A0A087X9V0_POEFO Loading...

Tetraspanin

AlphaFold DB , UniProt , Accession A0A087X9V0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 238 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M51.8Low76.2Confident228 Ų22898.5 Ų98.5100%1.12354%0.541SS*.  0-41.10-141.1173.9-78.300112
2A63.8Low77.2Confident72 Ų7292.1 Ų92.160%0.59551%0.514SS*.Hα-helixtrans-64.9-43.8177.100000114.6G4 C5 M6A2-G4 PolarHBondContact O-N 3.44Å; A2-C5 PolarHBondContact O-N 3.17Å; A2-M6 WeakPolarHBondContact O-CG 3.4Å; A2-M6 PolarHBondContact O-N 3.28Å; A2-M6 VanDerWaalsContact O-N 3.17Å
3E69.9Low78.2Confident154 Ų15485.2 Ų85.272%0.7248%0.475SS*.Hα-helixtrans-62.8-41.2-178.5-71.1-174155.900114C5 M6 M7E3-C5 VanDerWaalsContact C-N 3.33Å; E3-C5 PolarHBondContact O-N 3.45Å; E3-M6 HydrophobicContact CG-CE 4.48Å; E3-M6 PolarHBondContact O-N 3.44Å; E3-M7 PolarHBondContact O-N 3.03Å
4G74.6Confident79.3Confident52 Ų5281.8 Ų81.854%0.53646%0.457SS..Hα-helixtrans-64.8-35.7177.500000113.1A2 A8A2-G4 PolarHBondContact O-N 3.44Å; G4-A8 WeakPolarHBondContact O-CB 3.42Å; G4-A8 PolarHBondContact O-N 3.05Å
5C79.1Confident80.2Confident75 Ų7584.2 Ų84.251%0.50746%0.461SS..Hα-helixtrans-66-42175.1-175.30000111.5A2 E3 A8 L9A2-C5 PolarHBondContact O-N 3.17Å; E3-C5 VanDerWaalsContact C-N 3.33Å; E3-C5 PolarHBondContact O-N 3.45Å; C5-A8 PolarHBondContact O-N 3.28Å; C5-L9 WeakPolarHBondContact O-CG 3.28Å; C5-L9 PolarHBondContact O-N 3.34Å
6M75.4Confident81Confident71 Ų7185.6 Ų85.635%0.3546%0.461SS..Hα-helixtrans-66.7-40.9178.7-63.1-168.9-53.600112.2A2 E3 L9 R10 Q229A2-M6 WeakPolarHBondContact O-CG 3.4Å; A2-M6 PolarHBondContact O-N 3.28Å; A2-M6 VanDerWaalsContact O-N 3.17Å; E3-M6 HydrophobicContact CG-CE 4.48Å; E3-M6 PolarHBondContact O-N 3.44Å; M6-L9 PolarHBondContact O-N 3.17Å; M6-R10 PolarHBondContact O-N 3.21Å; M6-Q229 HydrophobicContact SD-CG 4.23Å; M6-Q229 PolarHBondContact SD-NE2 3.35Å; M6-Q229 PolarHBondContact SD-OE1 2.95Å; M6-Q229 VanDerWaalsContact SD-OE1 3.34Å
7M81.2Confident81.7Confident97 Ų9781.3 Ų81.348%0.47844%0.438SS..Hα-helixtrans-62.3-44173.8-73-66.9162.300111.5E3 L9 R10 Y11E3-M7 PolarHBondContact O-N 3.03Å; M7-L9 PolarHBondContact O-N 2.82Å; M7-R10 PolarHBondContact O-N 3.32Å; M7-Y11 HydrophobicContact CB-CD2 4.44Å; M7-Y11 HydrophobicContact CB-CE2 4.42Å; M7-Y11 WeakPolarHBondContact O-CD2 3.28Å; M7-Y11 PolarHBondContact O-N 3.46Å; M7-Y11 HydrophobicContact SD-CE2 4.29Å
8A84.1Confident82.5Confident64 Ų6481 Ų8153%0.52944%0.436SS..Hα-helixtrans-60.8-42.7176.400000112.5G4 C5 G12G4-A8 WeakPolarHBondContact O-CB 3.42Å; G4-A8 PolarHBondContact O-N 3.05Å; C5-A8 PolarHBondContact O-N 3.28Å; A8-G12 PolarHBondContact O-N 3.49Å
9L84.1Confident83.2Confident42 Ų4281.3 Ų81.322%0.2244%0.437CS..Hα-helixtrans-62.1-43.8175.8-72.8172.4000112C5 M6 M7 G12 M13 F222C5-L9 WeakPolarHBondContact O-CG 3.28Å; C5-L9 PolarHBondContact O-N 3.34Å; M6-L9 PolarHBondContact O-N 3.17Å; M7-L9 PolarHBondContact O-N 2.82Å; L9-G12 PolarHBondContact O-N 2.95Å; L9-M13 VanDerWaalsContact O-CB 3.3Å; L9-M13 WeakPolarHBondContact O-CB 3.35Å; L9-M13 PolarHBondContact O-N 2.99Å; L9-F222 HydrophobicContact CD2-CD1 3.73Å; L9-F222 HydrophobicContact CD2-CE1 3.46Å; L9-F222 VanDerWaalsContact CD2-CE1 3.46Å; L9-F222 HydrophobicContact CD2-CG 4.44Å; L9-F222 HydrophobicContact CD2-CZ 3.96Å
10R85.6Confident83.8Confident63 Ų6381.8 Ų81.824%0.23844%0.435CS..Hα-helixtrans-64.2-50.9178.6-175.2177.1178.3-163.7-8.6111.8M6 M7 G12 M13 V14 A75 V76 E78 M226M6-R10 PolarHBondContact O-N 3.21Å; M7-R10 PolarHBondContact O-N 3.32Å; R10-G12 VanDerWaalsContact C-N 3.32Å; R10-G12 PolarHBondContact O-N 3.29Å; R10-M13 PolarHBondContact O-N 3.5Å; R10-V14 WeakPolarHBondContact O-CG2 3.45Å; R10-V14 PolarHBondContact O-N 3.43Å; R10-A75 PolarHBondContact NE-O 3.24Å; R10-V76 PolarHBondContact NH2-O 3.44Å; R10-E78 IonicContact CZ-OE1 3.06Å; R10-E78 IonicContact NE-OE1 3.43Å; R10-E78 PolarHBondContact NE-OE1 3.14Å; R10-E78 IonicContact NH1-OE1 2.7Å; R10-E78 PolarHBondContact NH1-OE1 2.87Å; R10-E78 IonicContact NH2-OE1 3.73Å; R10-M226 HydrophobicContact CB-CE 4.13Å; R10-M226 HydrophobicContact CB-SD 4.32Å; R10-M226 HydrophobicContact CG-CE 4Å
11Y88.4Confident84.4Confident166 Ų16682.3 Ų82.365%0.65143%0.431SS*.Hα-helixtrans-63.8-39178.2-75.2-64.3000112M7 V14 F15M7-Y11 HydrophobicContact CB-CD2 4.44Å; M7-Y11 HydrophobicContact CB-CE2 4.42Å; M7-Y11 WeakPolarHBondContact O-CD2 3.28Å; M7-Y11 PolarHBondContact O-N 3.46Å; M7-Y11 HydrophobicContact SD-CE2 4.29Å; Y11-V14 PolarHBondContact O-N 3.34Å; Y11-F15 VanDerWaalsContact O-CB 3.28Å; Y11-F15 WeakPolarHBondContact O-CB 3.43Å; Y11-F15 PolarHBondContact O-N 3.46Å
12G88.9Confident86.6Confident21 Ų2175.9 Ų75.922%0.21640%0.401CS..Hα-helixtrans-60.7-48.7173.600000111.9A8 L9 R10 V14 F15 F16A8-G12 PolarHBondContact O-N 3.49Å; L9-G12 PolarHBondContact O-N 2.95Å; R10-G12 VanDerWaalsContact C-N 3.32Å; R10-G12 PolarHBondContact O-N 3.29Å; G12-V14 PolarHBondContact O-N 3.3Å; G12-F15 PolarHBondContact O-N 2.86Å; G12-F16 WeakPolarHBondContact O-CD2 3.11Å; G12-F16 PolarHBondContact O-N 3.47Å
13M90.1Very high88.2Confident3 Ų374.1 Ų74.12%0.01539%0.39CS..Hα-helixtrans-59.6-44.8177.8-173.7175.6-178.500111.7L9 R10 N17 A75 L83 F86 F222 M226L9-M13 VanDerWaalsContact O-CB 3.3Å; L9-M13 WeakPolarHBondContact O-CB 3.35Å; L9-M13 PolarHBondContact O-N 2.99Å; R10-M13 PolarHBondContact O-N 3.5Å; M13-N17 WeakPolarHBondContact CG-ND2 3.3Å; M13-N17 WeakPolarHBondContact O-CB 3.48Å; M13-N17 PolarHBondContact O-N 2.92Å; M13-N17 PolarHBondContact O-ND2 2.96Å; M13-A75 HydrophobicContact CB-CB 4.48Å; M13-A75 HydrophobicContact CG-CB 4.14Å; M13-A75 HydrophobicContact SD-CB 4Å; M13-L83 HydrophobicContact CE-CD2 3.91Å; M13-L83 HydrophobicContact SD-CD2 4.43Å; M13-F86 HydrophobicContact CE-CD1 3.81Å; M13-F86 HydrophobicContact CE-CE1 3.56Å; M13-F86 HydrophobicContact CE-CZ 4.23Å; M13-F222 HydrophobicContact SD-CB 4.36Å; M13-M226 HydrophobicContact SD-CG 4.39Å
14V93.1Very high89.5Confident37 Ų3766.8 Ų66.822%0.22436%0.356CS..Hα-helixtrans-62.6-46.5176.1173.20000111R10 Y11 G12 N17 L18 A75 V76R10-V14 WeakPolarHBondContact O-CG2 3.45Å; R10-V14 PolarHBondContact O-N 3.43Å; Y11-V14 PolarHBondContact O-N 3.34Å; G12-V14 PolarHBondContact O-N 3.3Å; V14-N17 PolarHBondContact O-N 3.45Å; V14-L18 VanDerWaalsContact O-CB 3.25Å; V14-L18 WeakPolarHBondContact O-CB 3.46Å; V14-L18 PolarHBondContact O-N 3.47Å; V14-A75 HydrophobicContact CG2-CB 3.64Å; V14-V76 HydrophobicContact CG1-CG2 4.28Å; V14-V76 HydrophobicContact CG2-CG2 3.84Å
15F93.1Very high90.6Very high118 Ų11866.5 Ų66.552%0.51835%0.345SS..Hα-helixtrans-59.8-51-179.4176.1-102.8000112.3Y11 G12 L18 L19Y11-F15 VanDerWaalsContact O-CB 3.28Å; Y11-F15 WeakPolarHBondContact O-CB 3.43Å; Y11-F15 PolarHBondContact O-N 3.46Å; G12-F15 PolarHBondContact O-N 2.86Å; F15-L18 PolarHBondContact O-N 3.22Å; F15-L19 HydrophobicContact CD1-CD1 4.26Å; F15-L19 HydrophobicContact CE1-CD1 3.65Å; F15-L19 HydrophobicContact CE1-CG 4.47Å; F15-L19 HydrophobicContact CE2-CD1 4.48Å; F15-L19 HydrophobicContact CZ-CD1 3.78Å; F15-L19 HydrophobicContact CZ-CG 4.36Å; F15-L19 WeakPolarHBondContact O-CG 3.34Å; F15-L19 PolarHBondContact O-N 2.98Å; F15-L19 VanDerWaalsContact O-N 3.1Å
16F92.1Very high91.5Very high106 Ų10664.9 Ų64.947%0.46534%0.341SS..Hα-helixtrans-65.4-43.5-179.9-73.7-64.8000112.4G12 L18 L19 F20G12-F16 WeakPolarHBondContact O-CD2 3.11Å; G12-F16 PolarHBondContact O-N 3.47Å; F16-L18 PolarHBondContact O-N 3.37Å; F16-L19 WeakPolarHBondContact O-CB 3.32Å; F16-L19 PolarHBondContact O-N 2.92Å; F16-F20 WeakPolarHBondContact O-CD2 3.11Å; F16-F20 PolarHBondContact O-N 3.4Å
17N94.4Very high92.5Very high13 Ų1364.3 Ų64.37%0.0734%0.339CS..Hα-helixtrans-65.9-29.6177.5-78.1-76.3000112.3M13 V14 F20 W21 C72 F86M13-N17 WeakPolarHBondContact CG-ND2 3.3Å; M13-N17 WeakPolarHBondContact O-CB 3.48Å; M13-N17 PolarHBondContact O-N 2.92Å; M13-N17 PolarHBondContact O-ND2 2.96Å; V14-N17 PolarHBondContact O-N 3.45Å; N17-F20 PolarHBondContact O-N 3.47Å; N17-W21 WeakPolarHBondContact O-CB 3.26Å; N17-W21 PolarHBondContact O-N 3.35Å; N17-C72 WeakPolarHBondContact CB-SG 3.46Å; N17-F86 WeakPolarHBondContact OD1-CE2 3.35Å; N17-F86 WeakPolarHBondContact OD1-CZ 3.31Å
18L95.4Very high93.2Very high76 Ų7661 Ų6140%0.39832%0.323SS..Hα-helixtrans-68.7-40.4174.8-177.764.9000111.1V14 F15 F16 W21 L22 C72V14-L18 VanDerWaalsContact O-CB 3.25Å; V14-L18 WeakPolarHBondContact O-CB 3.46Å; V14-L18 PolarHBondContact O-N 3.47Å; F15-L18 PolarHBondContact O-N 3.22Å; F16-L18 PolarHBondContact O-N 3.37Å; L18-W21 HydrophobicContact CD1-CE3 3.98Å; L18-W21 PolarHBondContact O-N 3.42Å; L18-L22 HydrophobicContact CG-CD1 4.35Å; L18-L22 WeakPolarHBondContact O-CG 3.33Å; L18-L22 PolarHBondContact O-N 3.4Å; L18-C72 PolarHBondContact N-SG 2.87Å
19L95.4Very high93.7Very high87 Ų8759.7 Ų59.746%0.45532%0.316SS..Hα-helixtrans-61.8-44.3173.3-67.1178.9000111.5F15 F16 L22 G23F15-L19 HydrophobicContact CD1-CD1 4.26Å; F15-L19 HydrophobicContact CE1-CD1 3.65Å; F15-L19 HydrophobicContact CE1-CG 4.47Å; F15-L19 HydrophobicContact CE2-CD1 4.48Å; F15-L19 HydrophobicContact CZ-CD1 3.78Å; F15-L19 HydrophobicContact CZ-CG 4.36Å; F15-L19 WeakPolarHBondContact O-CG 3.34Å; F15-L19 PolarHBondContact O-N 2.98Å; F15-L19 VanDerWaalsContact O-N 3.1Å; F16-L19 WeakPolarHBondContact O-CB 3.32Å; F16-L19 PolarHBondContact O-N 2.92Å; L19-L22 PolarHBondContact O-N 2.85Å; L19-G23 PolarHBondContact O-N 2.89Å
20F95.1Very high94.1Very high91 Ų9161.4 Ų61.440%0.39933%0.328SS..Hα-helixtrans-62.4-42.3174.5-75.7-61.5000112.1F16 N17 G23 G24 I64 T215F16-F20 WeakPolarHBondContact O-CD2 3.11Å; F16-F20 PolarHBondContact O-N 3.4Å; N17-F20 PolarHBondContact O-N 3.47Å; F20-G23 PolarHBondContact O-N 2.96Å; F20-G24 PolarHBondContact O-N 2.96Å; F20-I64 HydrophobicContact CB-CG2 4.23Å; F20-I64 HydrophobicContact CD1-CG2 4.43Å; F20-I64 VanDerWaalsContact O-CG2 3.25Å; F20-I64 WeakPolarHBondContact O-CG2 3.36Å; F20-T215 HydrophobicContact CE2-CG2 3.61Å; F20-T215 HydrophobicContact CZ-CG2 3.55Å
21W97.3Very high94.3Very high92 Ų9258.4 Ų58.435%0.34832%0.317SS..Hα-helixtrans-60.4-49.2176.8179.475.9000111.9N17 L18 G23 G24 C25 M65N17-W21 WeakPolarHBondContact O-CB 3.26Å; N17-W21 PolarHBondContact O-N 3.35Å; L18-W21 HydrophobicContact CD1-CE3 3.98Å; L18-W21 PolarHBondContact O-N 3.42Å; W21-G23 PolarHBondContact O-N 2.88Å; W21-G24 PolarHBondContact O-N 3.2Å; W21-C25 PolarHBondContact O-N 3.04Å; W21-C25 PolarHBondContact O-SG 3.47Å; W21-M65 VanDerWaalsContact CD1-O 3.31Å
22L97.6Very high94.4Very high94 Ų9454.6 Ų54.649%0.49231%0.307SS..Hα-helixtrans-61.9-42.8176.7-70.9173.6000111.9L18 L19 C25 G26L18-L22 HydrophobicContact CG-CD1 4.35Å; L18-L22 WeakPolarHBondContact O-CG 3.33Å; L18-L22 PolarHBondContact O-N 3.4Å; L19-L22 PolarHBondContact O-N 2.85Å; L22-C25 WeakPolarHBondContact O-CB 3.15Å; L22-C25 PolarHBondContact O-N 3.47Å; L22-G26 PolarHBondContact O-N 3.43Å
23G96.8Very high94.4Very high35 Ų3561.8 Ų61.836%0.36133%0.327SS..Hα-helixtrans-61.5-43.9174.900000112.2L19 F20 W21 G26 I27L19-G23 PolarHBondContact O-N 2.89Å; F20-G23 PolarHBondContact O-N 2.96Å; W21-G23 PolarHBondContact O-N 2.88Å; G23-G26 PolarHBondContact O-N 3.33Å; G23-G26 VanDerWaalsContact O-N 3.16Å; G23-I27 WeakPolarHBondContact O-CG1 3.31Å; G23-I27 PolarHBondContact O-N 3.11Å
24G97.4Very high94Very high0 Ų063 Ų630%033%0.333CS..Hα-helixtrans-60.2-44.7175.100000112.3F20 W21 G26 I27 L28F20-G24 PolarHBondContact O-N 2.96Å; W21-G24 PolarHBondContact O-N 3.2Å; G24-G26 VanDerWaalsContact C-N 3.32Å; G24-G26 PolarHBondContact O-N 3.09Å; G24-I27 PolarHBondContact O-N 3.37Å; G24-L28 WeakPolarHBondContact O-CB 3.35Å; G24-L28 PolarHBondContact O-N 3.04Å
25C97.7Very high93.5Very high45 Ų4563 Ų6330%0.30434%0.335SS..Hα-helixtrans-59.2-42.1172.7-69.60000112.1W21 L22 G29 M65W21-C25 PolarHBondContact O-N 3.04Å; W21-C25 PolarHBondContact O-SG 3.47Å; L22-C25 WeakPolarHBondContact O-CB 3.15Å; L22-C25 PolarHBondContact O-N 3.47Å; C25-G29 PolarHBondContact O-N 3.24Å; C25-M65 VanDerWaalsContact SG-SD 3.66Å
26G97.5Very high92.8Very high42 Ų4262.8 Ų62.843%0.43334%0.344SS..Hα-helixtrans-63.4-50.5176.600000112.7L22 G23 G24 L28 G29 V30L22-G26 PolarHBondContact O-N 3.43Å; G23-G26 PolarHBondContact O-N 3.33Å; G23-G26 VanDerWaalsContact O-N 3.16Å; G24-G26 VanDerWaalsContact C-N 3.32Å; G24-G26 PolarHBondContact O-N 3.09Å; G26-L28 VanDerWaalsContact C-N 3.34Å; G26-L28 PolarHBondContact O-N 3.04Å; G26-G29 PolarHBondContact O-N 3.36Å; G26-V30 WeakPolarHBondContact O-CG2 3.3Å; G26-V30 PolarHBondContact O-N 3.47Å
27I96.2Very high91.9Very high59 Ų5961.5 Ų61.530%0.30335%0.345SS..Hα-helixtrans-60.6-45178.1-67167.7000110.6G23 G24 G29 V30 G31 L57 I64G23-I27 WeakPolarHBondContact O-CG1 3.31Å; G23-I27 PolarHBondContact O-N 3.11Å; G24-I27 PolarHBondContact O-N 3.37Å; I27-G29 VanDerWaalsContact C-N 3.35Å; I27-G29 PolarHBondContact O-N 3.31Å; I27-V30 PolarHBondContact O-N 2.7Å; I27-G31 PolarHBondContact O-N 3.25Å; I27-L57 HydrophobicContact CG2-CB 4.37Å; I27-L57 HydrophobicContact CG2-CD2 4Å; I27-L57 WeakPolarHBondContact CG2-O 3.39Å; I27-I64 HydrophobicContact CD1-CD1 4.17Å
28L96.1Very high90.4Very high26 Ų2663.6 Ų63.614%0.13635%0.354CS..Hα-helixtrans-60.5-44.9176177.358.7000111.3G24 G26 V30 G31 I32 I58 T62 M65G24-L28 WeakPolarHBondContact O-CB 3.35Å; G24-L28 PolarHBondContact O-N 3.04Å; G26-L28 VanDerWaalsContact C-N 3.34Å; G26-L28 PolarHBondContact O-N 3.04Å; L28-V30 PolarHBondContact O-N 3.09Å; L28-G31 PolarHBondContact O-N 2.81Å; L28-I32 HydrophobicContact CD1-CD1 3.91Å; L28-I32 HydrophobicContact CD1-CG1 4.14Å; L28-I32 HydrophobicContact CG-CD1 3.93Å; L28-I32 WeakPolarHBondContact O-CG1 3.4Å; L28-I32 PolarHBondContact O-N 3.32Å; L28-I58 HydrophobicContact CD1-CB 4.23Å; L28-I58 HydrophobicContact CD1-CG1 4.38Å; L28-I58 HydrophobicContact CD1-CG2 3.81Å; L28-T62 WeakPolarHBondContact CD1-OG1 3.44Å; L28-M65 HydrophobicContact CD2-CE 3.85Å; L28-M65 HydrophobicContact CD2-SD 4.03Å
29G95Very high88.7Confident38 Ų3861.5 Ų61.539%0.39235%0.351SS..Hα-helixtrans-59.3-44.8176.600000112.5C25 G26 I27 I32 W33C25-G29 PolarHBondContact O-N 3.24Å; G26-G29 PolarHBondContact O-N 3.36Å; I27-G29 VanDerWaalsContact C-N 3.35Å; I27-G29 PolarHBondContact O-N 3.31Å; G29-I32 PolarHBondContact O-N 2.88Å; G29-W33 VanDerWaalsContact O-CB 3.31Å; G29-W33 WeakPolarHBondContact O-CB 3.3Å; G29-W33 PolarHBondContact O-N 3.41Å
