.13Å; F235-V239 VanDerWaalsContact O-CG2 3.27Å; F235-V239 WeakPolarHBondContact O-CG2 3.34Å; F235-V239 PolarHBondContact O-N 3.06Å
236A65.8Low66.3Low32 Ų32103.1 Ų103.126%0.26451%0.513SS..Hα-helixtrans-62-39.9178.100000112.4Y84 Q232 I233 I234 Y240Y84-A236 HydrophobicContact CE2-CB 3.99Å; Q232-A236 VanDerWaalsContact O-CB 3.31Å; Q232-A236 WeakPolarHBondContact O-CB 3.38Å; Q232-A236 PolarHBondContact O-N 2.88Å; I233-A236 PolarHBondContact O-N 3.44Å; I234-A236 VanDerWaalsContact C-N 3.34Å; I234-A236 PolarHBondContact O-N 2.94Å; A236-Y240 WeakPolarHBondContact O-CB 3.27Å; A236-Y240 PolarHBondContact O-N 3.48Å
237L67.1Low65Low91 Ų91103.9 Ų103.948%0.47652%0.519SS..Hα-helixtrans-65.4-47.1174.9-70.4172.5000111.3I233 I234 F235 V239 Y240 Y241I233-L237 HydrophobicContact CG2-CD1 4.2Å; I233-L237 WeakPolarHBondContact O-CG 3.33Å; I233-L237 PolarHBondContact O-N 3.09Å; I234-L237 PolarHBondContact O-N 3.13Å; F235-L237 VanDerWaalsContact C-N 3.33Å; F235-L237 PolarHBondContact O-N 2.7Å; L237-V239 PolarHBondContact O-N 3.29Å; L237-Y240 PolarHBondContact O-N 3.36Å; L237-Y240 VanDerWaalsContact O-N 3.16Å; L237-Y241 HydrophobicContact CB-CD2 4.43Å; L237-Y241 HydrophobicContact CB-CE2 4.42Å; L237-Y241 WeakPolarHBondContact O-CD2 3.08Å; L237-Y241 PolarHBondContact O-N 2.66Å
238Q64.4Low63.5Low109 Ų109101.7 Ų101.751%0.50951%0.506SS..Hα-helixtrans-58-47.9178.2-73.9174.7-26.300111.6I234 F235 Y240 Y241 F242I234-Q238 HydrophobicContact CG2-CG 4.3Å; I234-Q238 WeakPolarHBondContact O-CG 3.08Å; I234-Q238 PolarHBondContact O-N 3.31Å; F235-Q238 PolarHBondContact O-N 3.16Å; Q238-Y240 PolarHBondContact O-N 3.18Å; Q238-Y241 PolarHBondContact O-N 3.28Å; Q238-F242 WeakPolarHBondContact O-CD2 3.43Å; Q238-F242 PolarHBondContact O-N 3.01Å
239V61.3Low62Low51 Ų51104.8 Ų104.831%0.30952%0.521SS..Hα-helixtrans-56.3-50.1174.1167.70000110.2F235 L237 Y241 F242 Y243F235-V239 HydrophobicContact CD1-CG2 4.21Å; F235-V239 HydrophobicContact CD2-CG2 4.37Å; F235-V239 HydrophobicContact CE1-CG2 3.8Å; F235-V239 HydrophobicContact CE2-CG2 3.98Å; F235-V239 HydrophobicContact CG-CG2 4.49Å; F235-V239 HydrophobicContact CZ-CG2 3.67Å; F235-V239 WeakPolarHBondContact O-CB 3.13Å; F235-V239 VanDerWaalsContact O-CG2 3.27Å; F235-V239 WeakPolarHBondContact O-CG2 3.34Å; F235-V239 PolarHBondContact O-N 3.06Å; L237-V239 PolarHBondContact O-N 3.29Å; V239-Y241 VanDerWaalsContact C-N 3.35Å; V239-Y241 PolarHBondContact O-N 3.38Å; V239-F242 PolarHBondContact O-N 3.36Å; V239-F242 VanDerWaalsContact O-N 3.15Å; V239-Y243 HydrophobicContact CG1-CD2 3.78Å; V239-Y243 HydrophobicContact CG1-CE2 3.72Å; V239-Y243 WeakPolarHBondContact O-CD2 3.35Å; V239-Y243 PolarHBondContact O-N 2.83Å