30V92.1Very high86.8Confident77 Ų7761.2 Ų61.247%0.46735%0.35SS..Hα-helixtrans-63.3-43.1174.5173.60000111.2G26 I27 L28 W33 L34 L57G26-V30 WeakPolarHBondContact O-CG2 3.3Å; G26-V30 PolarHBondContact O-N 3.47Å; I27-V30 PolarHBondContact O-N 2.7Å; L28-V30 PolarHBondContact O-N 3.09Å; V30-W33 PolarHBondContact O-N 2.96Å; V30-L34 HydrophobicContact CG1-CD1 3.92Å; V30-L34 HydrophobicContact CG1-CG 4.32Å; V30-L34 WeakPolarHBondContact O-CB 3.4Å; V30-L34 VanDerWaalsContact O-CG 3.31Å; V30-L34 WeakPolarHBondContact O-CG 3.39Å; V30-L34 PolarHBondContact O-N 3.02Å; V30-L57 HydrophobicContact CG1-CD1 4.45Å
31G90.4Very high84.9Confident0 Ų059 Ų590%034%0.34CS..Hα-helixtrans-60.5-46177.100000112.8I27 L28 L34 S35 I58I27-G31 PolarHBondContact O-N 3.25Å; L28-G31 PolarHBondContact O-N 2.81Å; G31-L34 PolarHBondContact O-N 3.48Å; G31-S35 WeakPolarHBondContact O-CB 3.36Å; G31-S35 PolarHBondContact O-N 3.1Å; G31-I58 VanDerWaalsContact C-CG1 3.5Å
32I90.3Very high82.9Confident86 Ų8655.2 Ų55.244%0.44133%0.328SS..Hα-helixtrans-63.4-46.1175.7-66.8168.7000110.4L28 G29 L34 S35 V36 I58L28-I32 HydrophobicContact CD1-CD1 3.91Å; L28-I32 HydrophobicContact CD1-CG1 4.14Å; L28-I32 HydrophobicContact CG-CD1 3.93Å; L28-I32 WeakPolarHBondContact O-CG1 3.4Å; L28-I32 PolarHBondContact O-N 3.32Å; G29-I32 PolarHBondContact O-N 2.88Å; I32-L34 PolarHBondContact O-N 3.22Å; I32-S35 PolarHBondContact O-N 3.49Å; I32-V36 HydrophobicContact CG2-CG2 4.29Å; I32-V36 WeakPolarHBondContact O-CG2 3.32Å; I32-V36 PolarHBondContact O-N 3.27Å; I32-I58 HydrophobicContact CG1-CD1 4.33Å; I32-I58 HydrophobicContact CG1-CG1 4.21Å
33W88.6Confident81.1Confident173 Ų17351.4 Ų51.466%0.65531%0.309SS*.Hα-helixtrans-56.7-48.5177.2177-96.5000111.7G29 V30 S35 V36 T37G29-W33 VanDerWaalsContact O-CB 3.31Å; G29-W33 WeakPolarHBondContact O-CB 3.3Å; G29-W33 PolarHBondContact O-N 3.41Å; V30-W33 PolarHBondContact O-N 2.96Å; W33-S35 VanDerWaalsContact C-N 3.34Å; W33-S35 PolarHBondContact O-N 2.96Å; W33-V36 PolarHBondContact O-N 3.31Å; W33-T37 HydrophobicContact CZ2-CG2 4.47Å; W33-T37 WeakPolarHBondContact O-CB 3.49Å; W33-T37 PolarHBondContact O-N 3.06Å; W33-T37 PolarHBondContact O-OG1 3.24Å; W33-T37 VanDerWaalsContact O-OG1 3.12Å
34L82.5Confident79.2Confident27 Ų2754.2 Ų54.214%0.14132%0.315CS..Hα-helixtrans-61.3-42.2177.3-72.4172000112.1V30 G31 I32 V36 Q38 F41 A54 L57V30-L34 HydrophobicContact CG1-CD1 3.92Å; V30-L34 HydrophobicContact CG1-CG 4.32Å; V30-L34 WeakPolarHBondContact O-CB 3.4Å; V30-L34 VanDerWaalsContact O-CG 3.31Å; V30-L34 WeakPolarHBondContact O-CG 3.39Å; V30-L34 PolarHBondContact O-N 3.02Å; G31-L34 PolarHBondContact O-N 3.48Å; I32-L34 PolarHBondContact O-N 3.22Å; L34-V36 VanDerWaalsContact C-N 3.3Å; L34-V36 PolarHBondContact O-N 2.94Å; L34-Q38 PolarHBondContact O-N 2.95Å; L34-Q38 VanDerWaalsContact O-N 3.08Å; L34-F41 HydrophobicContact CB-CB 4.44Å; L34-F41 HydrophobicContact CB-CG 4.43Å; L34-F41 HydrophobicContact CD1-CD1 4.37Å; L34-F41 HydrophobicContact CD1-CE1 4.41Å; L34-F41 HydrophobicContact CD2-CD2 4.25Å; L34-F41 HydrophobicContact CD2-CE2 4.25Å; L34-F41 HydrophobicContact CD2-CG 4.46Å; L34-F41 HydrophobicContact CD2-CZ 4.47Å; L34-A54 HydrophobicContact CB-CB 3.94Å; L34-L57 HydrophobicContact CD1-CD1 3.65Å
35S81.6Confident77.1Confident38 Ų3854.6 Ų54.627%0.26632%0.318SS..Hα-helixtrans-64.6-33178-1750000113.1G31 I32 W33 G39G31-S35 WeakPolarHBondContact O-CB 3.36Å; G31-S35 PolarHBondContact O-N 3.1Å; I32-S35 PolarHBondContact O-N 3.49Å; W33-S35 VanDerWaalsContact C-N 3.34Å; W33-S35 PolarHBondContact O-N 2.96Å; S35-G39 CarbonylContact O-C 3.59Å
36V80.3Confident74.9Confident114 Ų11453.8 Ų53.869%0.69131%0.313SS*.Hα-helixtrans-85.3-47-178.41730000111.4I32 W33 L34I32-V36 HydrophobicContact CG2-CG2 4.29Å; I32-V36 WeakPolarHBondContact O-CG2 3.32Å; I32-V36 PolarHBondContact O-N 3.27Å; W33-V36 PolarHBondContact O-N 3.31Å; L34-V36 VanDerWaalsContact C-N 3.3Å; L34-V36 PolarHBondContact O-N 2.94Å
37T72.1Confident72.6Confident79 Ų7954.6 Ų54.649%0.48531%0.312SS..Hα-helixtrans-78.3-34.7-173.2-53.40000112.8W33W33-T37 HydrophobicContact CZ2-CG2 4.47Å; W33-T37 WeakPolarHBondContact O-CB 3.49Å; W33-T37 PolarHBondContact O-N 3.06Å; W33-T37 PolarHBondContact O-OG1 3.24Å; W33-T37 VanDerWaalsContact O-OG1 3.12Å
38Q62.2Low70.7Confident57 Ų5755.8 Ų55.827%0.26632%0.318SS..SBendtrans-112.611.8-174.3-59.9-160.143.300113.6L34 F41L34-Q38 PolarHBondContact O-N 2.95Å; L34-Q38 VanDerWaalsContact O-N 3.08Å; Q38-F41 HydrophobicContact CB-CB 4.34Å; Q38-F41 HydrophobicContact CB-CD2 3.88Å; Q38-F41 HydrophobicContact CG-CD2 4.32Å
39G60.1Low68.7Low32 Ų3258.6 Ų58.633%0.3334%0.338SS..SBendtrans63.5-145.5-173.900000111.4S35 F41S35-G39 CarbonylContact O-C 3.59Å; G39-F41 PolarHBondContact O-N 3.43Å
40N55.3Low66.9Low81 Ų8160.7 Ų60.743%0.43335%0.347SS..SBendtrans-65.881.2169.1-75.3-20000109.5A42N40-A42 PolarHBondContact O-N 2.89Å
41F56.2Low65.5Low43 Ų4360.1 Ų60.119%0.18934%0.341CS..  trans-59.1121.5178.3-179.8-99.6000110.3L34 Q38 G39 S52 A53 A54L34-F41 HydrophobicContact CB-CB 4.44Å; L34-F41 HydrophobicContact CB-CG 4.43Å; L34-F41 HydrophobicContact CD1-CD1 4.37Å; L34-F41 HydrophobicContact CD1-CE1 4.41Å; L34-F41 HydrophobicContact CD2-CD2 4.25Å; L34-F41 HydrophobicContact CD2-CE2 4.25Å; L34-F41 HydrophobicContact CD2-CG 4.46Å; L34-F41 HydrophobicContact CD2-CZ 4.47Å; Q38-F41 HydrophobicContact CB-CB 4.34Å; Q38-F41 HydrophobicContact CB-CD2 3.88Å; Q38-F41 HydrophobicContact CG-CD2 4.32Å; G39-F41 PolarHBondContact O-N 3.43Å; F41-S52 VanDerWaalsContact O-CB 3.27Å; F41-S52 WeakPolarHBondContact O-CB 3.28Å; F41-A53 HydrophobicContact CD1-CB 3.88Å; F41-A53 HydrophobicContact CE1-CB 3.99Å; F41-A53 PolarHBondContact O-N 2.78Å; F41-A54 HydrophobicContact CB-CB 3.99Å
42A55.5Low64.7Low13 Ų1360.1 Ų60.111%0.10734%0.341CS..  trans37.280.3176.100000113.3N40 L44 S52 A53 A137N40-A42 PolarHBondContact O-N 2.89Å; A42-L44 PolarHBondContact O-N 3.44Å; A42-S52 WeakPolarHBondContact O-CA 3.37Å; A42-A53 HydrophobicContact CB-CB 4.42Å; A42-A53 PolarHBondContact O-N 3.06Å; A42-A53 VanDerWaalsContact O-N 3.11Å; A42-A137 HydrophobicContact CB-CB 4.33Å
43T60Low64.2Low15 Ų1557.1 Ų57.19%0.09233%0.329CS..BIsolated β-bridgetrans-55105167-46.90000108.2S45T43-S45 VanDerWaalsContact C-N 3.28Å; T43-S45 VanDerWaalsContact CG2-O 3.24Å; T43-S45 WeakPolarHBondContact CG2-O 3.44Å
44L56.1Low64Low94 Ų9448.9 Ų48.949%0.49230%0.297SS..SBendtrans-75.4-24.4-177.4-68.7170.3000111.5A42 L51 A53 L56A42-L44 PolarHBondContact O-N 3.44Å; L44-L51 WeakPolarHBondContact CB-O 3.1Å; L44-L51 PolarHBondContact N-O 2.96Å; L44-A53 HydrophobicContact CD1-CB 4Å; L44-A53 HydrophobicContact CD2-CB 4.42Å; L44-A53 HydrophobicContact CG-CB 4.19Å; L44-L56 HydrophobicContact CD1-CD1 3.33Å; L44-L56 HydrophobicContact CD1-CG 4.26Å
45S54.5Low64.1Low7 Ų750 Ų505%0.04930%0.304CS..  trans-129.9112.7166.6-176.30000112.6T43 S47 L48 L51 Y114 D118T43-S45 VanDerWaalsContact C-N 3.28Å; T43-S45 VanDerWaalsContact CG2-O 3.24Å; T43-S45 WeakPolarHBondContact CG2-O 3.44Å; S45-S47 PolarHBondContact O-N 2.77Å; S45-S47 PolarHBondContact OG-N 3.43Å; S45-L48 CarbonylContact O-C 3.54Å; S45-L48 PolarHBondContact O-N 3.5Å; S45-L48 PolarHBondContact OG-N 2.94Å; S45-L51 PolarHBondContact N-O 3.31Å; S45-Y114 PolarHBondContact OG-OH 3.47Å; S45-D118 VanDerWaalsContact CA-CG 3.43Å; S45-D118 VanDerWaalsContact CA-OD1 3.22Å; S45-D118 WeakPolarHBondContact CA-OD1 3.42Å; S45-D118 WeakPolarHBondContact CA-OD2 3.28Å; S45-D118 WeakPolarHBondContact CB-OD1 3.41Å; S45-D118 PolarHBondContact OG-OD1 3.36Å
46S50.9Low64.4Low29 Ų2951.7 Ų51.720%0.20331%0.309CS..THydrogen-bonded Turntrans-61-25.3171.6-52.20000112.1D118 K121 G122S46-D118 VanDerWaalsContact N-CG 3.28Å; S46-D118 PolarHBondContact N-OD1 2.7Å; S46-D118 PolarHBondContact N-OD2 2.97Å; S46-D118 PolarHBondContact OG-O 3.16Å; S46-D118 PolarHBondContact OG-OD2 3.37Å; S46-K121 VanDerWaalsContact OG-CB 3.3Å; S46-K121 WeakPolarHBondContact OG-CB 3.33Å; S46-G122 PolarHBondContact OG-N 3.46Å; S46-G122 VanDerWaalsContact OG-N 3.14Å
47S49.1Very low64.9Low58 Ų5849.1 Ų49.141%0.40629%0.292SS..THydrogen-bonded Turntrans-78.3-17.5173.5-87.50000113.8S45 D118 K121S45-S47 PolarHBondContact O-N 2.77Å; S45-S47 PolarHBondContact OG-N 3.43Å; S47-D118 PolarHBondContact N-OD1 3.48Å; S47-K121 PolarHBondContact OG-NZ 2.9Å
48L55.1Low65.9Low84 Ų8447.4 Ų47.444%0.4428%0.279SS..  trans-134.184.5176.2-68.1171.2000108.6S45 S50 L51S45-L48 CarbonylContact O-C 3.54Å; S45-L48 PolarHBondContact O-N 3.5Å; S45-L48 PolarHBondContact OG-N 2.94Å; L48-S50 PolarHBondContact O-N 3.21Å; L48-L51 HydrophobicContact CB-CB 4.2Å; L48-L51 HydrophobicContact CB-CD1 3.72Å; L48-L51 HydrophobicContact CB-CG 4.32Å; L48-L51 HydrophobicContact CD1-CD1 3.4Å; L48-L51 VanDerWaalsContact CD1-CD1 3.4Å; L48-L51 HydrophobicContact CG-CD1 4.18Å; L48-L51 WeakPolarHBondContact O-CB 3.28Å; L48-L51 PolarHBondContact O-N 3.44Å
49P54.6Low67.4Low85 Ų8546.9 Ų46.955%0.55228%0.284SS*.THydrogen-bonded Turntrans-57.1-18.5-175.4-23.532.2000114.4
50S56.8Low69Low83 Ų8348.8 Ų48.858%0.5829%0.289SS*.THydrogen-bonded Turntrans-78.1-17.3174.254.10000114.1L48 S52 N55L48-S50 PolarHBondContact O-N 3.21Å; S50-S52 PolarHBondContact O-N 2.95Å; S50-N55 VanDerWaalsContact O-CB 3.31Å; S50-N55 WeakPolarHBondContact O-CB 3.47Å; S50-N55 PolarHBondContact O-ND2 2.89Å
51L63.2Low71Confident64 Ų6444.9 Ų44.934%0.33527%0.268SS..  trans-88.376.1174.9-85161.6000109.8L44 S45 L48 L56L44-L51 WeakPolarHBondContact CB-O 3.1Å; L44-L51 PolarHBondContact N-O 2.96Å; S45-L51 PolarHBondContact N-O 3.31Å; L48-L51 HydrophobicContact CB-CB 4.2Å; L48-L51 HydrophobicContact CB-CD1 3.72Å; L48-L51 HydrophobicContact CB-CG 4.32Å; L48-L51 HydrophobicContact CD1-CD1 3.4Å; L48-L51 VanDerWaalsContact CD1-CD1 3.4Å; L48-L51 HydrophobicContact CG-CD1 4.18Å; L48-L51 WeakPolarHBondContact O-CB 3.28Å; L48-L51 PolarHBondContact O-N 3.44Å; L51-L56 HydrophobicContact CD2-CD2 3.66Å; L51-L56 HydrophobicContact CD2-CG 4.25Å
52S74.1Confident73Confident1 Ų145.2 Ų45.21%0.00727%0.274CS..BIsolated β-bridgetrans-100.1153.9169.580.90000109.7F41 A42 S50 A54 N55 L56F41-S52 VanDerWaalsContact O-CB 3.27Å; F41-S52 WeakPolarHBondContact O-CB 3.28Å; A42-S52 WeakPolarHBondContact O-CA 3.37Å; S50-S52 PolarHBondContact O-N 2.95Å; S52-A54 PolarHBondContact O-N 3.25Å; S52-N55 PolarHBondContact O-N 3.33Å; S52-N55 VanDerWaalsContact O-N 3.09Å; S52-N55 WeakPolarHBondContact OG-CB 3.26Å; S52-N55 PolarHBondContact OG-N 3.15Å; S52-N55 PolarHBondContact OG-ND2 2.77Å; S52-L56 PolarHBondContact O-N 3Å
53A79.4Confident74.9Confident22 Ų2249 Ų4918%0.18229%0.291CS..Hα-helixtrans-59.1-34.5176.500000111.6F41 A42 L44 L56 L57F41-A53 HydrophobicContact CD1-CB 3.88Å; F41-A53 HydrophobicContact CE1-CB 3.99Å; F41-A53 PolarHBondContact O-N 2.78Å; A42-A53 HydrophobicContact CB-CB 4.42Å; A42-A53 PolarHBondContact O-N 3.06Å; A42-A53 VanDerWaalsContact O-N 3.11Å; L44-A53 HydrophobicContact CD1-CB 4Å; L44-A53 HydrophobicContact CD2-CB 4.42Å; L44-A53 HydrophobicContact CG-CB 4.19Å; A53-L56 PolarHBondContact O-N 3.01Å; A53-L57 WeakPolarHBondContact O-CG 3.46Å; A53-L57 PolarHBondContact O-N 3.31Å
54A83.9Confident76.6Confident0 Ų050.5 Ų50.50%030%0.298CS..Hα-helixtrans-63.6-45.3172.800000112.5L34 F41 S52 L56 L57 I58L34-A54 HydrophobicContact CB-CB 3.94Å; F41-A54 HydrophobicContact CB-CB 3.99Å; S52-A54 PolarHBondContact O-N 3.25Å; A54-L56 VanDerWaalsContact C-N 3.32Å; A54-L56 PolarHBondContact O-N 3.13Å; A54-L57 PolarHBondContact O-N 3Å; A54-I58 VanDerWaalsContact O-CG1 3.31Å; A54-I58 WeakPolarHBondContact O-CG1 3.45Å; A54-I58 PolarHBondContact O-N 3Å
55N85.3Confident78.6Confident51 Ų5148.3 Ų48.327%0.27329%0.286SS..Hα-helixtrans-66.4-34.3179.5-71.5-12.8000112.3S50 S52 I58 A59S50-N55 VanDerWaalsContact O-CB 3.31Å; S50-N55 WeakPolarHBondContact O-CB 3.47Å; S50-N55 PolarHBondContact O-ND2 2.89Å; S52-N55 PolarHBondContact O-N 3.33Å; S52-N55 VanDerWaalsContact O-N 3.09Å; S52-N55 WeakPolarHBondContact OG-CB 3.26Å; S52-N55 PolarHBondContact OG-N 3.15Å; S52-N55 PolarHBondContact OG-ND2 2.77Å; N55-I58 PolarHBondContact O-N 3.4Å; N55-A59 WeakPolarHBondContact O-CB 3.5Å; N55-A59 PolarHBondContact O-N 3.31Å
56L87.8Confident80.6Confident74 Ų7451.1 Ų51.139%0.38730%0.303SS..Hα-helixtrans-64.3-45171.5-72.8-176.3000111.8L44 L51 S52 A53 A54 I58 A59 V60L44-L56 HydrophobicContact CD1-CD1 3.33Å; L44-L56 HydrophobicContact CD1-CG 4.26Å; L51-L56 HydrophobicContact CD2-CD2 3.66Å; L51-L56 HydrophobicContact CD2-CG 4.25Å; S52-L56 PolarHBondContact O-N 3Å; A53-L56 PolarHBondContact O-N 3.01Å; A54-L56 VanDerWaalsContact C-N 3.32Å; A54-L56 PolarHBondContact O-N 3.13Å; L56-I58 VanDerWaalsContact C-N 3.32Å; L56-I58 PolarHBondContact O-N 2.92Å; L56-A59 PolarHBondContact O-N 3.48Å; L56-V60 WeakPolarHBondContact O-CB 3.39Å; L56-V60 VanDerWaalsContact O-CG2 3.3Å; L56-V60 WeakPolarHBondContact O-CG2 3.47Å; L56-V60 PolarHBondContact O-N 3.48Å
57L91.4Very high82.7Confident60 Ų6050.7 Ų50.731%0.31430%0.298SS..Hα-helixtrans-61-41.6175.5-70.9169.6000111.6I27 V30 L34 A53 A54 G61I27-L57 HydrophobicContact CG2-CB 4.37Å; I27-L57 HydrophobicContact CG2-CD2 4Å; I27-L57 WeakPolarHBondContact CG2-O 3.39Å; V30-L57 HydrophobicContact CG1-CD1 4.45Å; L34-L57 HydrophobicContact CD1-CD1 3.65Å; A53-L57 WeakPolarHBondContact O-CG 3.46Å; A53-L57 PolarHBondContact O-N 3.31Å; A54-L57 PolarHBondContact O-N 3Å; L57-G61 WeakPolarHBondContact O-CA 3.49Å; L57-G61 PolarHBondContact O-N 3.49Å
58I92.8Very high84.9Confident43 Ų4348 Ų4822%0.22128%0.279CS..Hα-helixtrans-61.6-48.6175-68.2168.4000110.5L28 G31 I32 A54 N55 L56 T62L28-I58 HydrophobicContact CD1-CB 4.23Å; L28-I58 HydrophobicContact CD1-CG1 4.38Å; L28-I58 HydrophobicContact CD1-CG2 3.81Å; G31-I58 VanDerWaalsContact C-CG1 3.5Å; I32-I58 HydrophobicContact CG1-CD1 4.33Å; I32-I58 HydrophobicContact CG1-CG1 4.21Å; A54-I58 VanDerWaalsContact O-CG1 3.31Å; A54-I58 WeakPolarHBondContact O-CG1 3.45Å; A54-I58 PolarHBondContact O-N 3Å; N55-I58 PolarHBondContact O-N 3.4Å; L56-I58 VanDerWaalsContact C-N 3.32Å; L56-I58 PolarHBondContact O-N 2.92Å; I58-T62 VanDerWaalsContact O-CB 3.28Å; I58-T62 WeakPolarHBondContact O-CB 3.26Å; I58-T62 PolarHBondContact O-N 3.34Å; I58-T62 PolarHBondContact O-OG1 3.44Å
59A93.4Very high86.8Confident45 Ų4546.6 Ų46.637%0.37228%0.276SS..Hα-helixtrans-63.1-52.1-178.700000111.7N55 L56 T62 I63N55-A59 WeakPolarHBondContact O-CB 3.5Å; N55-A59 PolarHBondContact O-N 3.31Å; L56-A59 PolarHBondContact O-N 3.48Å; A59-T62 PolarHBondContact O-N 2.93Å; A59-I63 VanDerWaalsContact O-CG1 3.29Å; A59-I63 WeakPolarHBondContact O-CG1 3.5Å; A59-I63 PolarHBondContact O-N 3.01Å
60V94.6Very high88.7Confident72 Ų7244.7 Ų44.744%0.43626%0.261SS..Hα-helixtrans-62.7-46.4179.3172.40000110.8L56 T62 I63 I64L56-V60 WeakPolarHBondContact O-CB 3.39Å; L56-V60 VanDerWaalsContact O-CG2 3.3Å; L56-V60 WeakPolarHBondContact O-CG2 3.47Å; L56-V60 PolarHBondContact O-N 3.48Å; V60-T62 VanDerWaalsContact C-N 3.33Å; V60-T62 PolarHBondContact O-N 3.48Å; V60-I63 PolarHBondContact O-N 2.98Å; V60-I64 HydrophobicContact CG1-CD1 3.61Å; V60-I64 HydrophobicContact CG1-CG1 4.32Å; V60-I64 VanDerWaalsContact O-CG1 3.28Å; V60-I64 WeakPolarHBondContact O-CG1 3.42Å; V60-I64 PolarHBondContact O-N 3.38Å
61G97Very high90.5Very high0 Ų040.7 Ų40.70%023%0.233CC..Hα-helixtrans-59.8-42177.600000112.5L57 M65L57-G61 WeakPolarHBondContact O-CA 3.49Å; L57-G61 PolarHBondContact O-N 3.49Å; G61-M65 WeakPolarHBondContact O-CB 3.32Å; G61-M65 PolarHBondContact O-N 2.99Å
62T96.8Very high91.9Very high50 Ų5038.5 Ų38.531%0.30722%0.223SC..Hα-helixtrans-64.2-45.6176-57.50000111.7L28 I58 A59 V60 M65 V66L28-T62 WeakPolarHBondContact CD1-OG1 3.44Å; I58-T62 VanDerWaalsContact O-CB 3.28Å; I58-T62 WeakPolarHBondContact O-CB 3.26Å; I58-T62 PolarHBondContact O-N 3.34Å; I58-T62 PolarHBondContact O-OG1 3.44Å; A59-T62 PolarHBondContact O-N 2.93Å; V60-T62 VanDerWaalsContact C-N 3.33Å; V60-T62 PolarHBondContact O-N 3.48Å; T62-M65 PolarHBondContact O-N 2.95Å; T62-V66 HydrophobicContact CG2-CG2 4.41Å; T62-V66 WeakPolarHBondContact O-CG2 3.21Å; T62-V66 PolarHBondContact O-N 2.86Å
63I95.8Very high92.9Very high91 Ų9140.7 Ų40.747%0.46724%0.236SC..Hα-helixtrans-60.6-49.3178.5-69.9165.4000110.4A59 V60 M65 V66 I67 I93A59-I63 VanDerWaalsContact O-CG1 3.29Å; A59-I63 WeakPolarHBondContact O-CG1 3.5Å; A59-I63 PolarHBondContact O-N 3.01Å; V60-I63 PolarHBondContact O-N 2.98Å; I63-M65 VanDerWaalsContact C-N 3.34Å; I63-M65 PolarHBondContact O-N 3.37Å; I63-V66 PolarHBondContact O-N 3.29Å; I63-I67 HydrophobicContact CG2-CD1 3.61Å; I63-I67 WeakPolarHBondContact O-CB 3.43Å; I63-I67 VanDerWaalsContact O-CG1 3.28Å; I63-I67 WeakPolarHBondContact O-CG1 3.4Å; I63-I67 PolarHBondContact O-N 3.11Å; I63-I93 HydrophobicContact CG2-CD1 4.15Å
64I96.7Very high93.4Very high48 Ų4839.7 Ų39.725%0.24623%0.228CC..Hα-helixtrans-60.8-44.2178.6-66.6170.7000110.7F20 I27 V60 I67 G68F20-I64 HydrophobicContact CB-CG2 4.23Å; F20-I64 HydrophobicContact CD1-CG2 4.43Å; F20-I64 VanDerWaalsContact O-CG2 3.25Å; F20-I64 WeakPolarHBondContact O-CG2 3.36Å; I27-I64 HydrophobicContact CD1-CD1 4.17Å; V60-I64 HydrophobicContact CG1-CD1 3.61Å; V60-I64 HydrophobicContact CG1-CG1 4.32Å; V60-I64 VanDerWaalsContact O-CG1 3.28Å; V60-I64 WeakPolarHBondContact O-CG1 3.42Å; V60-I64 PolarHBondContact O-N 3.38Å; I64-I67 PolarHBondContact O-N 2.92Å; I64-G68 PolarHBondContact O-N 3.46Å
65M97.1Very high93.7Very high47 Ų4739.7 Ų39.723%0.23223%0.228CC..Hα-helixtrans-60.8-48177.5-178.3-175.466.200111.5W21 C25 L28 G61 T62 I63 I67 G68 C69W21-M65 VanDerWaalsContact CD1-O 3.31Å; C25-M65 VanDerWaalsContact SG-SD 3.66Å; L28-M65 HydrophobicContact CD2-CE 3.85Å; L28-M65 HydrophobicContact CD2-SD 4.03Å; G61-M65 WeakPolarHBondContact O-CB 3.32Å; G61-M65 PolarHBondContact O-N 2.99Å; T62-M65 PolarHBondContact O-N 2.95Å; I63-M65 VanDerWaalsContact C-N 3.34Å; I63-M65 PolarHBondContact O-N 3.37Å; M65-I67 PolarHBondContact O-N 3.3Å; M65-G68 PolarHBondContact O-N 3.13Å; M65-C69 WeakPolarHBondContact O-CB 3.38Å; M65-C69 PolarHBondContact O-N 2.92Å
66V96.4Very high93.9Very high66 Ų6641 Ų4140%0.424%0.238SC..Hα-helixtrans-62.8-45.8179.81700000110.9T62 I63 C69 L70T62-V66 HydrophobicContact CG2-CG2 4.41Å; T62-V66 WeakPolarHBondContact O-CG2 3.21Å; T62-V66 PolarHBondContact O-N 2.86Å; I63-V66 PolarHBondContact O-N 3.29Å; V66-C69 PolarHBondContact O-N 3.31Å; V66-L70 HydrophobicContact CG1-CD1 4.02Å; V66-L70 HydrophobicContact CG1-CG 4.45Å; V66-L70 WeakPolarHBondContact O-CG 3.36Å; V66-L70 PolarHBondContact O-N 3.14Å
67I95.9Very high93.9Very high21 Ų2144.9 Ų44.911%0.10825%0.251CS..Hα-helixtrans-64.5-45.8-179.9-68.8169.5000111I63 I64 M65 C69 L70 G71 F86 L89 L90 I93I63-I67 HydrophobicContact CG2-CD1 3.61Å; I63-I67 WeakPolarHBondContact O-CB 3.43Å; I63-I67 VanDerWaalsContact O-CG1 3.28Å; I63-I67 WeakPolarHBondContact O-CG1 3.4Å; I63-I67 PolarHBondContact O-N 3.11Å; I64-I67 PolarHBondContact O-N 2.92Å; M65-I67 PolarHBondContact O-N 3.3Å; I67-C69 VanDerWaalsContact C-N 3.31Å; I67-C69 PolarHBondContact O-N 2.98Å; I67-L70 PolarHBondContact O-N 2.81Å; I67-G71 PolarHBondContact O-N 2.65Å; I67-F86 HydrophobicContact CG2-CD2 3.91Å; I67-F86 HydrophobicContact CG2-CE2 3.65Å; I67-L89 HydrophobicContact CG1-CD1 4.42Å; I67-L90 HydrophobicContact CG2-CD2 3.95Å; I67-I93 HydrophobicContact CD1-CD1 3.2Å
68G95.8Very high93.7Very high1 Ų146.6 Ų46.61%0.0126%0.258CS..Hα-helixtrans-60.6-39.8176.100000112.5I64 M65 G71 C72I64-G68 PolarHBondContact O-N 3.46Å; M65-G68 PolarHBondContact O-N 3.13Å; G68-G71 PolarHBondContact O-N 3.25Å; G68-C72 WeakPolarHBondContact O-CB 3.12Å; G68-C72 PolarHBondContact O-N 3.44Å; G68-C72 PolarHBondContact O-SG 3.21Å
69C94.8Very high93.5Very high55 Ų5546.1 Ų46.137%0.37226%0.258SS..Hα-helixtrans-63.9-48.2175-1760000111.8M65 V66 I67 G71 C72 V73M65-C69 WeakPolarHBondContact O-CB 3.38Å; M65-C69 PolarHBondContact O-N 2.92Å; V66-C69 PolarHBondContact O-N 3.31Å; I67-C69 VanDerWaalsContact C-N 3.31Å; I67-C69 PolarHBondContact O-N 2.98Å; C69-G71 VanDerWaalsContact C-N 3.34Å; C69-G71 PolarHBondContact O-N 2.86Å; C69-C72 PolarHBondContact O-N 3.03Å; C69-V73 WeakPolarHBondContact O-CB 3.49Å; C69-V73 WeakPolarHBondContact O-CG2 3.25Å; C69-V73 PolarHBondContact O-N 2.92Å
70L94.8Very high93.2Very high44 Ų4446.6 Ų46.623%0.2325%0.251CS..Hα-helixtrans-60.6-42.9177.5-71.5173.6000111.9V66 I67 G74 L82 L89V66-L70 HydrophobicContact CG1-CD1 4.02Å; V66-L70 HydrophobicContact CG1-CG 4.45Å; V66-L70 WeakPolarHBondContact O-CG 3.36Å; V66-L70 PolarHBondContact O-N 3.14Å; I67-L70 PolarHBondContact O-N 2.81Å; L70-G74 WeakPolarHBondContact O-CA 3.31Å; L70-G74 PolarHBondContact O-N 3.35Å; L70-L82 HydrophobicContact CD2-CG 4.42Å; L70-L89 HydrophobicContact CD1-CD1 3.51Å
71G93.5Very high93.1Very high0 Ų047.4 Ų47.40%026%0.257CS..Hα-helixtrans-62.4-46.2176.100000112.3I67 G68 C69 A75I67-G71 PolarHBondContact O-N 2.65Å; G68-G71 PolarHBondContact O-N 3.25Å; C69-G71 VanDerWaalsContact C-N 3.34Å; C69-G71 PolarHBondContact O-N 2.86Å; G71-A75 VanDerWaalsContact O-CB 3.28Å; G71-A75 WeakPolarHBondContact O-CB 3.46Å; G71-A75 PolarHBondContact O-N 3.43Å
72C93.3Very high92.9Very high17 Ų1749.7 Ų49.712%0.11527%0.269CS..Hα-helixtrans-62-54.7176.5-72.20000112.1N17 L18 G68 C69 G74 A75 V76N17-C72 WeakPolarHBondContact CB-SG 3.46Å; L18-C72 PolarHBondContact N-SG 2.87Å; G68-C72 WeakPolarHBondContact O-CB 3.12Å; G68-C72 PolarHBondContact O-N 3.44Å; G68-C72 PolarHBondContact O-SG 3.21Å; C69-C72 PolarHBondContact O-N 3.03Å; C72-G74 VanDerWaalsContact C-N 3.34Å; C72-G74 PolarHBondContact O-N 3.23Å; C72-A75 PolarHBondContact O-N 2.87Å; C72-V76 WeakPolarHBondContact O-CB 3.48Å; C72-V76 VanDerWaalsContact O-CG2 3.31Å; C72-V76 WeakPolarHBondContact O-CG2 3.43Å; C72-V76 PolarHBondContact O-N 3.19Å
73V93.6Very high92.7Very high48 Ų4847.3 Ų47.329%0.29126%0.255SS..Hα-helixtrans-67.5-37.9-175.8179.90000110.6C69 V76 K77 L82C69-V73 WeakPolarHBondContact O-CB 3.49Å; C69-V73 WeakPolarHBondContact O-CG2 3.25Å; C69-V73 PolarHBondContact O-N 2.92Å; V73-V76 PolarHBondContact O-N 3.49Å; V73-K77 HydrophobicContact CG1-CD 3.75Å; V73-K77 HydrophobicContact CG1-CG 4.07Å; V73-K77 VanDerWaalsContact O-CB 3.29Å; V73-K77 WeakPolarHBondContact O-CB 3.4Å; V73-K77 PolarHBondContact O-N 3.31Å; V73-L82 HydrophobicContact CB-CD2 3.93Å; V73-L82 HydrophobicContact CG1-CD2 3.47Å; V73-L82 VanDerWaalsContact CG1-CD2 3.47Å
74G91Very high92.6Very high0 Ų046.2 Ų46.20%025%0.249CC..Hα-helixtrans-60.1-45.1174.400000112.2L70 C72 E78 S79L70-G74 WeakPolarHBondContact O-CA 3.31Å; L70-G74 PolarHBondContact O-N 3.35Å; C72-G74 VanDerWaalsContact C-N 3.34Å; C72-G74 PolarHBondContact O-N 3.23Å; G74-E78 VanDerWaalsContact O-CA 3.26Å; G74-E78 WeakPolarHBondContact O-CA 3.22Å; G74-E78 PolarHBondContact O-N 3.31Å; G74-S79 PolarHBondContact O-N 2.91Å
75A89.6Confident92.5Very high0 Ų045.8 Ų45.80%025%0.253CS..Hα-helixtrans-72.8-35.7178.200000113.5R10 M13 V14 G71 C72R10-A75 PolarHBondContact NE-O 3.24Å; M13-A75 HydrophobicContact CB-CB 4.48Å; M13-A75 HydrophobicContact CG-CB 4.14Å; M13-A75 HydrophobicContact SD-CB 4Å; V14-A75 HydrophobicContact CG2-CB 3.64Å; G71-A75 VanDerWaalsContact O-CB 3.28Å; G71-A75 WeakPolarHBondContact O-CB 3.46Å; G71-A75 PolarHBondContact O-N 3.43Å; C72-A75 PolarHBondContact O-N 2.87Å
76V90.2Very high92.5Very high80 Ų8043.7 Ų43.749%0.48524%0.243SC..Hα-helixtrans-73.3-47.7178.1171.20000111.4R10 V14 C72 V73 E78R10-V76 PolarHBondContact NH2-O 3.44Å; V14-V76 HydrophobicContact CG1-CG2 4.28Å; V14-V76 HydrophobicContact CG2-CG2 3.84Å; C72-V76 WeakPolarHBondContact O-CB 3.48Å; C72-V76 VanDerWaalsContact O-CG2 3.31Å; C72-V76 WeakPolarHBondContact O-CG2 3.43Å; C72-V76 PolarHBondContact O-N 3.19Å; V73-V76 PolarHBondContact O-N 3.49Å; V76-E78 VanDerWaalsContact C-N 3.29Å; V76-E78 PolarHBondContact O-N 2.8Å
77K87.9Confident92.4Very high155 Ų15542.4 Ų42.467%0.67423%0.231SC*.Hα-helixtrans-83.1-5.5-178.4-64.8-169.2176-179.50113.6V73 S79V73-K77 HydrophobicContact CG1-CD 3.75Å; V73-K77 HydrophobicContact CG1-CG 4.07Å; V73-K77 VanDerWaalsContact O-CB 3.29Å; V73-K77 WeakPolarHBondContact O-CB 3.4Å; V73-K77 PolarHBondContact O-N 3.31Å; K77-S79 PolarHBondContact O-N 2.94Å
78E86Confident92.5Very high95 Ų9545.3 Ų45.344%0.44425%0.246SC..THydrogen-bonded Turntrans5033.4-172.8-61.5-178170.500111.9R10 G74 V76 R80R10-E78 IonicContact CZ-OE1 3.06Å; R10-E78 IonicContact NE-OE1 3.43Å; R10-E78 PolarHBondContact NE-OE1 3.14Å; R10-E78 IonicContact NH1-OE1 2.7Å; R10-E78 PolarHBondContact NH1-OE1 2.87Å; R10-E78 IonicContact NH2-OE1 3.73Å; G74-E78 VanDerWaalsContact O-CA 3.26Å; G74-E78 WeakPolarHBondContact O-CA 3.22Å; G74-E78 PolarHBondContact O-N 3.31Å; V76-E78 VanDerWaalsContact C-N 3.29Å; V76-E78 PolarHBondContact O-N 2.8Å; E78-R80 PolarHBondContact O-N 3.03Å
79S88.9Confident92.5Very high34 Ų3448.2 Ų48.224%0.23826%0.261CS..  trans-83.4110.4-173.5-179.40000109.9G74 K77 P81 L82 L83G74-S79 PolarHBondContact O-N 2.91Å; K77-S79 PolarHBondContact O-N 2.94Å; S79-P81 WeakPolarHBondContact OG-CD 3.4Å; S79-L82 PolarHBondContact O-N 3.49Å; S79-L82 VanDerWaalsContact O-N 3.14Å; S79-L83 PolarHBondContact O-N 3.31Å
80R88.4Confident92.5Very high55 Ų5546.3 Ų46.321%0.20825%0.247CC..Hα-helixtrans-49.9-50.8177.6-67.3-177-175.2168.44.8115.1E78 L82 L83 L84 F227 A230 V231 E234E78-R80 PolarHBondContact O-N 3.03Å; R80-L82 VanDerWaalsContact C-N 3.26Å; R80-L82 PolarHBondContact O-N 3.44Å; R80-L83 PolarHBondContact O-N 3.26Å; R80-L84 WeakPolarHBondContact O-CB 3.42Å; R80-L84 PolarHBondContact O-N 3.47Å; R80-F227 HydrophobicContact CB-CD2 4.18Å; R80-F227 HydrophobicContact CB-CE2 3.87Å; R80-F227 HydrophobicContact CG-CD2 4.37Å; R80-F227 HydrophobicContact CG-CE2 4.26Å; R80-A230 HydrophobicContact CG-CB 3.95Å; R80-A230 VanDerWaalsContact NH2-C 3.35Å; R80-A230 PolarHBondContact NH2-O 3.27Å; R80-V231 PolarHBondContact NH2-O 2.81Å; R80-E234 IonicContact CZ-OE1 2.64Å; R80-E234 VanDerWaalsContact CZ-OE1 3.25Å; R80-E234 IonicContact CZ-OE2 3.25Å; R80-E234 IonicContact NE-OE1 3.22Å; R80-E234 VanDerWaalsContact NH1-CD 3.28Å; R80-E234 IonicContact NH1-OE1 2.68Å; R80-E234 IonicContact NH1-OE2 3.7Å; R80-E234 PolarHBondContact NH1-OE2 3.15Å; R80-E234 IonicContact NH2-OE1 3.36Å; R80-E234 PolarHBondContact NH2-OE1 3.08Å; R80-E234 IonicContact NH2-OE2 3.51Å; R80-E234 PolarHBondContact NH2-OE2 3.38Å
81P92.6Very high92.6Very high89 Ų8946.8 Ų46.858%0.57825%0.25SS*.Hα-helixtrans-62.9-34.1-179.723.6-34.3000112.3S79 A85S79-P81 WeakPolarHBondContact OG-CD 3.4Å; P81-A85 VanDerWaalsContact O-CB 3.27Å; P81-A85 WeakPolarHBondContact O-CB 3.29Å; P81-A85 PolarHBondContact O-N 2.82Å
82L92.9Very high92.8Very high47 Ų4751.4 Ų51.425%0.24627%0.274CS..Hα-helixtrans-71-43.3176.5-89.165.3000111.9L70 V73 S79 R80 L84 A85 F86L70-L82 HydrophobicContact CD2-CG 4.42Å; V73-L82 HydrophobicContact CB-CD2 3.93Å; V73-L82 HydrophobicContact CG1-CD2 3.47Å; V73-L82 VanDerWaalsContact CG1-CD2 3.47Å; S79-L82 PolarHBondContact O-N 3.49Å; S79-L82 VanDerWaalsContact O-N 3.14Å; R80-L82 VanDerWaalsContact C-N 3.26Å; R80-L82 PolarHBondContact O-N 3.44Å; L82-L84 VanDerWaalsContact C-N 3.33Å; L82-L84 PolarHBondContact O-N 2.88Å; L82-A85 PolarHBondContact O-N 3.46Å; L82-F86 WeakPolarHBondContact O-CB 3.43Å; L82-F86 PolarHBondContact O-N 2.88Å
83L92Very high92.9Very high1 Ų152.5 Ų52.51%0.00528%0.278CS..Hα-helixtrans-62.4-40.9175.7-72.9170.2000111.6M13 S79 R80 F86 F87 M226M13-L83 HydrophobicContact CE-CD2 3.91Å; M13-L83 HydrophobicContact SD-CD2 4.43Å; S79-L83 PolarHBondContact O-N 3.31Å; R80-L83 PolarHBondContact O-N 3.26Å; L83-F86 PolarHBondContact O-N 2.86Å; L83-F87 PolarHBondContact O-N 3.06Å; L83-M226 HydrophobicContact CD1-CB 4.16Å
84L93.2Very high93.1Very high67 Ų6752.6 Ų52.635%0.35128%0.275SS..Hα-helixtrans-67.8-42.5176.4-17465.2000111.7R80 L82 F86 F87 I88 F227R80-L84 WeakPolarHBondContact O-CB 3.42Å; R80-L84 PolarHBondContact O-N 3.47Å; L82-L84 VanDerWaalsContact C-N 3.33Å; L82-L84 PolarHBondContact O-N 2.88Å; L84-F86 PolarHBondContact O-N 2.87Å; L84-F87 PolarHBondContact O-N 3.13Å; L84-I88 HydrophobicContact CD1-CD1 4.33Å; L84-I88 HydrophobicContact CG-CD1 3.96Å; L84-I88 VanDerWaalsContact O-CG1 3.31Å; L84-I88 WeakPolarHBondContact O-CG1 3.41Å; L84-I88 PolarHBondContact O-N 3.14Å; L84-F227 HydrophobicContact CB-CD2 4.39Å; L84-F227 HydrophobicContact CB-CE2 4.14Å
85A95.4Very high93.3Very high39 Ų3958.4 Ų58.432%0.32230%0.301SS..Hα-helixtrans-60.9-44.517500000111.6P81 L82 I88 L89P81-A85 VanDerWaalsContact O-CB 3.27Å; P81-A85 WeakPolarHBondContact O-CB 3.29Å; P81-A85 PolarHBondContact O-N 2.82Å; L82-A85 PolarHBondContact O-N 3.46Å; A85-I88 PolarHBondContact O-N 3.47Å; A85-L89 WeakPolarHBondContact O-CB 3.46Å; A85-L89 VanDerWaalsContact O-CG 3.27Å; A85-L89 WeakPolarHBondContact O-CG 3.47Å; A85-L89 PolarHBondContact O-N 2.87Å