240Y58.5Low60.5Low161 Ų161109.6 Ų109.663%0.63155%0.546SS*.Hα-helixtrans-60.4-41.5-180-162.6-95.6000112.8A236 L237 Q238 Y243 L244A236-Y240 WeakPolarHBondContact O-CB 3.27Å; A236-Y240 PolarHBondContact O-N 3.48Å; L237-Y240 PolarHBondContact O-N 3.36Å; L237-Y240 VanDerWaalsContact O-N 3.16Å; Q238-Y240 PolarHBondContact O-N 3.18Å; Y240-Y243 PolarHBondContact O-N 3.12Å; Y240-L244 HydrophobicContact CD1-CD1 4.11Å; Y240-L244 HydrophobicContact CD1-CG 4.48Å; Y240-L244 HydrophobicContact CE1-CD1 4.05Å; Y240-L244 HydrophobicContact CE1-CD2 4.38Å; Y240-L244 HydrophobicContact CE1-CG 4.34Å; Y240-L244 PolarHBondContact O-N 3.15Å
241Y53.9Low59.2Low166 Ų166115.6 Ų115.665%0.65157%0.572SS**Hα-helixtrans-67.8-32.8175.8-78.7-69.7000113.1L237 Q238 V239 Y243 L244L237-Y241 HydrophobicContact CB-CD2 4.43Å; L237-Y241 HydrophobicContact CB-CE2 4.42Å; L237-Y241 WeakPolarHBondContact O-CD2 3.08Å; L237-Y241 PolarHBondContact O-N 2.66Å; Q238-Y241 PolarHBondContact O-N 3.28Å; V239-Y241 VanDerWaalsContact C-N 3.35Å; V239-Y241 PolarHBondContact O-N 3.38Å; Y241-Y243 VanDerWaalsContact C-N 3.31Å; Y241-Y243 PolarHBondContact O-N 2.94Å; Y241-L244 HydrophobicContact CD1-CD1 4.39Å
242F54Low57.9Low185 Ų185112.7 Ų112.781%0.81156%0.561SS**Hα-helixtrans-70.5-24.1175.6-99.2-83.6000113.7Q238 V239Q238-F242 WeakPolarHBondContact O-CD2 3.43Å; Q238-F242 PolarHBondContact O-N 3.01Å; V239-F242 PolarHBondContact O-N 3.36Å; V239-F242 VanDerWaalsContact O-N 3.15Å
243Y50.8Low57.1Low189 Ų189116.1 Ų116.174%0.74158%0.579SS**THydrogen-bonded Turntrans-99.70.6-178.9-71.8-68.4000114.5V239 Y240 Y241 P245V239-Y243 HydrophobicContact CG1-CD2 3.78Å; V239-Y243 HydrophobicContact CG1-CE2 3.72Å; V239-Y243 WeakPolarHBondContact O-CD2 3.35Å; V239-Y243 PolarHBondContact O-N 2.83Å; Y240-Y243 PolarHBondContact O-N 3.12Å; Y241-Y243 VanDerWaalsContact C-N 3.31Å; Y241-Y243 PolarHBondContact O-N 2.94Å; Y243-P245 WeakPolarHBondContact O-CD 3.37Å
244L38.4Very low56.1Low90 Ų90123.2 Ų123.247%0.47161%0.614SS.*SBendtrans-79.5118.1168.5-75.2166.8000108.7Y240 Y241 C246Y240-L244 HydrophobicContact CD1-CD1 4.11Å; Y240-L244 HydrophobicContact CD1-CG 4.48Å; Y240-L244 HydrophobicContact CE1-CD1 4.05Å; Y240-L244 HydrophobicContact CE1-CD2 4.38Å; Y240-L244 HydrophobicContact CE1-CG 4.34Å; Y240-L244 PolarHBondContact O-N 3.15Å; Y241-L244 HydrophobicContact CD1-CD1 4.39Å; L244-C246 PolarHBondContact O-N 3.36Å
245P40.9Very low55.2Low119 Ų119125.7 Ų125.777%0.77363%0.625SS**  trans-61.7131166.525.4-29.8000108.4Y243Y243-P245 WeakPolarHBondContact O-CD 3.37Å
246C40.6Very low54.1Low202 Ų202126.8 Ų126.8100%1.36564%0.637SS**  trans-520175.9-54.70000112.7L244L244-C246 PolarHBondContact O-N 3.36Å

Retrieved 246 of 246 residues in 826.2 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).