86F95.6Very high93.6Very high4 Ų463.5 Ų63.52%0.01833%0.327CS..Hα-helixtrans-58.7-46.7174.1173.5-98.7000111.9M13 N17 I67 L82 L83 L84 L89 L90M13-F86 HydrophobicContact CE-CD1 3.81Å; M13-F86 HydrophobicContact CE-CE1 3.56Å; M13-F86 HydrophobicContact CE-CZ 4.23Å; N17-F86 WeakPolarHBondContact OD1-CE2 3.35Å; N17-F86 WeakPolarHBondContact OD1-CZ 3.31Å; I67-F86 HydrophobicContact CG2-CD2 3.91Å; I67-F86 HydrophobicContact CG2-CE2 3.65Å; L82-F86 WeakPolarHBondContact O-CB 3.43Å; L82-F86 PolarHBondContact O-N 2.88Å; L83-F86 PolarHBondContact O-N 2.86Å; L84-F86 PolarHBondContact O-N 2.87Å; F86-L89 PolarHBondContact O-N 3.49Å; F86-L90 HydrophobicContact CD1-CD1 4.13Å; F86-L90 HydrophobicContact CE1-CD1 3.41Å; F86-L90 VanDerWaalsContact CE1-CD1 3.41Å; F86-L90 HydrophobicContact CE1-CG 4.23Å; F86-L90 HydrophobicContact CE2-CD1 4.01Å; F86-L90 HydrophobicContact CE2-CG 4.17Å; F86-L90 HydrophobicContact CZ-CD1 3.35Å; F86-L90 HydrophobicContact CZ-CG 4.02Å; F86-L90 PolarHBondContact O-N 3.3Å
87F95.9Very high93.8Very high38 Ų3862.4 Ų62.417%0.16732%0.317CS..Hα-helixtrans-59.1-49.1176.1175.5-91.9000112.2L83 L84 L89 L90 L91 L220 S223 M224L83-F87 PolarHBondContact O-N 3.06Å; L84-F87 PolarHBondContact O-N 3.13Å; F87-L89 VanDerWaalsContact C-N 3.33Å; F87-L89 PolarHBondContact O-N 3.11Å; F87-L90 PolarHBondContact O-N 2.88Å; F87-L91 HydrophobicContact CE1-CD2 3.9Å; F87-L91 HydrophobicContact CZ-CD2 4.27Å; F87-L91 VanDerWaalsContact O-CB 3.32Å; F87-L91 WeakPolarHBondContact O-CB 3.38Å; F87-L91 PolarHBondContact O-N 3.32Å; F87-L220 HydrophobicContact CD2-CB 4.24Å; F87-L220 HydrophobicContact CD2-CD2 3.44Å; F87-L220 VanDerWaalsContact CD2-CD2 3.44Å; F87-L220 HydrophobicContact CD2-CG 4.47Å; F87-L220 HydrophobicContact CE2-CB 4.05Å; F87-L220 HydrophobicContact CE2-CD2 3.53Å; F87-L220 HydrophobicContact CE2-CG 4.38Å; F87-L220 HydrophobicContact CG-CD2 4.12Å; F87-L220 HydrophobicContact CZ-CD2 4.24Å; F87-L220 WeakPolarHBondContact O-CD2 3.48Å; F87-S223 WeakPolarHBondContact CD2-OG 3.48Å; F87-M224 HydrophobicContact CD1-CE 3.42Å; F87-M224 VanDerWaalsContact CD1-CE 3.42Å; F87-M224 HydrophobicContact CD2-CE 3.77Å; F87-M224 HydrophobicContact CD2-CG 3.51Å; F87-M224 HydrophobicContact CD2-SD 4.39Å; F87-M224 HydrophobicContact CE1-CE 3.28Å; F87-M224 HydrophobicContact CE2-CE 3.63Å; F87-M224 HydrophobicContact CE2-CG 3.36Å; F87-M224 HydrophobicContact CE2-SD 4.36Å; F87-M224 HydrophobicContact CG-CE 3.66Å; F87-M224 HydrophobicContact CG-CG 4.27Å; F87-M224 HydrophobicContact CZ-CE 3.39Å; F87-M224 HydrophobicContact CZ-CG 4.05Å
88I96.6Very high94.1Very high82 Ų8258.6 Ų58.642%0.42130%0.303SS..Hα-helixtrans-61.9-43.2-179.3-68.1168000110.4L84 A85 L91 L92L84-I88 HydrophobicContact CD1-CD1 4.33Å; L84-I88 HydrophobicContact CG-CD1 3.96Å; L84-I88 VanDerWaalsContact O-CG1 3.31Å; L84-I88 WeakPolarHBondContact O-CG1 3.41Å; L84-I88 PolarHBondContact O-N 3.14Å; A85-I88 PolarHBondContact O-N 3.47Å; I88-L91 PolarHBondContact O-N 3.3Å; I88-L92 HydrophobicContact CG2-CD1 4.03Å; I88-L92 HydrophobicContact CG2-CG 4.39Å; I88-L92 WeakPolarHBondContact O-CB 3.46Å; I88-L92 VanDerWaalsContact O-CG 3.29Å; I88-L92 WeakPolarHBondContact O-CG 3.45Å; I88-L92 PolarHBondContact O-N 3.36Å
89L96.3Very high94.7Very high62 Ų6258.1 Ų58.133%0.32530%0.303SS..Hα-helixtrans-63.1-45.9177.9-72.9170.9000112.2I67 L70 A85 F86 F87 L91 L92 I93I67-L89 HydrophobicContact CG1-CD1 4.42Å; L70-L89 HydrophobicContact CD1-CD1 3.51Å; A85-L89 WeakPolarHBondContact O-CB 3.46Å; A85-L89 VanDerWaalsContact O-CG 3.27Å; A85-L89 WeakPolarHBondContact O-CG 3.47Å; A85-L89 PolarHBondContact O-N 2.87Å; F86-L89 PolarHBondContact O-N 3.49Å; F87-L89 VanDerWaalsContact C-N 3.33Å; F87-L89 PolarHBondContact O-N 3.11Å; L89-L91 VanDerWaalsContact C-N 3.31Å; L89-L91 PolarHBondContact O-N 2.96Å; L89-L92 PolarHBondContact O-N 2.86Å; L89-I93 WeakPolarHBondContact O-CG1 3.43Å; L89-I93 PolarHBondContact O-N 3.38Å
90L96Very high94.9Very high15 Ų1560.1 Ų60.18%0.07932%0.317CS..Hα-helixtrans-61.8-40.5175.3-75.8-170.9000112I67 F86 F87 I93 F94 L220I67-L90 HydrophobicContact CG2-CD2 3.95Å; F86-L90 HydrophobicContact CD1-CD1 4.13Å; F86-L90 HydrophobicContact CE1-CD1 3.41Å; F86-L90 VanDerWaalsContact CE1-CD1 3.41Å; F86-L90 HydrophobicContact CE1-CG 4.23Å; F86-L90 HydrophobicContact CE2-CD1 4.01Å; F86-L90 HydrophobicContact CE2-CG 4.17Å; F86-L90 HydrophobicContact CZ-CD1 3.35Å; F86-L90 HydrophobicContact CZ-CG 4.02Å; F86-L90 PolarHBondContact O-N 3.3Å; F87-L90 PolarHBondContact O-N 2.88Å; L90-I93 PolarHBondContact O-N 3.39Å; L90-F94 WeakPolarHBondContact O-CB 3.39Å; L90-F94 PolarHBondContact O-N 3.03Å; L90-L220 HydrophobicContact CB-CD2 3.65Å; L90-L220 HydrophobicContact CB-CG 4.13Å; L90-L220 HydrophobicContact CD1-CG 4.48Å
91L96.6Very high95.1Very high55 Ų5561 Ų6129%0.28833%0.325SS..Hα-helixtrans-66.1-41.1180-174.665.5000111.4F87 I88 L89 F94 F95 L220F87-L91 HydrophobicContact CE1-CD2 3.9Å; F87-L91 HydrophobicContact CZ-CD2 4.27Å; F87-L91 VanDerWaalsContact O-CB 3.32Å; F87-L91 WeakPolarHBondContact O-CB 3.38Å; F87-L91 PolarHBondContact O-N 3.32Å; I88-L91 PolarHBondContact O-N 3.3Å; L89-L91 VanDerWaalsContact C-N 3.31Å; L89-L91 PolarHBondContact O-N 2.96Å; L91-F94 PolarHBondContact O-N 3.49Å; L91-F95 HydrophobicContact CD1-CD2 4.32Å; L91-F95 HydrophobicContact CD1-CE2 3.69Å; L91-F95 HydrophobicContact CD1-CZ 4.15Å; L91-F95 HydrophobicContact CD2-CE2 4.14Å; L91-F95 HydrophobicContact CG-CD2 4.06Å; L91-F95 HydrophobicContact CG-CE2 3.62Å; L91-F95 WeakPolarHBondContact O-CD2 3.32Å; L91-F95 PolarHBondContact O-N 2.9Å; L91-F95 VanDerWaalsContact O-N 3.11Å; L91-L220 HydrophobicContact CB-CD2 4.04Å; L91-L220 HydrophobicContact CD1-CD1 4.43Å
92L97Very high95.2Very high97 Ų9761.6 Ų61.651%0.50832%0.321SS..Hα-helixtrans-62-44.3174.5-73.1172.2000111.4I88 L89 F95 L96I88-L92 HydrophobicContact CG2-CD1 4.03Å; I88-L92 HydrophobicContact CG2-CG 4.39Å; I88-L92 WeakPolarHBondContact O-CB 3.46Å; I88-L92 VanDerWaalsContact O-CG 3.29Å; I88-L92 WeakPolarHBondContact O-CG 3.45Å; I88-L92 PolarHBondContact O-N 3.36Å; L89-L92 PolarHBondContact O-N 2.86Å; L92-F95 PolarHBondContact O-N 3.34Å; L92-L96 WeakPolarHBondContact O-CG 3.27Å; L92-L96 PolarHBondContact O-N 2.74Å
93I96.1Very high95.3Very high39 Ų3963 Ų6320%0.233%0.328CS..Hα-helixtrans-63-44.2177.3-70171.1000110.9I63 I67 L89 L90 F95 L96 E97 Q216I63-I93 HydrophobicContact CG2-CD1 4.15Å; I67-I93 HydrophobicContact CD1-CD1 3.2Å; L89-I93 WeakPolarHBondContact O-CG1 3.43Å; L89-I93 PolarHBondContact O-N 3.38Å; L90-I93 PolarHBondContact O-N 3.39Å; I93-F95 VanDerWaalsContact C-N 3.3Å; I93-F95 PolarHBondContact O-N 3.14Å; I93-L96 CarbonylContact O-C 3.35Å; I93-L96 WeakPolarHBondContact O-CB 3.43Å; I93-L96 PolarHBondContact O-N 3.45Å; I93-L96 VanDerWaalsContact O-N 3.08Å; I93-E97 HydrophobicContact CG2-CG 4.27Å; I93-E97 WeakPolarHBondContact O-CG 3.27Å; I93-E97 PolarHBondContact O-N 2.92Å; I93-Q216 VanDerWaalsContact CG2-NE2 3.35Å
94F96.1Very high95.3Very high50 Ų5068.2 Ų68.222%0.21935%0.351CS..Hα-helixtrans-57.6-42.9177.9-177.3-104.8000112.2L90 L91 E97 I98 I217L90-F94 WeakPolarHBondContact O-CB 3.39Å; L90-F94 PolarHBondContact O-N 3.03Å; L91-F94 PolarHBondContact O-N 3.49Å; F94-E97 PolarHBondContact O-N 3.34Å; F94-I98 HydrophobicContact CD1-CD1 3.92Å; F94-I98 HydrophobicContact CE1-CD1 3.44Å; F94-I98 VanDerWaalsContact CE1-CD1 3.44Å; F94-I98 HydrophobicContact CE2-CD1 4.41Å; F94-I98 HydrophobicContact CZ-CD1 3.72Å; F94-I98 WeakPolarHBondContact O-CG1 3.29Å; F94-I98 PolarHBondContact O-N 3.03Å; F94-I98 VanDerWaalsContact O-N 3.13Å; F94-I217 HydrophobicContact CE2-CD1 4.39Å; F94-I217 HydrophobicContact CE2-CG1 4.27Å
95F96.6Very high95.2Very high123 Ų12369.7 Ų69.754%0.53936%0.355SS..Hα-helixtrans-67.6-38.5174.5-72.8-54.7000113.1L91 L92 I93 E97 I98 L99L91-F95 HydrophobicContact CD1-CD2 4.32Å; L91-F95 HydrophobicContact CD1-CE2 3.69Å; L91-F95 HydrophobicContact CD1-CZ 4.15Å; L91-F95 HydrophobicContact CD2-CE2 4.14Å; L91-F95 HydrophobicContact CG-CD2 4.06Å; L91-F95 HydrophobicContact CG-CE2 3.62Å; L91-F95 WeakPolarHBondContact O-CD2 3.32Å; L91-F95 PolarHBondContact O-N 2.9Å; L91-F95 VanDerWaalsContact O-N 3.11Å; L92-F95 PolarHBondContact O-N 3.34Å; I93-F95 VanDerWaalsContact C-N 3.3Å; I93-F95 PolarHBondContact O-N 3.14Å; F95-E97 VanDerWaalsContact C-N 3.34Å; F95-I98 PolarHBondContact O-N 3.44Å; F95-L99 WeakPolarHBondContact O-CB 3.31Å; F95-L99 PolarHBondContact O-N 3.29Å
96L95.9Very high95.3Very high106 Ų10673.2 Ų73.256%0.55537%0.368SS*.Hα-helixtrans-63-40.6174.9-72.4173.2000111.4L92 I93 L99 S100L92-L96 WeakPolarHBondContact O-CG 3.27Å; L92-L96 PolarHBondContact O-N 2.74Å; I93-L96 CarbonylContact O-C 3.35Å; I93-L96 WeakPolarHBondContact O-CB 3.43Å; I93-L96 PolarHBondContact O-N 3.45Å; I93-L96 VanDerWaalsContact O-N 3.08Å; L96-L99 PolarHBondContact O-N 3.32Å; L96-S100 VanDerWaalsContact O-CB 3.31Å; L96-S100 WeakPolarHBondContact O-CB 3.36Å; L96-S100 PolarHBondContact O-N 3.4Å; L96-S100 PolarHBondContact O-OG 2.9Å; L96-S100 VanDerWaalsContact O-OG 3.07Å
97E94.3Very high95.2Very high58 Ų5879.2 Ų79.227%0.27139%0.391SS..Hα-helixtrans-62.2-47.2176.4-74.7-179177.700111.8I93 F94 F95 L99 S100 I101 Q216I93-E97 HydrophobicContact CG2-CG 4.27Å; I93-E97 WeakPolarHBondContact O-CG 3.27Å; I93-E97 PolarHBondContact O-N 2.92Å; F94-E97 PolarHBondContact O-N 3.34Å; F95-E97 VanDerWaalsContact C-N 3.34Å; E97-L99 VanDerWaalsContact C-N 3.33Å; E97-L99 PolarHBondContact O-N 3.36Å; E97-S100 PolarHBondContact O-N 2.95Å; E97-I101 WeakPolarHBondContact O-CB 3.31Å; E97-I101 VanDerWaalsContact O-CG1 3.27Å; E97-I101 WeakPolarHBondContact O-CG1 3.32Å; E97-I101 PolarHBondContact O-N 3.29Å; E97-Q216 PolarHBondContact OE1-NE2 2.98Å; E97-Q216 PolarHBondContact OE2-NE2 3.38Å; E97-Q216 PolarHBondContact OE2-OE1 2.97Å
98I95Very high95.1Very high75 Ų7581.9 Ų81.939%0.38540%0.404SS..Hα-helixtrans-60.3-46176-67.4170.6000110.5F94 F95 I101 M102F94-I98 HydrophobicContact CD1-CD1 3.92Å; F94-I98 HydrophobicContact CE1-CD1 3.44Å; F94-I98 VanDerWaalsContact CE1-CD1 3.44Å; F94-I98 HydrophobicContact CE2-CD1 4.41Å; F94-I98 HydrophobicContact CZ-CD1 3.72Å; F94-I98 WeakPolarHBondContact O-CG1 3.29Å; F94-I98 PolarHBondContact O-N 3.03Å; F94-I98 VanDerWaalsContact O-N 3.13Å; F95-I98 PolarHBondContact O-N 3.44Å; I98-I101 PolarHBondContact O-N 2.96Å; I98-M102 WeakPolarHBondContact O-CG 3.15Å; I98-M102 PolarHBondContact O-N 3.11Å
99L96.6Very high94.9Very high84 Ų8482.6 Ų82.644%0.4441%0.409SS..Hα-helixtrans-61.9-46.4179.1-179.563.8000111.3F95 L96 E97 I101 M102 L103F95-L99 WeakPolarHBondContact O-CB 3.31Å; F95-L99 PolarHBondContact O-N 3.29Å; L96-L99 PolarHBondContact O-N 3.32Å; E97-L99 VanDerWaalsContact C-N 3.33Å; E97-L99 PolarHBondContact O-N 3.36Å; L99-I101 PolarHBondContact O-N 3.5Å; L99-M102 PolarHBondContact O-N 3.33Å; L99-L103 HydrophobicContact CD1-CD1 4.13Å; L99-L103 HydrophobicContact CD1-CG 4.15Å; L99-L103 HydrophobicContact CG-CD1 3.95Å; L99-L103 HydrophobicContact CG-CG 4.36Å; L99-L103 WeakPolarHBondContact O-CB 3.27Å; L99-L103 VanDerWaalsContact O-CG 3.28Å; L99-L103 WeakPolarHBondContact O-CG 3.5Å; L99-L103 PolarHBondContact O-N 3.49Å
100S93.3Very high94.8Very high76 Ų7683.7 Ų83.753%0.53141%0.412SS..Hα-helixtrans-60.3-43.6177.8-71.40000111.9L96 E97 L103 F104L96-S100 VanDerWaalsContact O-CB 3.31Å; L96-S100 WeakPolarHBondContact O-CB 3.36Å; L96-S100 PolarHBondContact O-N 3.4Å; L96-S100 PolarHBondContact O-OG 2.9Å; L96-S100 VanDerWaalsContact O-OG 3.07Å; E97-S100 PolarHBondContact O-N 2.95Å; S100-L103 PolarHBondContact O-N 3.38Å; S100-F104 VanDerWaalsContact O-CB 3.29Å; S100-F104 WeakPolarHBondContact O-CB 3.49Å; S100-F104 PolarHBondContact O-N 2.91Å
101I93Very high94.5Very high75 Ų7586 Ų8639%0.38542%0.424SS..Hα-helixtrans-63.3-46.8176.7-68.8167.3000110.5E97 I98 L99 L103 F104 F105E97-I101 WeakPolarHBondContact O-CB 3.31Å; E97-I101 VanDerWaalsContact O-CG1 3.27Å; E97-I101 WeakPolarHBondContact O-CG1 3.32Å; E97-I101 PolarHBondContact O-N 3.29Å; I98-I101 PolarHBondContact O-N 2.96Å; L99-I101 PolarHBondContact O-N 3.5Å; I101-L103 PolarHBondContact O-N 3.48Å; I101-F104 PolarHBondContact O-N 2.91Å; I101-F105 HydrophobicContact CG2-CD2 3.78Å; I101-F105 HydrophobicContact CG2-CE2 3.64Å; I101-F105 WeakPolarHBondContact O-CD2 3.32Å; I101-F105 PolarHBondContact O-N 2.89Å; I101-F105 VanDerWaalsContact O-N 3.11Å
102M95.3Very high94.2Very high101 Ų10185.3 Ų85.350%0.49842%0.42SS..Hα-helixtrans-61.1-46.9177.6-72.2-154.8-45.700112I98 L99 F104 F105 I106I98-M102 WeakPolarHBondContact O-CG 3.15Å; I98-M102 PolarHBondContact O-N 3.11Å; L99-M102 PolarHBondContact O-N 3.33Å; M102-F104 VanDerWaalsContact C-N 3.31Å; M102-F104 PolarHBondContact O-N 3.48Å; M102-F105 PolarHBondContact O-N 2.94Å; M102-I106 HydrophobicContact CB-CD1 4.49Å; M102-I106 WeakPolarHBondContact O-CB 3.48Å; M102-I106 VanDerWaalsContact O-CG1 3.23Å; M102-I106 WeakPolarHBondContact O-CG1 3.33Å; M102-I106 PolarHBondContact O-N 2.89Å
103L94.7Very high94Very high75 Ų7586.7 Ų86.739%0.39342%0.419SS..Hα-helixtrans-62.2-40.2178.7-71.6176000111.5L99 S100 I101 F105 I106 Y107L99-L103 HydrophobicContact CD1-CD1 4.13Å; L99-L103 HydrophobicContact CD1-CG 4.15Å; L99-L103 HydrophobicContact CG-CD1 3.95Å; L99-L103 HydrophobicContact CG-CG 4.36Å; L99-L103 WeakPolarHBondContact O-CB 3.27Å; L99-L103 VanDerWaalsContact O-CG 3.28Å; L99-L103 WeakPolarHBondContact O-CG 3.5Å; L99-L103 PolarHBondContact O-N 3.49Å; S100-L103 PolarHBondContact O-N 3.38Å; I101-L103 PolarHBondContact O-N 3.48Å; L103-F105 PolarHBondContact O-N 3.46Å; L103-I106 PolarHBondContact O-N 3.35Å; L103-Y107 HydrophobicContact CB-CD2 4.48Å; L103-Y107 HydrophobicContact CD2-CD2 3.97Å; L103-Y107 HydrophobicContact CD2-CE2 3.66Å; L103-Y107 WeakPolarHBondContact O-CB 3.23Å; L103-Y107 WeakPolarHBondContact O-CD2 3.29Å; L103-Y107 PolarHBondContact O-N 2.8Å
104F91.7Very high93.7Very high111 Ų11189.6 Ų89.649%0.48743%0.428SS..Hα-helixtrans-58-47.3176.3178.8-96.6000111.6S100 I101 M102 Q108 I111S100-F104 VanDerWaalsContact O-CB 3.29Å; S100-F104 WeakPolarHBondContact O-CB 3.49Å; S100-F104 PolarHBondContact O-N 2.91Å; I101-F104 PolarHBondContact O-N 2.91Å; M102-F104 VanDerWaalsContact C-N 3.31Å; M102-F104 PolarHBondContact O-N 3.48Å; F104-Q108 WeakPolarHBondContact O-CA 3.5Å; F104-Q108 WeakPolarHBondContact O-CB 3.28Å; F104-Q108 PolarHBondContact O-N 3.39Å; F104-I111 HydrophobicContact CB-CD1 4.5Å; F104-I111 HydrophobicContact CD2-CD1 3.93Å; F104-I111 HydrophobicContact CE2-CG2 4.47Å
105F92.4Very high93.4Very high98 Ų9888.5 Ų88.543%0.4343%0.429SS..Hα-helixtrans-70-41178.5-78.2-63.9000113.7I101 M102 L103 Y107 W206I101-F105 HydrophobicContact CG2-CD2 3.78Å; I101-F105 HydrophobicContact CG2-CE2 3.64Å; I101-F105 WeakPolarHBondContact O-CD2 3.32Å; I101-F105 PolarHBondContact O-N 2.89Å; I101-F105 VanDerWaalsContact O-N 3.11Å; M102-F105 PolarHBondContact O-N 2.94Å; L103-F105 PolarHBondContact O-N 3.46Å; F105-Y107 VanDerWaalsContact C-N 3.34Å; F105-W206 AromaticContact CE2-CH2 3.75Å; F105-W206 HydrophobicContact CE2-CH2 3.75Å; F105-W206 HydrophobicContact CE2-CZ2 4.39Å; F105-W206 AromaticContact CZ-CH2 3.49Å; F105-W206 HydrophobicContact CZ-CH2 3.49Å; F105-W206 VanDerWaalsContact CZ-CH2 3.49Å; F105-W206 AromaticContact CZ-CZ2 3.66Å; F105-W206 HydrophobicContact CZ-CZ2 3.66Å
106I95.9Very high93.1Very high114 Ų11485.4 Ų85.459%0.58542%0.416SS*.Hα-helixtrans-65.6-40.5-179.7-69.6166.4000110.9M102 L103M102-I106 HydrophobicContact CB-CD1 4.49Å; M102-I106 WeakPolarHBondContact O-CB 3.48Å; M102-I106 VanDerWaalsContact O-CG1 3.23Å; M102-I106 WeakPolarHBondContact O-CG1 3.33Å; M102-I106 PolarHBondContact O-N 2.89Å; L103-I106 PolarHBondContact O-N 3.35Å
107Y94.5Very high92.9Very high130 Ų13086.2 Ų86.251%0.5141%0.411SS..THydrogen-bonded Turntrans-106.421.3-173.9-63.7-73000113.5L103 F105 D109 E110 I111L103-Y107 HydrophobicContact CB-CD2 4.48Å; L103-Y107 HydrophobicContact CD2-CD2 3.97Å; L103-Y107 HydrophobicContact CD2-CE2 3.66Å; L103-Y107 WeakPolarHBondContact O-CB 3.23Å; L103-Y107 WeakPolarHBondContact O-CD2 3.29Å; L103-Y107 PolarHBondContact O-N 2.8Å; F105-Y107 VanDerWaalsContact C-N 3.34Å; Y107-D109 VanDerWaalsContact C-N 3.27Å; Y107-D109 PolarHBondContact O-N 3.45Å; Y107-D109 VanDerWaalsContact O-N 3.16Å; Y107-E110 PolarHBondContact O-N 2.82Å; Y107-I111 WeakPolarHBondContact O-CG1 3.45Å; Y107-I111 PolarHBondContact O-N 3.45Å
108Q92.5Very high92.4Very high93 Ų9383.8 Ų83.844%0.43540%0.4SS..Hα-helixtrans-50.6-44.7-174.965.5-179.4-0.600112.9F104 E110 I111 D112F104-Q108 WeakPolarHBondContact O-CA 3.5Å; F104-Q108 WeakPolarHBondContact O-CB 3.28Å; F104-Q108 PolarHBondContact O-N 3.39Å; Q108-E110 VanDerWaalsContact C-N 3.35Å; Q108-E110 PolarHBondContact O-N 3.07Å; Q108-I111 PolarHBondContact O-N 3.13Å; Q108-D112 WeakPolarHBondContact O-CB 3.36Å; Q108-D112 PolarHBondContact O-N 2.94Å
109D93.4Very high92.2Very high98 Ų9883.3 Ų83.352%0.52440%0.398SS..Hα-helixtrans-70.1-33-177.7-61.8-41.5000112.3Y107 R113Y107-D109 VanDerWaalsContact C-N 3.27Å; Y107-D109 PolarHBondContact O-N 3.45Å; Y107-D109 VanDerWaalsContact O-N 3.16Å; D109-R113 WeakPolarHBondContact O-CG 3.5Å; D109-R113 PolarHBondContact O-N 3.4Å; D109-R113 PolarHBondContact O-NH1 3.43Å
110E93.3Very high91.9Very high85 Ų8582.8 Ų82.840%0.39739%0.392SS..Hα-helixtrans-76.1-38.9177-17159.5-145.700110.9Y107 Q108 D112 R113 Y114Y107-E110 PolarHBondContact O-N 2.82Å; Q108-E110 VanDerWaalsContact C-N 3.35Å; Q108-E110 PolarHBondContact O-N 3.07Å; E110-D112 VanDerWaalsContact C-N 3.31Å; E110-D112 PolarHBondContact O-N 3.08Å; E110-R113 PolarHBondContact O-N 2.92Å; E110-R113 IonicContact OE2-CZ 2.81Å; E110-R113 IonicContact OE2-NE 3.25Å; E110-R113 PolarHBondContact OE2-NE 2.92Å; E110-R113 IonicContact OE2-NH2 2.65Å; E110-R113 PolarHBondContact OE2-NH2 3.43Å; E110-Y114 VanDerWaalsContact O-CB 3.22Å; E110-Y114 WeakPolarHBondContact O-CB 3.41Å; E110-Y114 PolarHBondContact O-N 3.3Å
111I89.8Confident91.5Very high63 Ų6383.3 Ų83.332%0.32339%0.385SS..Hα-helixtrans-61-43.3173.6-68.8169.8000109.9F104 Y107 Q108 Y114 A115F104-I111 HydrophobicContact CB-CD1 4.5Å; F104-I111 HydrophobicContact CD2-CD1 3.93Å; F104-I111 HydrophobicContact CE2-CG2 4.47Å; Y107-I111 WeakPolarHBondContact O-CG1 3.45Å; Y107-I111 PolarHBondContact O-N 3.45Å; Q108-I111 PolarHBondContact O-N 3.13Å; I111-Y114 PolarHBondContact O-N 3.34Å; I111-A115 VanDerWaalsContact O-CB 3.27Å; I111-A115 WeakPolarHBondContact O-CB 3.42Å; I111-A115 PolarHBondContact O-N 3.05Å
112D91.1Very high91.1Very high40 Ų4079.9 Ų79.921%0.21437%0.368CS..Hα-helixtrans-60.1-49.5176.8-84.53.9000111.7Q108 E110 Y114 A115 Q116 Y191 K195Q108-D112 WeakPolarHBondContact O-CB 3.36Å; Q108-D112 PolarHBondContact O-N 2.94Å; E110-D112 VanDerWaalsContact C-N 3.31Å; E110-D112 PolarHBondContact O-N 3.08Å; D112-Y114 VanDerWaalsContact C-N 3.34Å; D112-Y114 PolarHBondContact O-N 2.96Å; D112-A115 PolarHBondContact O-N 3.33Å; D112-Q116 WeakPolarHBondContact O-CG 3.33Å; D112-Q116 PolarHBondContact O-N 3.35Å; D112-Y191 VanDerWaalsContact CA-OH 3.3Å; D112-Y191 WeakPolarHBondContact CA-OH 3.24Å; D112-Y191 WeakPolarHBondContact CB-OH 3.33Å; D112-Y191 VanDerWaalsContact CG-OH 3.27Å; D112-Y191 PolarHBondContact OD1-OH 3.11Å; D112-K195 IonicContact OD2-NZ 2.99Å; D112-K195 PolarHBondContact OD2-NZ 3.23Å
113R92.4Very high90.8Very high127 Ų12775.1 Ų75.148%0.47935%0.345SS..Hα-helixtrans-61.8-41.9176.2-74.6-172.1-67-91.14.4112.3D109 E110 R117D109-R113 WeakPolarHBondContact O-CG 3.5Å; D109-R113 PolarHBondContact O-N 3.4Å; D109-R113 PolarHBondContact O-NH1 3.43Å; E110-R113 PolarHBondContact O-N 2.92Å; E110-R113 IonicContact OE2-CZ 2.81Å; E110-R113 IonicContact OE2-NE 3.25Å; E110-R113 PolarHBondContact OE2-NE 2.92Å; E110-R113 IonicContact OE2-NH2 2.65Å; E110-R113 PolarHBondContact OE2-NH2 3.43Å; R113-R117 WeakPolarHBondContact O-CB 3.33Å; R113-R117 PolarHBondContact O-N 2.88Å
114Y89Confident90.4Very high99 Ų9976 Ų7639%0.38835%0.347SS..Hα-helixtrans-64-46179-176.2-90.4000110.8S45 E110 I111 D112 R117 D118S45-Y114 PolarHBondContact OG-OH 3.47Å; E110-Y114 VanDerWaalsContact O-CB 3.22Å; E110-Y114 WeakPolarHBondContact O-CB 3.41Å; E110-Y114 PolarHBondContact O-N 3.3Å; I111-Y114 PolarHBondContact O-N 3.34Å; D112-Y114 VanDerWaalsContact C-N 3.34Å; D112-Y114 PolarHBondContact O-N 2.96Å; Y114-R117 PolarHBondContact O-N 3.32Å; Y114-D118 HydrophobicContact CE1-CB 4.47Å; Y114-D118 WeakPolarHBondContact O-CB 3.48Å; Y114-D118 PolarHBondContact O-N 2.77Å
115A89.6Confident90.1Very high28 Ų2873.3 Ų73.323%0.23134%0.337CS..Hα-helixtrans-60.1-47.9178.200000111.6I111 D112 R117 D118 L119 Y191I111-A115 VanDerWaalsContact O-CB 3.27Å; I111-A115 WeakPolarHBondContact O-CB 3.42Å; I111-A115 PolarHBondContact O-N 3.05Å; D112-A115 PolarHBondContact O-N 3.33Å; A115-R117 PolarHBondContact O-N 2.96Å; A115-D118 PolarHBondContact O-N 3.27Å; A115-L119 WeakPolarHBondContact O-CB 3.28Å; A115-L119 VanDerWaalsContact O-CG 3.24Å; A115-L119 WeakPolarHBondContact O-CG 3.35Å; A115-L119 PolarHBondContact O-N 3.31Å; A115-Y191 HydrophobicContact CB-CE2 3.88Å
116Q91.9Very high89.9Confident57 Ų5769.8 Ų69.827%0.26632%0.322SS..Hα-helixtrans-60-46.1176-71.2-177.1400112D112 D118 L119 K120 V150 T151 Y191D112-Q116 WeakPolarHBondContact O-CG 3.33Å; D112-Q116 PolarHBondContact O-N 3.35Å; Q116-D118 VanDerWaalsContact C-N 3.3Å; Q116-D118 PolarHBondContact O-N 3.44Å; Q116-L119 PolarHBondContact O-N 2.93Å; Q116-K120 WeakPolarHBondContact O-CG 3.25Å; Q116-K120 PolarHBondContact O-N 3.5Å; Q116-V150 HydrophobicContact CB-CG1 4.23Å; Q116-V150 HydrophobicContact CG-CG1 4.37Å; Q116-T151 HydrophobicContact CG-CG2 4.42Å; Q116-Y191 HydrophobicContact CG-CD1 3.67Å; Q116-Y191 HydrophobicContact CG-CD2 3.89Å; Q116-Y191 HydrophobicContact CG-CE1 3.72Å; Q116-Y191 HydrophobicContact CG-CE2 3.94Å; Q116-Y191 HydrophobicContact CG-CG 3.74Å
117R90.2Very high89.2Confident123 Ų12367.2 Ų67.246%0.46432%0.324SS..Hα-helixtrans-61.7-41.5178.9-172.1-172.4-60.1129.50.3111.4R113 Y114 A115 K120 K121R113-R117 WeakPolarHBondContact O-CB 3.33Å; R113-R117 PolarHBondContact O-N 2.88Å; Y114-R117 PolarHBondContact O-N 3.32Å; A115-R117 PolarHBondContact O-N 2.96Å; R117-K120 PolarHBondContact O-N 2.94Å; R117-K121 WeakPolarHBondContact O-CG 3.46Å; R117-K121 PolarHBondContact O-N 3.44Å; R117-K121 VanDerWaalsContact O-N 3.12Å
118D85.6Confident88.7Confident7 Ų763.8 Ų63.84%0.03732%0.316CS..Hα-helixtrans-69.9-44.1-179.5-160.4102.6000111.7S45 S46 S47 Y114 A115 Q116 K120 K121 G122S45-D118 VanDerWaalsContact CA-CG 3.43Å; S45-D118 VanDerWaalsContact CA-OD1 3.22Å; S45-D118 WeakPolarHBondContact CA-OD1 3.42Å; S45-D118 WeakPolarHBondContact CA-OD2 3.28Å; S45-D118 WeakPolarHBondContact CB-OD1 3.41Å; S45-D118 PolarHBondContact OG-OD1 3.36Å; S46-D118 VanDerWaalsContact N-CG 3.28Å; S46-D118 PolarHBondContact N-OD1 2.7Å; S46-D118 PolarHBondContact N-OD2 2.97Å; S46-D118 PolarHBondContact OG-O 3.16Å; S46-D118 PolarHBondContact OG-OD2 3.37Å; S47-D118 PolarHBondContact N-OD1 3.48Å; Y114-D118 HydrophobicContact CE1-CB 4.47Å; Y114-D118 WeakPolarHBondContact O-CB 3.48Å; Y114-D118 PolarHBondContact O-N 2.77Å; A115-D118 PolarHBondContact O-N 3.27Å; Q116-D118 VanDerWaalsContact C-N 3.3Å; Q116-D118 PolarHBondContact O-N 3.44Å; D118-K120 VanDerWaalsContact C-N 3.26Å; D118-K120 PolarHBondContact O-N 3.35Å; D118-K121 CarbonylContact O-C 3.02Å; D118-K121 WeakPolarHBondContact O-CA 3.5Å; D118-K121 WeakPolarHBondContact O-CB 3.33Å; D118-K121 PolarHBondContact O-N 2.87Å; D118-G122 PolarHBondContact O-N 2.94Å
119L89.2Confident88Confident66 Ų6668.8 Ų68.835%0.34634%0.339SS..Hα-helixtrans-57.9-39.2173.1-70.2168.7000111.9A115 Q116 K121 G122 L123 W138 V150 Y191A115-L119 WeakPolarHBondContact O-CB 3.28Å; A115-L119 VanDerWaalsContact O-CG 3.24Å; A115-L119 WeakPolarHBondContact O-CG 3.35Å; A115-L119 PolarHBondContact O-N 3.31Å; Q116-L119 PolarHBondContact O-N 2.93Å; L119-K121 PolarHBondContact O-N 3.48Å; L119-G122 WeakPolarHBondContact O-CA 3.46Å; L119-G122 PolarHBondContact O-N 2.88Å; L119-G122 VanDerWaalsContact O-N 3.09Å; L119-L123 PolarHBondContact O-N 3.41Å; L119-W138 HydrophobicContact CB-CH2 4.48Å; L119-W138 HydrophobicContact CB-CZ2 4.29Å; L119-W138 HydrophobicContact CD2-CZ2 4.27Å; L119-V150 HydrophobicContact CB-CG1 3.97Å; L119-V150 HydrophobicContact CB-CG2 3.69Å; L119-V150 HydrophobicContact CD1-CG1 4.31Å; L119-Y191 HydrophobicContact CD1-CD2 3.67Å; L119-Y191 HydrophobicContact CD1-CE2 4.32Å
120K90.7Very high87Confident72 Ų7266.9 Ų66.931%0.31334%0.343SS..Hα-helixtrans-64.4-37.1174.8-74.4-171.5-173.7-143.90112.7Q116 R117 D118 G122 L123 V150 T151 D155Q116-K120 WeakPolarHBondContact O-CG 3.25Å; Q116-K120 PolarHBondContact O-N 3.5Å; R117-K120 PolarHBondContact O-N 2.94Å; D118-K120 VanDerWaalsContact C-N 3.26Å; D118-K120 PolarHBondContact O-N 3.35Å; K120-G122 VanDerWaalsContact C-N 3.31Å; K120-L123 WeakPolarHBondContact O-CB 3.21Å; K120-L123 PolarHBondContact O-N 3.19Å; K120-V150 HydrophobicContact CB-CG2 4.49Å; K120-V150 HydrophobicContact CG-CB 3.87Å; K120-V150 HydrophobicContact CG-CG1 4.18Å; K120-V150 HydrophobicContact CG-CG2 3.76Å; K120-T151 WeakPolarHBondContact CE-OG1 3.31Å; K120-T151 PolarHBondContact NZ-OG1 3.08Å; K120-D155 WeakPolarHBondContact CE-OD1 3.29Å; K120-D155 IonicContact NZ-OD1 2.75Å; K120-D155 PolarHBondContact NZ-OD1 3.45Å; K120-D155 IonicContact NZ-OD2 3.73Å
121K86.1Confident86.2Confident87 Ų8764 Ų6438%0.37833%0.33SS..Hα-helixtrans-66.1-36.8170.7-68175.9-177.4-179.40111.3S46 S47 R117 D118 L119 L123 Q124S46-K121 VanDerWaalsContact OG-CB 3.3Å; S46-K121 WeakPolarHBondContact OG-CB 3.33Å; S47-K121 PolarHBondContact OG-NZ 2.9Å; R117-K121 WeakPolarHBondContact O-CG 3.46Å; R117-K121 PolarHBondContact O-N 3.44Å; R117-K121 VanDerWaalsContact O-N 3.12Å; D118-K121 CarbonylContact O-C 3.02Å; D118-K121 WeakPolarHBondContact O-CA 3.5Å; D118-K121 WeakPolarHBondContact O-CB 3.33Å; D118-K121 PolarHBondContact O-N 2.87Å; L119-K121 PolarHBondContact O-N 3.48Å; K121-L123 VanDerWaalsContact C-N 3.27Å; K121-L123 PolarHBondContact O-N 3.38Å; K121-Q124 WeakPolarHBondContact O-CB 3.32Å; K121-Q124 PolarHBondContact O-N 3.08Å; K121-Q124 VanDerWaalsContact O-N 3.08Å
122G83.8Confident85.7Confident3 Ų366 Ų663%0.03135%0.345CS..Hα-helixtrans-60.8-34.6174.900000112.9S46 D118 L119 K120 Q124 L125 L134S46-G122 PolarHBondContact OG-N 3.46Å; S46-G122 VanDerWaalsContact OG-N 3.14Å; D118-G122 PolarHBondContact O-N 2.94Å; L119-G122 WeakPolarHBondContact O-CA 3.46Å; L119-G122 PolarHBondContact O-N 2.88Å; L119-G122 VanDerWaalsContact O-N 3.09Å; K120-G122 VanDerWaalsContact C-N 3.31Å; G122-Q124 PolarHBondContact O-N 3.28Å; G122-L125 PolarHBondContact O-N 3.31Å; G122-L125 VanDerWaalsContact O-N 3.12Å; G122-L134 WeakPolarHBondContact O-CD2 3.37Å
123L88.3Confident84.9Confident2 Ų264.1 Ų64.11%0.0134%0.335CS..Hα-helixtrans-58.2-35.4173.2-66.3178.6000112.6L119 K120 K121 L125 F126 W138 V150 D155 W156 V159L119-L123 PolarHBondContact O-N 3.41Å; K120-L123 WeakPolarHBondContact O-CB 3.21Å; K120-L123 PolarHBondContact O-N 3.19Å; K121-L123 VanDerWaalsContact C-N 3.27Å; K121-L123 PolarHBondContact O-N 3.38Å; L123-L125 PolarHBondContact O-N 2.75Å; L123-F126 WeakPolarHBondContact O-CB 3.49Å; L123-F126 PolarHBondContact O-N 2.95Å; L123-F126 VanDerWaalsContact O-N 3.07Å; L123-W138 HydrophobicContact CD2-CD2 3.89Å; L123-W138 HydrophobicContact CD2-CE3 4.15Å; L123-W138 HydrophobicContact CD2-CH2 3.77Å; L123-W138 HydrophobicContact CD2-CZ2 3.46Å; L123-W138 VanDerWaalsContact CD2-CZ2 3.46Å; L123-W138 HydrophobicContact CD2-CZ3 4.09Å; L123-W138 HydrophobicContact CG-CH2 4.36Å; L123-W138 HydrophobicContact CG-CZ2 3.91Å; L123-V150 HydrophobicContact CD1-CG2 3.75Å; L123-V150 HydrophobicContact CG-CG2 4.05Å; L123-D155 HydrophobicContact CD1-CB 3.74Å; L123-W156 HydrophobicContact CD2-CD2 4.4Å; L123-W156 HydrophobicContact CD2-CH2 3.4Å; L123-W156 VanDerWaalsContact CD2-CH2 3.4Å; L123-W156 HydrophobicContact CD2-CZ2 3.19Å; L123-W156 HydrophobicContact CD2-CZ3 4.11Å; L123-V159 HydrophobicContact CB-CG2 3.78Å; L123-V159 WeakPolarHBondContact O-CG1 3.28Å
124Q87.9Confident84.3Confident93 Ų9358.6 Ų58.644%0.43532%0.315SS..THydrogen-bonded Turntrans-67.5-18.9-180-59.6-65.4-30.200113K121 G122K121-Q124 WeakPolarHBondContact O-CB 3.32Å; K121-Q124 PolarHBondContact O-N 3.08Å; K121-Q124 VanDerWaalsContact O-N 3.08Å; G122-Q124 PolarHBondContact O-N 3.28Å
125L85.1Confident84.1Confident55 Ų5554.8 Ų54.829%0.28830%0.302SS..THydrogen-bonded Turntrans-91.7-3.8176.6-62.4174.2000112.4G122 L123 G127 T128 N131 L134G122-L125 PolarHBondContact O-N 3.31Å; G122-L125 VanDerWaalsContact O-N 3.12Å; L123-L125 PolarHBondContact O-N 2.75Å; L125-G127 PolarHBondContact O-N 2.94Å; L125-T128 PolarHBondContact O-N 3.35Å; L125-T128 PolarHBondContact O-OG1 2.94Å; L125-N131 WeakPolarHBondContact O-CB 3.46Å; L125-L134 HydrophobicContact CB-CD2 3.5Å; L125-L134 HydrophobicContact CD1-CD2 4.15Å; L125-L134 HydrophobicContact CG-CD2 4.46Å
126F86.5Confident83.8Confident24 Ų2456.5 Ų56.511%0.10531%0.307CS..THydrogen-bonded Turntrans-62.6130.7179.9-173.2-87.7000111.5L123 T128 T135 W138 M139 W156 Y160 P166L123-F126 WeakPolarHBondContact O-CB 3.49Å; L123-F126 PolarHBondContact O-N 2.95Å; L123-F126 VanDerWaalsContact O-N 3.07Å; F126-T128 PolarHBondContact O-N 3.49Å; F126-T135 HydrophobicContact CD1-CG2 4.34Å; F126-T135 HydrophobicContact CD2-CG2 3.9Å; F126-T135 HydrophobicContact CE1-CG2 3.99Å; F126-T135 HydrophobicContact CE2-CG2 3.54Å; F126-T135 HydrophobicContact CG-CG2 4.3Å; F126-T135 HydrophobicContact CZ-CG2 3.59Å; F126-W138 HydrophobicContact CD2-CB 3.78Å; F126-W138 HydrophobicContact CD2-CG 4.16Å; F126-W138 HydrophobicContact CE2-CB 3.71Å; F126-M139 HydrophobicContact CE2-CG 4.3Å; F126-M139 HydrophobicContact CZ-CG 4.24Å; F126-W156 HydrophobicContact CB-CH2 3.85Å; F126-W156 HydrophobicContact CB-CZ3 3.77Å; F126-W156 AromaticContact CD1-CH2 3.99Å; F126-W156 HydrophobicContact CD1-CH2 3.99Å; F126-W156 AromaticContact CD1-CZ3 3.77Å; F126-W156 HydrophobicContact CD1-CZ3 3.77Å; F126-W156 AromaticContact CD2-CH2 3.52Å; F126-W156 HydrophobicContact CD2-CH2 3.52Å; F126-W156 HydrophobicContact CD2-CZ3 4.13Å; F126-W156 HydrophobicContact CE1-CH2 4.43Å; F126-W156 HydrophobicContact CE1-CZ3 4.39Å; F126-W156 AromaticContact CE2-CH2 3.99Å; F126-W156 HydrophobicContact CE2-CH2 3.99Å; F126-W156 AromaticContact CG-CH2 3.51Å; F126-W156 HydrophobicContact CG-CH2 3.51Å; F126-W156 AromaticContact CG-CZ3 3.62Å; F126-W156 HydrophobicContact CG-CZ3 3.62Å; F126-W156 HydrophobicContact CZ-CH2 4.42Å; F126-Y160 WeakPolarHBondContact CD1-OH 3.33Å; F126-Y160 WeakPolarHBondContact CE1-OH 3.46Å; F126-P166 HydrophobicContact CE1-CB 4.21Å; F126-P166 HydrophobicContact CE1-CG 4.1Å; F126-P166 HydrophobicContact CZ-CB 3.99Å; F126-P166 HydrophobicContact CZ-CG 4.05Å
127G82.8Confident83.5Confident60 Ų6054.9 Ų54.962%0.61930%0.304SS*.THydrogen-bonded Turntrans71.83.9179.200000115.4L125 T135L125-G127 PolarHBondContact O-N 2.94Å; G127-T135 PolarHBondContact N-OG1 2.98Å
128T83.3Confident83.4Confident57 Ų5749.9 Ų49.935%0.3529%0.285SS..  trans-81.5149.9176.863.50000112.1L125 F126 G130 N131L125-T128 PolarHBondContact O-N 3.35Å; L125-T128 PolarHBondContact O-OG1 2.94Å; F126-T128 PolarHBondContact O-N 3.49Å; T128-G130 PolarHBondContact O-N 2.64Å; T128-N131 PolarHBondContact O-N 2.98Å; T128-N131 VanDerWaalsContact O-N 3.15Å; T128-N131 PolarHBondContact OG1-ND2 3.43Å
129E78.2Confident83.6Confident199 Ų19953.1 Ų53.193%0.9330%0.301SS*.THydrogen-bonded Turntrans-57.6131.9177.5-67.1-171.1170.100111.1
130G72.8Confident83.5Confident57 Ų5753.7 Ų53.759%0.58830%0.303SS*.THydrogen-bonded Turntrans86.7-6.3-177.900000115.8T128T128-G130 PolarHBondContact O-N 2.64Å
131N75.7Confident83.6Confident24 Ų2452.3 Ų52.313%0.12830%0.301CS..  trans-113.132.7179.8-67.1-67.1000113.4L125 T128 G133 L134 T135L125-N131 WeakPolarHBondContact O-CB 3.46Å; T128-N131 PolarHBondContact O-N 2.98Å; T128-N131 VanDerWaalsContact O-N 3.15Å; T128-N131 PolarHBondContact OG1-ND2 3.43Å; N131-G133 VanDerWaalsContact C-N 3.33Å; N131-G133 PolarHBondContact O-N 3Å; N131-L134 HydrophobicContact CB-CB 4.34Å; N131-L134 PolarHBondContact O-N 3.16Å; N131-T135 PolarHBondContact O-N 2.86Å; N131-T135 PolarHBondContact O-OG1 2.84Å
132V79.7Confident84Confident107 Ų10748.1 Ų48.165%0.64828%0.283SS*.Hα-helixtrans-60.5-41.6-179-176.60000111.5L134 T135 N136V132-L134 PolarHBondContact O-N 3.37Å; V132-T135 WeakPolarHBondContact O-CB 3.42Å; V132-T135 PolarHBondContact O-N 2.94Å; V132-N136 WeakPolarHBondContact O-CB 3.41Å; V132-N136 PolarHBondContact O-N 2.87Å
133G75.1Confident84.4Confident0 Ų051.8 Ų51.80%030%0.304CS..Hα-helixtrans-62.9-39.9177.400000113.3N131 N136 A137N131-G133 VanDerWaalsContact C-N 3.33Å; N131-G133 PolarHBondContact O-N 3Å; G133-N136 PolarHBondContact O-N 3.33Å; G133-A137 WeakPolarHBondContact O-CB 3.45Å; G133-A137 PolarHBondContact O-N 2.94Å
134L79.9Confident84.6Confident10 Ų1057.2 Ų57.25%0.05233%0.333CS..Hα-helixtrans-66-41.917517967.7000111.7G122 L125 N131 V132 N136 A137 W138G122-L134 WeakPolarHBondContact O-CD2 3.37Å; L125-L134 HydrophobicContact CB-CD2 3.5Å; L125-L134 HydrophobicContact CD1-CD2 4.15Å; L125-L134 HydrophobicContact CG-CD2 4.46Å; N131-L134 HydrophobicContact CB-CB 4.34Å; N131-L134 PolarHBondContact O-N 3.16Å; V132-L134 PolarHBondContact O-N 3.37Å; L134-N136 VanDerWaalsContact C-N 3.34Å; L134-A137 PolarHBondContact O-N 3.21Å; L134-W138 PolarHBondContact O-N 3.46Å
135T84.2Confident84.9Confident20 Ų2055.3 Ų55.312%0.12332%0.324CS..Hα-helixtrans-60.5-46.2176.7-55.20000110.6F126 G127 N131 V132 W138 M139F126-T135 HydrophobicContact CD1-CG2 4.34Å; F126-T135 HydrophobicContact CD2-CG2 3.9Å; F126-T135 HydrophobicContact CE1-CG2 3.99Å; F126-T135 HydrophobicContact CE2-CG2 3.54Å; F126-T135 HydrophobicContact CG-CG2 4.3Å; F126-T135 HydrophobicContact CZ-CG2 3.59Å; G127-T135 PolarHBondContact N-OG1 2.98Å; N131-T135 PolarHBondContact O-N 2.86Å; N131-T135 PolarHBondContact O-OG1 2.84Å; V132-T135 WeakPolarHBondContact O-CB 3.42Å; V132-T135 PolarHBondContact O-N 2.94Å; T135-W138 PolarHBondContact O-N 2.86Å; T135-M139 HydrophobicContact CG2-CE 4.33Å; T135-M139 WeakPolarHBondContact O-CG 3.31Å; T135-M139 PolarHBondContact O-N 3.45Å
136N83.6Confident85.3Confident63 Ų6360 Ų6034%0.33734%0.337SS..Hα-helixtrans-63.5-43177-167.941.3000112.5V132 G133 L134 W138 M139 I140V132-N136 WeakPolarHBondContact O-CB 3.41Å; V132-N136 PolarHBondContact O-N 2.87Å; G133-N136 PolarHBondContact O-N 3.33Å; L134-N136 VanDerWaalsContact C-N 3.34Å; N136-W138 VanDerWaalsContact C-N 3.32Å; N136-W138 PolarHBondContact O-N 3.49Å; N136-M139 HydrophobicContact CB-CE 4.35Å; N136-M139 PolarHBondContact O-N 3.42Å; N136-I140 VanDerWaalsContact O-CG1 3.31Å; N136-I140 WeakPolarHBondContact O-CG1 3.43Å; N136-I140 PolarHBondContact O-N 2.89Å
137A84.6Confident85.7Confident24 Ų2458.8 Ų58.820%0.19833%0.332CS..Hα-helixtrans-59.4-42.6176.100000112.1A42 G133 L134 I140 V141A42-A137 HydrophobicContact CB-CB 4.33Å; G133-A137 WeakPolarHBondContact O-CB 3.45Å; G133-A137 PolarHBondContact O-N 2.94Å; L134-A137 PolarHBondContact O-N 3.21Å; A137-I140 PolarHBondContact O-N 2.95Å; A137-V141 WeakPolarHBondContact O-CG2 3.18Å; A137-V141 PolarHBondContact O-N 2.04Å
138W88.9Confident86.3Confident17 Ų1756 Ų566%0.06430%0.303CS..Hα-helixtrans-62.6-42.9175.1-91.2115.4000112.9L119 L123 F126 L134 T135 N136 V141 Q142 V150L119-W138 HydrophobicContact CB-CH2 4.48Å; L119-W138 HydrophobicContact CB-CZ2 4.29Å; L119-W138 HydrophobicContact CD2-CZ2 4.27Å; L123-W138 HydrophobicContact CD2-CD2 3.89Å; L123-W138 HydrophobicContact CD2-CE3 4.15Å; L123-W138 HydrophobicContact CD2-CH2 3.77Å; L123-W138 HydrophobicContact CD2-CZ2 3.46Å; L123-W138 VanDerWaalsContact CD2-CZ2 3.46Å; L123-W138 HydrophobicContact CD2-CZ3 4.09Å; L123-W138 HydrophobicContact CG-CH2 4.36Å; L123-W138 HydrophobicContact CG-CZ2 3.91Å; F126-W138 HydrophobicContact CD2-CB 3.78Å; F126-W138 HydrophobicContact CD2-CG 4.16Å; F126-W138 HydrophobicContact CE2-CB 3.71Å; L134-W138 PolarHBondContact O-N 3.46Å; T135-W138 PolarHBondContact O-N 2.86Å; N136-W138 VanDerWaalsContact C-N 3.32Å; N136-W138 PolarHBondContact O-N 3.49Å; W138-V141 PolarHBondContact O-N 3.43Å; W138-Q142 HydrophobicContact CE3-CG 4.46Å; W138-Q142 WeakPolarHBondContact O-CB 2.97Å; W138-Q142 VanDerWaalsContact O-CG 3.26Å; W138-Q142 WeakPolarHBondContact O-CG 3.27Å; W138-Q142 PolarHBondContact O-N 3.19Å; W138-V150 HydrophobicContact CH2-CG2 3.69Å; W138-V150 HydrophobicContact CZ2-CG2 4.15Å
139M89Confident86.8Confident75 Ų7553.2 Ų53.237%0.36929%0.286SS..Hα-helixtrans-62.2-43.6176.9-69.7-173.9-65.300111.7F126 T135 N136 T143F126-M139 HydrophobicContact CE2-CG 4.3Å; F126-M139 HydrophobicContact CZ-CG 4.24Å; T135-M139 HydrophobicContact CG2-CE 4.33Å; T135-M139 WeakPolarHBondContact O-CG 3.31Å; T135-M139 PolarHBondContact O-N 3.45Å; N136-M139 HydrophobicContact CB-CE 4.35Å; N136-M139 PolarHBondContact O-N 3.42Å; M139-T143 WeakPolarHBondContact O-CB 3.27Å; M139-T143 PolarHBondContact O-N 3Å; M139-T143 PolarHBondContact O-OG1 2.92Å
140I88.4Confident87.6Confident79 Ų7943.8 Ų43.841%0.40524%0.242SC..Hα-helixtrans-61.1-51.9176.9-68.4164.9000110.3N136 A137 Q142 T143 D144N136-I140 VanDerWaalsContact O-CG1 3.31Å; N136-I140 WeakPolarHBondContact O-CG1 3.43Å; N136-I140 PolarHBondContact O-N 2.89Å; A137-I140 PolarHBondContact O-N 2.95Å; I140-Q142 VanDerWaalsContact C-N 3.33Å; I140-Q142 PolarHBondContact O-N 2.85Å; I140-T143 PolarHBondContact O-N 2.98Å; I140-D144 WeakPolarHBondContact CG2-OD2 3.3Å; I140-D144 VanDerWaalsContact O-CB 3.31Å; I140-D144 WeakPolarHBondContact O-CB 3.25Å; I140-D144 PolarHBondContact O-N 3.41Å
141V92.3Very high88.7Confident42 Ų4243.3 Ų43.326%0.25523%0.228SC..Hα-helixtrans-58.9-45.4-178.6169.30000111.3A137 W138 T143 F145 C190 V194A137-V141 WeakPolarHBondContact O-CG2 3.18Å; A137-V141 PolarHBondContact O-N 2.04Å; W138-V141 PolarHBondContact O-N 3.43Å; V141-T143 PolarHBondContact O-N 2.83Å; V141-F145 HydrophobicContact CG1-CD2 4.16Å; V141-F145 VanDerWaalsContact O-CB 3.3Å; V141-F145 WeakPolarHBondContact O-CB 3.44Å; V141-F145 WeakPolarHBondContact O-CD2 3.35Å; V141-F145 PolarHBondContact O-N 3.35Å; V141-C190 HydrophobicContact CG1-CB 4.23Å; V141-V194 HydrophobicContact CG1-CG2 4.29Å
142Q93.6Very high89.5Confident0 Ų045 Ų450%024%0.237CC..Hα-helixtrans-64.4-41.3-179.9-72.1169.518.600112.6W138 I140 R146 C147 S168 C169W138-Q142 HydrophobicContact CE3-CG 4.46Å; W138-Q142 WeakPolarHBondContact O-CB 2.97Å; W138-Q142 VanDerWaalsContact O-CG 3.26Å; W138-Q142 WeakPolarHBondContact O-CG 3.27Å; W138-Q142 PolarHBondContact O-N 3.19Å; I140-Q142 VanDerWaalsContact C-N 3.33Å; I140-Q142 PolarHBondContact O-N 2.85Å; Q142-R146 VanDerWaalsContact O-CA 3.25Å; Q142-R146 WeakPolarHBondContact O-CA 3.44Å; Q142-R146 PolarHBondContact O-N 2.9Å; Q142-C147 WeakPolarHBondContact CB-O 3.31Å; Q142-C147 PolarHBondContact O-N 3.32Å; Q142-S168 PolarHBondContact OE1-OG 3.48Å; Q142-C169 VanDerWaalsContact CD-SG 3.55Å; Q142-C169 PolarHBondContact OE1-SG 3.24Å
143T91.9Very high90.1Very high79 Ų7941.6 Ų41.649%0.48521%0.214SC..Hα-helixtrans-71.4-47.2-178.7-51.30000111.2M139 I140 V141M139-T143 WeakPolarHBondContact O-CB 3.27Å; M139-T143 PolarHBondContact O-N 3Å; M139-T143 PolarHBondContact O-OG1 2.92Å; I140-T143 PolarHBondContact O-N 2.98Å; V141-T143 PolarHBondContact O-N 2.83Å
144D93Very high90.9Very high116 Ų11644.1 Ų44.162%0.6223%0.23SC*.Hα-helixtrans-71.2-42.5-176.1-74.6-2.1000111.9I140I140-D144 WeakPolarHBondContact CG2-OD2 3.3Å; I140-D144 VanDerWaalsContact O-CB 3.31Å; I140-D144 WeakPolarHBondContact O-CB 3.25Å; I140-D144 PolarHBondContact O-N 3.41Å
145F93.6Very high91.6Very high53 Ų5344.2 Ų44.223%0.23223%0.23CC..Hα-helixtrans-91.4-0.6-178.9-68.7-87.5000113.8V141 C147 R193 V194 W197V141-F145 HydrophobicContact CG1-CD2 4.16Å; V141-F145 VanDerWaalsContact O-CB 3.3Å; V141-F145 WeakPolarHBondContact O-CB 3.44Å; V141-F145 WeakPolarHBondContact O-CD2 3.35Å; V141-F145 PolarHBondContact O-N 3.35Å; F145-C147 PolarHBondContact O-N 2.92Å; F145-R193 HydrophobicContact CB-CB 4.24Å; F145-R193 HydrophobicContact CD1-CB 4.49Å; F145-R193 PolarHBondContact O-NH1 3.03Å; F145-V194 HydrophobicContact CD1-CG2 4.26Å; F145-V194 HydrophobicContact CD2-CG2 4.13Å; F145-V194 HydrophobicContact CE1-CG2 4.28Å; F145-V194 HydrophobicContact CE2-CG2 4.15Å; F145-V194 HydrophobicContact CG-CG2 4.18Å; F145-V194 HydrophobicContact CZ-CG2 4.22Å; F145-W197 HydrophobicContact CD1-CB 4.44Å; F145-W197 HydrophobicContact CE1-CB 3.65Å; F145-W197 HydrophobicContact CE1-CD2 4.19Å; F145-W197 AromaticContact CE1-CG 3.66Å; F145-W197 HydrophobicContact CE1-CG 3.66Å; F145-W197 HydrophobicContact CZ-CD2 4.32Å; F145-W197 HydrophobicContact CZ-CG 4.26Å
146R94.3Very high92Very high153 Ų15343.3 Ų43.358%0.57722%0.224SC*.THydrogen-bonded Turntrans48.358.8178.8-62.6-178.3178.5-169.1-1.8111.6Q142 W186 R193Q142-R146 VanDerWaalsContact O-CA 3.25Å; Q142-R146 WeakPolarHBondContact O-CA 3.44Å; Q142-R146 PolarHBondContact O-N 2.9Å; R146-W186 HydrophobicContact CB-CD2 3.9Å; R146-W186 HydrophobicContact CB-CE3 3.99Å; R146-W186 HydrophobicContact CB-CH2 3.91Å; R146-W186 HydrophobicContact CB-CZ2 3.77Å; R146-W186 HydrophobicContact CB-CZ3 3.99Å; R146-W186 HydrophobicContact CG-CH2 4.08Å; R146-W186 HydrophobicContact CG-CZ2 3.81Å; R146-R193 PolarHBondContact O-NH1 3.45Å
147C95.6Very high92.4Very high0 Ų042.6 Ų42.60%022%0.218CC..  trans-141.9163.2-170.965.20000110Q142 F145 A188 C190 R193Q142-C147 WeakPolarHBondContact CB-O 3.31Å; Q142-C147 PolarHBondContact O-N 3.32Å; F145-C147 PolarHBondContact O-N 2.92Å; C147-A188 CarbonylContact C-O 3.59Å; C147-A188 VanDerWaalsContact CA-O 3.27Å; C147-A188 WeakPolarHBondContact CA-O 3.44Å; C147-A188 VanDerWaalsContact CB-O 3.31Å; C147-A188 WeakPolarHBondContact CB-O 3.48Å; C147-C190 HydrophobicContact CB-CB 3.85Å; C147-C190 WeakPolarHBondContact CB-SG 3.21Å; C147-C190 WeakPolarHBondContact SG-CA 3.36Å; C147-C190 WeakPolarHBondContact SG-CB 3.04Å; C147-C190 CovalentContact SG-SG 2.04Å; C147-C190 PolarHBondContact SG-SG 3.47Å; C147-R193 HydrophobicContact CB-CB 4.45Å; C147-R193 HydrophobicContact CB-CG 4.15Å
148C95.1Very high92.7Very high0 Ų048.5 Ų48.50%024%0.242CC..  trans-142.3132.2175.8-168.90000112.8N152 H153 C169 W186 A188C148-N152 CarbonylContact O-C 3.59Å; C148-H153 HydrophobicContact CB-CB 3.91Å; C148-H153 PolarHBondContact O-N 3.05Å; C148-C169 VanDerWaalsContact CA-SG 3.52Å; C148-C169 HydrophobicContact CB-CB 3.65Å; C148-C169 WeakPolarHBondContact CB-SG 3.27Å; C148-C169 WeakPolarHBondContact SG-CB 3.3Å; C148-C169 CovalentContact SG-SG 2.03Å; C148-C169 PolarHBondContact SG-SG 3.03Å; C148-W186 HydrophobicContact CB-CB 4.04Å; C148-W186 WeakPolarHBondContact CB-O 3.31Å; C148-A188 PolarHBondContact N-O 3.09Å
149G94.3Very high92.7Very high0 Ų049.1 Ų49.10%025%0.248CC..SBendtrans71178.9-177.500000112.6C190G149-C190 WeakPolarHBondContact O-CB 3.33Å; G149-C190 PolarHBondContact O-N 2.89Å; G149-C190 VanDerWaalsContact O-N 3.08Å; G149-C190 PolarHBondContact O-SG 3.03Å
150V94.6Very high92.8Very high1 Ų148.4 Ų48.41%0.00624%0.241CC..SBendtrans-77.3-58.4-178.1179.60000109.5Q116 L119 K120 L123 W138 D155 P189 C190 Y191Q116-V150 HydrophobicContact CB-CG1 4.23Å; Q116-V150 HydrophobicContact CG-CG1 4.37Å; L119-V150 HydrophobicContact CB-CG1 3.97Å; L119-V150 HydrophobicContact CB-CG2 3.69Å; L119-V150 HydrophobicContact CD1-CG1 4.31Å; K120-V150 HydrophobicContact CB-CG2 4.49Å; K120-V150 HydrophobicContact CG-CB 3.87Å; K120-V150 HydrophobicContact CG-CG1 4.18Å; K120-V150 HydrophobicContact CG-CG2 3.76Å; L123-V150 HydrophobicContact CD1-CG2 3.75Å; L123-V150 HydrophobicContact CG-CG2 4.05Å; W138-V150 HydrophobicContact CH2-CG2 3.69Å; W138-V150 HydrophobicContact CZ2-CG2 4.15Å; V150-D155 PolarHBondContact N-OD2 2.81Å; V150-D155 VanDerWaalsContact N-OD2 3.17Å; V150-P189 WeakPolarHBondContact O-CB 3.19Å; V150-C190 PolarHBondContact O-N 3.01Å; V150-Y191 WeakPolarHBondContact O-CB 3.41Å; V150-Y191 PolarHBondContact O-N 2.8Å
151T94.9Very high92.8Very high47 Ų4752 Ų5229%0.28826%0.261SS..SBendtrans-112.5-23-178.853.10000112.3Q116 K120 D155 P189Q116-T151 HydrophobicContact CG-CG2 4.42Å; K120-T151 WeakPolarHBondContact CE-OG1 3.31Å; K120-T151 PolarHBondContact NZ-OG1 3.08Å; T151-D155 PolarHBondContact N-OD2 3.5Å; T151-D155 PolarHBondContact OG1-OD1 3.38Å; T151-D155 PolarHBondContact OG1-OD2 2.9Å; T151-P189 WeakPolarHBondContact O-CB 3.16Å
152N93.5Very high92.7Very high60 Ų6052.2 Ų52.232%0.32127%0.267SS..  trans-161.5156.5174.3-156.7-18.6000110.2C148 T154 D155C148-N152 CarbonylContact O-C 3.59Å; N152-T154 PolarHBondContact O-N 3.28Å; N152-T154 VanDerWaalsContact O-N 3.16Å; N152-D155 PolarHBondContact N-OD2 3.49Å; N152-D155 VanDerWaalsContact O-CB 3.23Å; N152-D155 WeakPolarHBondContact O-CB 3.48Å; N152-D155 VanDerWaalsContact O-CG 3.24Å; N152-D155 PolarHBondContact O-N 3.04Å; N152-D155 VanDerWaalsContact O-OD2 3.13Å
153H91.1Very high92.5Very high35 Ų3556.8 Ų56.816%0.16230%0.296CS..THydrogen-bonded Turntrans-57.8-28.9174.566.5-82.3000112.4C148 D155 W156 F157 V165 W185C148-H153 HydrophobicContact CB-CB 3.91Å; C148-H153 PolarHBondContact O-N 3.05Å; H153-D155 PolarHBondContact O-N 3.5Å; H153-W156 WeakPolarHBondContact O-CB 3.3Å; H153-W156 PolarHBondContact O-N 2.85Å; H153-W156 VanDerWaalsContact O-N 3.14Å; H153-F157 AromaticContact CD2-CZ 3.89Å; H153-V165 HydrophobicContact CB-CG1 4.37Å; H153-W185 AromaticContact CD2-CE3 3.83Å
154T92.9Very high92.5Very high53 Ų5357.4 Ų57.433%0.32529%0.289SS..THydrogen-bonded Turntrans-62.9-18.3175.963.10000113.6N152 W156 F157N152-T154 PolarHBondContact O-N 3.28Å; N152-T154 VanDerWaalsContact O-N 3.16Å; T154-W156 PolarHBondContact O-N 3.26Å; T154-W156 VanDerWaalsContact O-N 3.15Å; T154-F157 HydrophobicContact CG2-CD2 4.15Å; T154-F157 HydrophobicContact CG2-CE2 3.69Å; T154-F157 HydrophobicContact CG2-CZ 4.25Å; T154-F157 WeakPolarHBondContact O-CB 3.35Å; T154-F157 PolarHBondContact O-N 2.99Å
155D93.7Very high92.5Very high12 Ų1252.1 Ų52.16%0.06426%0.261CS..Hα-helixtrans-57.6-26.3174-68.5-37.1000111.2K120 L123 V150 T151 N152 H153K120-D155 WeakPolarHBondContact CE-OD1 3.29Å; K120-D155 IonicContact NZ-OD1 2.75Å; K120-D155 PolarHBondContact NZ-OD1 3.45Å; K120-D155 IonicContact NZ-OD2 3.73Å; L123-D155 HydrophobicContact CD1-CB 3.74Å; V150-D155 PolarHBondContact N-OD2 2.81Å; V150-D155 VanDerWaalsContact N-OD2 3.17Å; T151-D155 PolarHBondContact N-OD2 3.5Å; T151-D155 PolarHBondContact OG1-OD1 3.38Å; T151-D155 PolarHBondContact OG1-OD2 2.9Å; N152-D155 PolarHBondContact N-OD2 3.49Å; N152-D155 VanDerWaalsContact O-CB 3.23Å; N152-D155 WeakPolarHBondContact O-CB 3.48Å; N152-D155 VanDerWaalsContact O-CG 3.24Å; N152-D155 PolarHBondContact O-N 3.04Å; N152-D155 VanDerWaalsContact O-OD2 3.13Å; H153-D155 PolarHBondContact O-N 3.5Å
156W93.8Very high92.4Very high0 Ų049.9 Ų49.90%025%0.252CS..Hα-helixtrans-74.8-21.8175.3-73.8109000114.4L123 F126 H153 T154 E158 V159 Y160 V165 P166L123-W156 HydrophobicContact CD2-CD2 4.4Å; L123-W156 HydrophobicContact CD2-CH2 3.4Å; L123-W156 VanDerWaalsContact CD2-CH2 3.4Å; L123-W156 HydrophobicContact CD2-CZ2 3.19Å; L123-W156 HydrophobicContact CD2-CZ3 4.11Å; F126-W156 HydrophobicContact CB-CH2 3.85Å; F126-W156 HydrophobicContact CB-CZ3 3.77Å; F126-W156 AromaticContact CD1-CH2 3.99Å; F126-W156 HydrophobicContact CD1-CH2 3.99Å; F126-W156 AromaticContact CD1-CZ3 3.77Å; F126-W156 HydrophobicContact CD1-CZ3 3.77Å; F126-W156 AromaticContact CD2-CH2 3.52Å; F126-W156 HydrophobicContact CD2-CH2 3.52Å; F126-W156 HydrophobicContact CD2-CZ3 4.13Å; F126-W156 HydrophobicContact CE1-CH2 4.43Å; F126-W156 HydrophobicContact CE1-CZ3 4.39Å; F126-W156 AromaticContact CE2-CH2 3.99Å; F126-W156 HydrophobicContact CE2-CH2 3.99Å; F126-W156 AromaticContact CG-CH2 3.51Å; F126-W156 HydrophobicContact CG-CH2 3.51Å; F126-W156 AromaticContact CG-CZ3 3.62Å; F126-W156 HydrophobicContact CG-CZ3 3.62Å; F126-W156 HydrophobicContact CZ-CH2 4.42Å; H153-W156 WeakPolarHBondContact O-CB 3.3Å; H153-W156 PolarHBondContact O-N 2.85Å; H153-W156 VanDerWaalsContact O-N 3.14Å; T154-W156 PolarHBondContact O-N 3.26Å; T154-W156 VanDerWaalsContact O-N 3.15Å; W156-E158 VanDerWaalsContact C-N 3.27Å; W156-E158 PolarHBondContact O-N 3.19Å; W156-V159 HydrophobicContact CE3-CB 4.1Å; W156-V159 HydrophobicContact CE3-CG1 4.22Å; W156-V159 HydrophobicContact CE3-CG2 4.11Å; W156-V159 HydrophobicContact CZ3-CG1 4.19Å; W156-V159 HydrophobicContact CZ3-CG2 4.43Å; W156-V159 PolarHBondContact O-N 3.37Å; W156-V159 VanDerWaalsContact O-N 3.16Å; W156-Y160 HydrophobicContact CB-CD2 4.34Å; W156-Y160 HydrophobicContact CD2-CE2 4.35Å; W156-Y160 HydrophobicContact CE3-CD2 4.15Å; W156-Y160 AromaticContact CE3-CE2 3.61Å; W156-Y160 HydrophobicContact CE3-CE2 3.61Å; W156-Y160 HydrophobicContact CZ3-CE2 4.2Å; W156-Y160 PolarHBondContact O-N 3.3Å; W156-V165 HydrophobicContact CB-CB 4.49Å; W156-V165 HydrophobicContact CB-CG1 4.09Å; W156-V165 HydrophobicContact CG-CB 4.49Å; W156-V165 HydrophobicContact CG-CG1 4.37Å; W156-P166 HydrophobicContact CD2-CG 3.67Å; W156-P166 HydrophobicContact CE3-CG 3.75Å; W156-P166 HydrophobicContact CG-CG 4.41Å; W156-P166 HydrophobicContact CH2-CG 3.74Å; W156-P166 HydrophobicContact CZ2-CG 3.65Å; W156-P166 HydrophobicContact CZ3-CG 3.77Å
157F92.4Very high92.3Very high48 Ų4844.6 Ų44.621%0.21124%0.235CC..Hα-helixtrans-68.7-33-177.6-59-10.6000111.3H153 T154 N161 A162 T163 V165 W185H153-F157 AromaticContact CD2-CZ 3.89Å; T154-F157 HydrophobicContact CG2-CD2 4.15Å; T154-F157 HydrophobicContact CG2-CE2 3.69Å; T154-F157 HydrophobicContact CG2-CZ 4.25Å; T154-F157 WeakPolarHBondContact O-CB 3.35Å; T154-F157 PolarHBondContact O-N 2.99Å; F157-N161 WeakPolarHBondContact O-CA 3.43Å; F157-N161 PolarHBondContact O-N 2.82Å; F157-A162 VanDerWaalsContact CA-O 3.31Å; F157-A162 WeakPolarHBondContact CA-O 3.19Å; F157-A162 PolarHBondContact O-N 2.68Å; F157-T163 HydrophobicContact CD2-CG2 4.32Å; F157-T163 HydrophobicContact CE1-CG2 4.04Å; F157-T163 HydrophobicContact CE2-CG2 3.74Å; F157-T163 HydrophobicContact CZ-CG2 3.6Å; F157-V165 HydrophobicContact CE1-CG1 4.23Å; F157-W185 HydrophobicContact CE1-CH2 4.35Å; F157-W185 AromaticContact CE1-CZ3 3.86Å; F157-W185 HydrophobicContact CE1-CZ3 3.86Å; F157-W185 AromaticContact CZ-CZ3 3.83Å; F157-W185 HydrophobicContact CZ-CZ3 3.83Å
158E89.7Confident92.1Very high149 Ų14945.2 Ų45.270%0.69624%0.239SC*.Hα-helixtrans-68.3-36173.4-64-175.1175.100111.8W156W156-E158 VanDerWaalsContact C-N 3.27Å; W156-E158 PolarHBondContact O-N 3.19Å
159V90Very high92.1Very high30 Ų3045.2 Ų45.218%0.18224%0.239CC..Hα-helixtrans-70-46.3179.8-178.30000111.1L123 W156L123-V159 HydrophobicContact CB-CG2 3.78Å; L123-V159 WeakPolarHBondContact O-CG1 3.28Å; W156-V159 HydrophobicContact CE3-CB 4.1Å; W156-V159 HydrophobicContact CE3-CG1 4.22Å; W156-V159 HydrophobicContact CE3-CG2 4.11Å; W156-V159 HydrophobicContact CZ3-CG1 4.19Å; W156-V159 HydrophobicContact CZ3-CG2 4.43Å; W156-V159 PolarHBondContact O-N 3.37Å; W156-V159 VanDerWaalsContact O-N 3.16Å
160Y89.3Confident91.9Very high59 Ų5945.6 Ų45.623%0.23124%0.242CC..Hα-helixtrans-90.4-6.8-177.2-70.4-58.3000114.3F126 W156 A162 R164 P166F126-Y160 WeakPolarHBondContact CD1-OH 3.33Å; F126-Y160 WeakPolarHBondContact CE1-OH 3.46Å; W156-Y160 HydrophobicContact CB-CD2 4.34Å; W156-Y160 HydrophobicContact CD2-CE2 4.35Å; W156-Y160 HydrophobicContact CE3-CD2 4.15Å; W156-Y160 AromaticContact CE3-CE2 3.61Å; W156-Y160 HydrophobicContact CE3-CE2 3.61Å; W156-Y160 HydrophobicContact CZ3-CE2 4.2Å; W156-Y160 PolarHBondContact O-N 3.3Å; Y160-A162 PolarHBondContact O-N 3.44Å; Y160-A162 VanDerWaalsContact O-N 3.17Å; Y160-R164 VanDerWaalsContact CD1-CZ 3.49Å; Y160-R164 HydrophobicContact CD2-CG 3.68Å; Y160-R164 HydrophobicContact CG-CG 3.7Å; Y160-P166 HydrophobicContact CE2-CG 4.05Å
161N89.9Confident91.7Very high155 Ų15549.6 Ų49.683%0.82926%0.262SS*.THydrogen-bonded Turntrans49.635.3-171.5-163.829.4000112.8F157F157-N161 WeakPolarHBondContact O-CA 3.43Å; F157-N161 PolarHBondContact O-N 2.82Å
162A89.1Confident91.2Very high46 Ų4655.4 Ų55.438%0.3829%0.287SS..SBendtrans-158.4157.3-175.800000109.8F157 Y160 R164F157-A162 VanDerWaalsContact CA-O 3.31Å; F157-A162 WeakPolarHBondContact CA-O 3.19Å; F157-A162 PolarHBondContact O-N 2.68Å; Y160-A162 PolarHBondContact O-N 3.44Å; Y160-A162 VanDerWaalsContact O-N 3.17Å; A162-R164 HydrophobicContact CB-CG 4.14Å; A162-R164 PolarHBondContact O-N 3.22Å
163T90Very high90.6Very high97 Ų9760.5 Ų60.560%0.59530%0.302SS*.SBendtrans-75.566177-37.60000110.8F157F157-T163 HydrophobicContact CD2-CG2 4.32Å; F157-T163 HydrophobicContact CE1-CG2 4.04Å; F157-T163 HydrophobicContact CE2-CG2 3.74Å; F157-T163 HydrophobicContact CZ-CG2 3.6Å
164R91.4Very high90.2Very high92 Ų9262 Ų6235%0.34732%0.316SS..  trans-142.9155.5-176.974.9-178.1-140.41673.6112Y160 A162 G178 L179Y160-R164 VanDerWaalsContact CD1-CZ 3.49Å; Y160-R164 HydrophobicContact CD2-CG 3.68Å; Y160-R164 HydrophobicContact CG-CG 3.7Å; A162-R164 HydrophobicContact CB-CG 4.14Å; A162-R164 PolarHBondContact O-N 3.22Å; R164-G178 VanDerWaalsContact CA-O 3.29Å; R164-G178 WeakPolarHBondContact CA-O 3.45Å; R164-G178 WeakPolarHBondContact CB-O 3.26Å; R164-L179 HydrophobicContact CB-CD2 4.03Å; R164-L179 HydrophobicContact CG-CD2 4.48Å
165V92.9Very high89.7Confident4 Ų465.3 Ų65.32%0.02433%0.332CS..  trans-124.6166.3175.3-60.90000110H153 W156 F157 C169 G178 W185H153-V165 HydrophobicContact CB-CG1 4.37Å; W156-V165 HydrophobicContact CB-CB 4.49Å; W156-V165 HydrophobicContact CB-CG1 4.09Å; W156-V165 HydrophobicContact CG-CB 4.49Å; W156-V165 HydrophobicContact CG-CG1 4.37Å; F157-V165 HydrophobicContact CE1-CG1 4.23Å; V165-C169 HydrophobicContact CB-CB 3.89Å; V165-C169 HydrophobicContact CG2-CB 3.67Å; V165-G178 PolarHBondContact N-O 3.2Å; V165-G178 VanDerWaalsContact O-CA 3.31Å; V165-G178 WeakPolarHBondContact O-CA 3.44Å; V165-W185 HydrophobicContact CG1-CD2 4.22Å; V165-W185 HydrophobicContact CG1-CE3 3.96Å; V165-W185 HydrophobicContact CG1-CZ3 4.26Å; V165-W185 HydrophobicContact CG2-CB 4.44Å; V165-W185 HydrophobicContact CG2-CD2 3.67Å; V165-W185 HydrophobicContact CG2-CE3 4.27Å; V165-W185 HydrophobicContact CG2-CG 3.73Å; V165-W185 HydrophobicContact CG2-CZ2 4.39Å
166P92.9Very high89.3Confident7 Ų769.3 Ų69.35%0.04535%0.354CS..  trans-65.7152.3167.8-1529.2000111.1F126 W156 Y160 S168 C169F126-P166 HydrophobicContact CE1-CB 4.21Å; F126-P166 HydrophobicContact CE1-CG 4.1Å; F126-P166 HydrophobicContact CZ-CB 3.99Å; F126-P166 HydrophobicContact CZ-CG 4.05Å; W156-P166 HydrophobicContact CD2-CG 3.67Å; W156-P166 HydrophobicContact CE3-CG 3.75Å; W156-P166 HydrophobicContact CG-CG 4.41Å; W156-P166 HydrophobicContact CH2-CG 3.74Å; W156-P166 HydrophobicContact CZ2-CG 3.65Å; W156-P166 HydrophobicContact CZ3-CG 3.77Å; Y160-P166 HydrophobicContact CE2-CG 4.05Å; P166-S168 PolarHBondContact O-N 2.7Å; P166-S168 VanDerWaalsContact O-N 3.12Å; P166-C169 VanDerWaalsContact O-CB 3.29Å; P166-C169 WeakPolarHBondContact O-CB 3.46Å; P166-C169 PolarHBondContact O-N 2.92Å
167D91.7Very high89.1Confident42 Ų4269.7 Ų69.723%0.22536%0.356CS..G310 helixtrans-62.1-23-179.5-67.4-18.9000113.3C169 C170 Y173 N176 C177 G178D167-C169 PolarHBondContact O-N 2.97Å; D167-C170 WeakPolarHBondContact O-CB 3.41Å; D167-C170 PolarHBondContact O-N 3.35Å; D167-C170 VanDerWaalsContact O-N 3.17Å; D167-C170 PolarHBondContact O-SG 2.96Å; D167-C170 VanDerWaalsContact O-SG 3.41Å; D167-Y173 HydrophobicContact CB-CE2 4.28Å; D167-N176 WeakPolarHBondContact OD1-CA 3.45Å; D167-N176 PolarHBondContact OD2-N 2.9Å; D167-C177 PolarHBondContact O-SG 2.91Å; D167-C177 PolarHBondContact OD1-N 3.02Å; D167-G178 PolarHBondContact OD1-N 3.45Å
168S92.1Very high88.8Confident12 Ų1267.5 Ų67.58%0.08435%0.347CS..G310 helixtrans-64.2-14.7171.649.30000114.2Q142 P166Q142-S168 PolarHBondContact OE1-OG 3.48Å; P166-S168 PolarHBondContact O-N 2.7Å; P166-S168 VanDerWaalsContact O-N 3.12Å
169C93.2Very high88.7Confident0 Ų064.7 Ų64.70%034%0.336CS..G310 helixtrans-86.2-3.5175.4-80.40000114.1Q142 C148 V165 P166 D167 W185 W186Q142-C169 VanDerWaalsContact CD-SG 3.55Å; Q142-C169 PolarHBondContact OE1-SG 3.24Å; C148-C169 VanDerWaalsContact CA-SG 3.52Å; C148-C169 HydrophobicContact CB-CB 3.65Å; C148-C169 WeakPolarHBondContact CB-SG 3.27Å; C148-C169 WeakPolarHBondContact SG-CB 3.3Å; C148-C169 CovalentContact SG-SG 2.03Å; C148-C169 PolarHBondContact SG-SG 3.03Å; V165-C169 HydrophobicContact CB-CB 3.89Å; V165-C169 HydrophobicContact CG2-CB 3.67Å; P166-C169 VanDerWaalsContact O-CB 3.29Å; P166-C169 WeakPolarHBondContact O-CB 3.46Å; P166-C169 PolarHBondContact O-N 2.92Å; D167-C169 PolarHBondContact O-N 2.97Å; C169-W185 WeakPolarHBondContact O-CA 3.46Å; C169-W186 VanDerWaalsContact C-CD1 3.49Å; C169-W186 PolarHBondContact O-N 3.44Å
170C91.9Very high87.8Confident9 Ų968.5 Ų68.56%0.06136%0.356CS..BIsolated β-bridgetrans-80.3149.3-177-57.50000112.4D167 E172 C177 G178 W186D167-C170 WeakPolarHBondContact O-CB 3.41Å; D167-C170 PolarHBondContact O-N 3.35Å; D167-C170 VanDerWaalsContact O-N 3.17Å; D167-C170 PolarHBondContact O-SG 2.96Å; D167-C170 VanDerWaalsContact O-SG 3.41Å; C170-E172 VanDerWaalsContact C-N 3.34Å; C170-E172 WeakPolarHBondContact CB-O 3.34Å; C170-C177 HydrophobicContact CB-CB 3.8Å; C170-C177 WeakPolarHBondContact CB-SG 3.33Å; C170-C177 WeakPolarHBondContact SG-CB 3.22Å; C170-C177 CovalentContact SG-SG 2.01Å; C170-C177 PolarHBondContact SG-SG 3.44Å; C170-G178 PolarHBondContact SG-N 3.4Å; C170-W186 PolarHBondContact O-NE1 2.98Å
171L89.1Confident87Confident84 Ų8471.7 Ų71.744%0.4438%0.377SS..SBendtrans-61.7-44.1176.4-68.3172.3000111.7T184 W186L171-T184 WeakPolarHBondContact CG-O 3.36Å; L171-T184 PolarHBondContact N-O 3.46Å; L171-W186 HydrophobicContact CD2-CD2 3.73Å; L171-W186 HydrophobicContact CD2-CE3 3.4Å; L171-W186 HydrophobicContact CD2-CH2 3.56Å; L171-W186 HydrophobicContact CD2-CZ2 3.89Å; L171-W186 HydrophobicContact CD2-CZ3 3.31Å
172E85.4Confident86.3Confident170 Ų17067.9 Ų67.979%0.79436%0.361SS*.SBendtrans-118.4129.3170.1-70.5-176.7177.200107.7C170 S174C170-E172 VanDerWaalsContact C-N 3.34Å; C170-E172 WeakPolarHBondContact CB-O 3.34Å; E172-S174 PolarHBondContact O-N 2.88Å
173Y80.6Confident85.9Confident167 Ų16769 Ų6966%0.65538%0.377SS*.  trans-69.1119178.8-178.9-86.4000109.6D167D167-Y173 HydrophobicContact CB-CE2 4.28Å
174S82.9Confident85.7Confident65 Ų6567.5 Ų67.546%0.45537%0.367SS..  trans-143.8149.1166.470.80000109.8E172 N176 C177E172-S174 PolarHBondContact O-N 2.88Å; S174-N176 PolarHBondContact O-N 3.22Å; S174-C177 VanDerWaalsContact O-CB 3.32Å; S174-C177 WeakPolarHBondContact O-CB 3.31Å; S174-C177 PolarHBondContact O-N 3.33Å; S174-C177 VanDerWaalsContact O-N 3.09Å; S174-C177 PolarHBondContact O-SG 2.88Å; S174-C177 WeakPolarHBondContact OG-CB 3.31Å
175D82.8Confident85.7Confident124 Ų12463.4 Ų63.466%0.66335%0.352SS*.THydrogen-bonded Turntrans-57.9126.8-179.5-68.8-21.6000110.7C177D175-C177 VanDerWaalsContact C-N 3.29Å; D175-C177 PolarHBondContact O-N 3.48Å
176N85.3Confident85.6Confident95 Ų9565.7 Ų65.751%0.50836%0.36SS..THydrogen-bonded Turntrans65.917.4-178.5-51.2-72.1000116.2D167 S174 G178 L179D167-N176 WeakPolarHBondContact OD1-CA 3.45Å; D167-N176 PolarHBondContact OD2-N 2.9Å; S174-N176 PolarHBondContact O-N 3.22Å; N176-G178 PolarHBondContact O-N 3.35Å; N176-G178 VanDerWaalsContact O-N 3.15Å; N176-L179 HydrophobicContact CB-CD1 3.96Å; N176-L179 HydrophobicContact CB-CG 4.3Å; N176-L179 WeakPolarHBondContact O-CB 3.31Å; N176-L179 PolarHBondContact O-N 2.85Å
177C88.3Confident85.5Confident9 Ų970.2 Ų70.26%0.06139%0.388CS..G310 helixtrans-59-25.6175.5630000113.4D167 C170 S174 D175 L179 D180 W185D167-C177 PolarHBondContact O-SG 2.91Å; D167-C177 PolarHBondContact OD1-N 3.02Å; C170-C177 HydrophobicContact CB-CB 3.8Å; C170-C177 WeakPolarHBondContact CB-SG 3.33Å; C170-C177 WeakPolarHBondContact SG-CB 3.22Å; C170-C177 CovalentContact SG-SG 2.01Å; C170-C177 PolarHBondContact SG-SG 3.44Å; S174-C177 VanDerWaalsContact O-CB 3.32Å; S174-C177 WeakPolarHBondContact O-CB 3.31Å; S174-C177 PolarHBondContact O-N 3.33Å; S174-C177 VanDerWaalsContact O-N 3.09Å; S174-C177 PolarHBondContact O-SG 2.88Å; S174-C177 WeakPolarHBondContact OG-CB 3.31Å; D175-C177 VanDerWaalsContact C-N 3.29Å; D175-C177 PolarHBondContact O-N 3.48Å; C177-L179 PolarHBondContact O-N 3.45Å; C177-D180 PolarHBondContact O-N 2.96Å; C177-W185 PolarHBondContact O-NE1 3.26Å
178G87.3Confident85.6Confident1 Ų168.9 Ų68.91%0.0138%0.382CS..G310 helixtrans-70.4-11.5178.100000114R164 V165 D167 C170 N176 W185R164-G178 VanDerWaalsContact CA-O 3.29Å; R164-G178 WeakPolarHBondContact CA-O 3.45Å; R164-G178 WeakPolarHBondContact CB-O 3.26Å; V165-G178 PolarHBondContact N-O 3.2Å; V165-G178 VanDerWaalsContact O-CA 3.31Å; V165-G178 WeakPolarHBondContact O-CA 3.44Å; D167-G178 PolarHBondContact OD1-N 3.45Å; C170-G178 PolarHBondContact SG-N 3.4Å; N176-G178 PolarHBondContact O-N 3.35Å; N176-G178 VanDerWaalsContact O-N 3.15Å; G178-W185 WeakPolarHBondContact O-CZ2 3.33Å
179L86.7Confident85.8Confident90 Ų9069.3 Ų69.347%0.47139%0.385SS..G310 helixtrans-90-22174.1-55-176.8000112.8R164 N176 C177R164-L179 HydrophobicContact CB-CD2 4.03Å; R164-L179 HydrophobicContact CG-CD2 4.48Å; N176-L179 HydrophobicContact CB-CD1 3.96Å; N176-L179 HydrophobicContact CB-CG 4.3Å; N176-L179 WeakPolarHBondContact O-CB 3.31Å; N176-L179 PolarHBondContact O-N 2.85Å; C177-L179 PolarHBondContact O-N 3.45Å
180D71.4Confident85.9Confident110 Ų11069.5 Ų69.559%0.58839%0.387SS*.SBendtrans-103.9147.1-172.4-73.9-33.3000111.9C177 W185C177-D180 PolarHBondContact O-N 2.96Å; D180-W185 WeakPolarHBondContact O-CZ2 3.42Å; D180-W185 PolarHBondContact O-NE1 3.11Å
181N72Confident86Confident127 Ų12770.6 Ų70.668%0.67939%0.389SS*.  trans22111.4174.1-96.40.8000117.9G183 T184N181-G183 PolarHBondContact O-N 3.42Å; N181-T184 PolarHBondContact O-N 3.25Å; N181-T184 PolarHBondContact O-OG1 3.06Å
182P75.4Confident86.3Confident75 Ų7571.9 Ų71.949%0.48739%0.393SS..G310 helixtrans-55-16.4175.9-25.432.8000116.4T184 W185P182-T184 VanDerWaalsContact C-N 3.25Å; P182-T184 PolarHBondContact O-N 3.43Å; P182-W185 HydrophobicContact CB-CE3 4Å; P182-W185 HydrophobicContact CB-CH2 4.05Å; P182-W185 HydrophobicContact CB-CZ3 3.68Å; P182-W185 HydrophobicContact CG-CH2 3.83Å; P182-W185 HydrophobicContact CG-CZ2 4.48Å; P182-W185 HydrophobicContact CG-CZ3 3.92Å
183G80.8Confident86.8Confident70 Ų7068.4 Ų68.472%0.72237%0.373SS*.G310 helixtrans-72.7-9.7177.100000115N181N181-G183 PolarHBondContact O-N 3.42Å
184T85.3Confident87.4Confident64 Ų6462.5 Ų62.539%0.39335%0.354SS..G310 helixtrans-108.714.7-177.7510000114.2L171 N181 P182L171-T184 WeakPolarHBondContact CG-O 3.36Å; L171-T184 PolarHBondContact N-O 3.46Å; N181-T184 PolarHBondContact O-N 3.25Å; N181-T184 PolarHBondContact O-OG1 3.06Å; P182-T184 VanDerWaalsContact C-N 3.25Å; P182-T184 PolarHBondContact O-N 3.43Å
185W90.9Very high87.9Confident7 Ų763 Ų633%0.02735%0.348CS..BIsolated β-bridgetrans-106.3154179.8-49.9-27.8000112H153 F157 V165 C169 C177 G178 D180 P182 T187H153-W185 AromaticContact CD2-CE3 3.83Å; F157-W185 HydrophobicContact CE1-CH2 4.35Å; F157-W185 AromaticContact CE1-CZ3 3.86Å; F157-W185 HydrophobicContact CE1-CZ3 3.86Å; F157-W185 AromaticContact CZ-CZ3 3.83Å; F157-W185 HydrophobicContact CZ-CZ3 3.83Å; V165-W185 HydrophobicContact CG1-CD2 4.22Å; V165-W185 HydrophobicContact CG1-CE3 3.96Å; V165-W185 HydrophobicContact CG1-CZ3 4.26Å; V165-W185 HydrophobicContact CG2-CB 4.44Å; V165-W185 HydrophobicContact CG2-CD2 3.67Å; V165-W185 HydrophobicContact CG2-CE3 4.27Å; V165-W185 HydrophobicContact CG2-CG 3.73Å; V165-W185 HydrophobicContact CG2-CZ2 4.39Å; C169-W185 WeakPolarHBondContact O-CA 3.46Å; C177-W185 PolarHBondContact O-NE1 3.26Å; G178-W185 WeakPolarHBondContact O-CZ2 3.33Å; D180-W185 WeakPolarHBondContact O-CZ2 3.42Å; D180-W185 PolarHBondContact O-NE1 3.11Å; P182-W185 HydrophobicContact CB-CE3 4Å; P182-W185 HydrophobicContact CB-CH2 4.05Å; P182-W185 HydrophobicContact CB-CZ3 3.68Å; P182-W185 HydrophobicContact CG-CH2 3.83Å; P182-W185 HydrophobicContact CG-CZ2 4.48Å; P182-W185 HydrophobicContact CG-CZ3 3.92Å; W185-T187 PolarHBondContact O-N 3.48Å
186W91.8Very high88.4Confident51 Ų5161 Ų6119%0.19334%0.338CS..  trans-63.1127.7168.2-62.4113.5000110R146 C148 C169 C170 L171R146-W186 HydrophobicContact CB-CD2 3.9Å; R146-W186 HydrophobicContact CB-CE3 3.99Å; R146-W186 HydrophobicContact CB-CH2 3.91Å; R146-W186 HydrophobicContact CB-CZ2 3.77Å; R146-W186 HydrophobicContact CB-CZ3 3.99Å; R146-W186 HydrophobicContact CG-CH2 4.08Å; R146-W186 HydrophobicContact CG-CZ2 3.81Å; C148-W186 HydrophobicContact CB-CB 4.04Å; C148-W186 WeakPolarHBondContact CB-O 3.31Å; C169-W186 VanDerWaalsContact C-CD1 3.49Å; C169-W186 PolarHBondContact O-N 3.44Å; C170-W186 PolarHBondContact O-NE1 2.98Å; L171-W186 HydrophobicContact CD2-CD2 3.73Å; L171-W186 HydrophobicContact CD2-CE3 3.4Å; L171-W186 HydrophobicContact CD2-CH2 3.56Å; L171-W186 HydrophobicContact CD2-CZ2 3.89Å; L171-W186 HydrophobicContact CD2-CZ3 3.31Å
187T90.3Very high88.8Confident102 Ų10262.7 Ų62.763%0.62634%0.337SS*.  trans-95.3-14.6175.9550000112.8W185W185-T187 PolarHBondContact O-N 3.48Å
188A94.4Very high88.9Confident14 Ų1465.5 Ų65.512%0.11635%0.351CS..SBendtrans-72.8133.5-178.300000111.3C147 C148 R193C147-A188 CarbonylContact C-O 3.59Å; C147-A188 VanDerWaalsContact CA-O 3.27Å; C147-A188 WeakPolarHBondContact CA-O 3.44Å; C147-A188 VanDerWaalsContact CB-O 3.31Å; C147-A188 WeakPolarHBondContact CB-O 3.48Å; C148-A188 PolarHBondContact N-O 3.09Å; A188-R193 HydrophobicContact CB-CG 4.29Å; A188-R193 VanDerWaalsContact CB-CZ 3.47Å; A188-R193 VanDerWaalsContact CB-NH2 3.27Å
189P95.7Very high89.1Confident22 Ų2269.2 Ų69.214%0.14337%0.37CS..  trans-68.2133.9175.722.5-29.3000112.3V150 T151 Y191 E192 R193V150-P189 WeakPolarHBondContact O-CB 3.19Å; T151-P189 WeakPolarHBondContact O-CB 3.16Å; P189-Y191 VanDerWaalsContact C-N 3.34Å; P189-Y191 PolarHBondContact O-N 3.17Å; P189-E192 HydrophobicContact CB-CG 4.28Å; P189-E192 HydrophobicContact CG-CB 3.92Å; P189-E192 HydrophobicContact CG-CG 3.75Å; P189-E192 WeakPolarHBondContact CG-OE2 3.18Å; P189-R193 WeakPolarHBondContact O-CG 3.36Å; P189-R193 PolarHBondContact O-N 3.36Å
190C95.8Very high89.5Confident4 Ų471.3 Ų71.33%0.02738%0.382CS..Hα-helixtrans-67.7-34.7178.2-68.70000112.8V141 C147 G149 V150 E192 R193 V194V141-C190 HydrophobicContact CG1-CB 4.23Å; C147-C190 HydrophobicContact CB-CB 3.85Å; C147-C190 WeakPolarHBondContact CB-SG 3.21Å; C147-C190 WeakPolarHBondContact SG-CA 3.36Å; C147-C190 WeakPolarHBondContact SG-CB 3.04Å; C147-C190 CovalentContact SG-SG 2.04Å; C147-C190 PolarHBondContact SG-SG 3.47Å; G149-C190 WeakPolarHBondContact O-CB 3.33Å; G149-C190 PolarHBondContact O-N 2.89Å; G149-C190 VanDerWaalsContact O-N 3.08Å; G149-C190 PolarHBondContact O-SG 3.03Å; V150-C190 PolarHBondContact O-N 3.01Å; C190-E192 PolarHBondContact O-N 2.71Å; C190-R193 PolarHBondContact O-N 2.82Å; C190-V194 WeakPolarHBondContact O-CB 3.37Å; C190-V194 VanDerWaalsContact O-CG2 3.31Å; C190-V194 WeakPolarHBondContact O-CG2 3.46Å; C190-V194 PolarHBondContact O-N 3.28Å
191Y94.8Very high90.5Very high31 Ų3169.1 Ų69.112%0.12237%0.371CS..Hα-helixtrans-62.3-46.4-179.5-179.2-96.6000111.8D112 A115 Q116 L119 V150 P189 V194 K195D112-Y191 VanDerWaalsContact CA-OH 3.3Å; D112-Y191 WeakPolarHBondContact CA-OH 3.24Å; D112-Y191 WeakPolarHBondContact CB-OH 3.33Å; D112-Y191 VanDerWaalsContact CG-OH 3.27Å; D112-Y191 PolarHBondContact OD1-OH 3.11Å; A115-Y191 HydrophobicContact CB-CE2 3.88Å; Q116-Y191 HydrophobicContact CG-CD1 3.67Å; Q116-Y191 HydrophobicContact CG-CD2 3.89Å; Q116-Y191 HydrophobicContact CG-CE1 3.72Å; Q116-Y191 HydrophobicContact CG-CE2 3.94Å; Q116-Y191 HydrophobicContact CG-CG 3.74Å; L119-Y191 HydrophobicContact CD1-CD2 3.67Å; L119-Y191 HydrophobicContact CD1-CE2 4.32Å; V150-Y191 WeakPolarHBondContact O-CB 3.41Å; V150-Y191 PolarHBondContact O-N 2.8Å; P189-Y191 VanDerWaalsContact C-N 3.34Å; P189-Y191 PolarHBondContact O-N 3.17Å; Y191-V194 PolarHBondContact O-N 3.43Å; Y191-K195 HydrophobicContact CE1-CD 4.27Å; Y191-K195 VanDerWaalsContact O-CB 3.32Å; Y191-K195 WeakPolarHBondContact O-CB 3.32Å; Y191-K195 PolarHBondContact O-N 3.3Å
192E95.2Very high91.5Very high111 Ų11166.3 Ų66.352%0.51936%0.355SS..Hα-helixtrans-67.8-41.7177.8-57.3-175.9162.300111.1P189 C190 V194 K195 D196P189-E192 HydrophobicContact CB-CG 4.28Å; P189-E192 HydrophobicContact CG-CB 3.92Å; P189-E192 HydrophobicContact CG-CG 3.75Å; P189-E192 WeakPolarHBondContact CG-OE2 3.18Å; C190-E192 PolarHBondContact O-N 2.71Å; E192-V194 VanDerWaalsContact C-N 3.32Å; E192-V194 PolarHBondContact O-N 2.92Å; E192-K195 CarbonylContact O-C 3.3Å; E192-K195 WeakPolarHBondContact O-CA 3.39Å; E192-K195 WeakPolarHBondContact O-CB 3.45Å; E192-K195 PolarHBondContact O-N 2.88Å; E192-K195 VanDerWaalsContact O-N 3.08Å; E192-D196 WeakPolarHBondContact O-CB 3.45Å; E192-D196 VanDerWaalsContact O-CG 3.25Å; E192-D196 PolarHBondContact O-N 3.44Å
193R95.5Very high92.3Very high97 Ų9767.6 Ų67.637%0.36636%0.362SS..Hα-helixtrans-59.4-41.1176.9-73.8-67.9-173.177.50.6113.2F145 R146 C147 A188 P189 C190 W197F145-R193 HydrophobicContact CB-CB 4.24Å; F145-R193 HydrophobicContact CD1-CB 4.49Å; F145-R193 PolarHBondContact O-NH1 3.03Å; R146-R193 PolarHBondContact O-NH1 3.45Å; C147-R193 HydrophobicContact CB-CB 4.45Å; C147-R193 HydrophobicContact CB-CG 4.15Å; A188-R193 HydrophobicContact CB-CG 4.29Å; A188-R193 VanDerWaalsContact CB-CZ 3.47Å; A188-R193 VanDerWaalsContact CB-NH2 3.27Å; P189-R193 WeakPolarHBondContact O-CG 3.36Å; P189-R193 PolarHBondContact O-N 3.36Å; C190-R193 PolarHBondContact O-N 2.82Å; R193-W197 WeakPolarHBondContact O-CB 3.48Å; R193-W197 PolarHBondContact O-N 3.26Å
194V93.3Very high92.9Very high44 Ų4466.3 Ų66.327%0.26734%0.344SS..Hα-helixtrans-68.9-40.5174.7172.50000110.6V141 F145 C190 Y191 E192 W197 L198V141-V194 HydrophobicContact CG1-CG2 4.29Å; F145-V194 HydrophobicContact CD1-CG2 4.26Å; F145-V194 HydrophobicContact CD2-CG2 4.13Å; F145-V194 HydrophobicContact CE1-CG2 4.28Å; F145-V194 HydrophobicContact CE2-CG2 4.15Å; F145-V194 HydrophobicContact CG-CG2 4.18Å; F145-V194 HydrophobicContact CZ-CG2 4.22Å; C190-V194 WeakPolarHBondContact O-CB 3.37Å; C190-V194 VanDerWaalsContact O-CG2 3.31Å; C190-V194 WeakPolarHBondContact O-CG2 3.46Å; C190-V194 PolarHBondContact O-N 3.28Å; Y191-V194 PolarHBondContact O-N 3.43Å; E192-V194 VanDerWaalsContact C-N 3.32Å; E192-V194 PolarHBondContact O-N 2.92Å; V194-W197 PolarHBondContact O-N 3.12Å; V194-L198 HydrophobicContact CG1-CD1 4.25Å; V194-L198 WeakPolarHBondContact O-CG 3.37Å; V194-L198 PolarHBondContact O-N 2.94Å
195K92.6Very high93.1Very high75 Ų7567.4 Ų67.433%0.32635%0.347SS..Hα-helixtrans-63.7-40.9176.7-173.4175176.9175.20112.2D112 Y191 E192 L198 N199D112-K195 IonicContact OD2-NZ 2.99Å; D112-K195 PolarHBondContact OD2-NZ 3.23Å; Y191-K195 HydrophobicContact CE1-CD 4.27Å; Y191-K195 VanDerWaalsContact O-CB 3.32Å; Y191-K195 WeakPolarHBondContact O-CB 3.32Å; Y191-K195 PolarHBondContact O-N 3.3Å; E192-K195 CarbonylContact O-C 3.3Å; E192-K195 WeakPolarHBondContact O-CA 3.39Å; E192-K195 WeakPolarHBondContact O-CB 3.45Å; E192-K195 PolarHBondContact O-N 2.88Å; E192-K195 VanDerWaalsContact O-N 3.08Å; K195-L198 WeakPolarHBondContact O-CB 2.9Å; K195-L198 PolarHBondContact O-N 2.01Å; K195-N199 WeakPolarHBondContact O-CB 2.98Å; K195-N199 VanDerWaalsContact O-CG 3.29Å; K195-N199 PolarHBondContact O-N 3.41Å; K195-N199 PolarHBondContact O-ND2 2.85Å
196D94.4Very high93.1Very high83 Ų8373.2 Ų73.244%0.44437%0.369SS..Hα-helixtrans-65.3-45.1176-70.7-18.1000110.7E192 L198 N199 D200E192-D196 WeakPolarHBondContact O-CB 3.45Å; E192-D196 VanDerWaalsContact O-CG 3.25Å; E192-D196 PolarHBondContact O-N 3.44Å; D196-L198 VanDerWaalsContact C-N 3.3Å; D196-L198 PolarHBondContact O-N 3.49Å; D196-N199 WeakPolarHBondContact O-CB 3.44Å; D196-N199 PolarHBondContact O-N 3.48Å; D196-N199 VanDerWaalsContact O-N 3.11Å; D196-D200 PolarHBondContact O-N 3.12Å
197W93.1Very high93.3Very high130 Ų13075.3 Ų75.349%0.49238%0.383SS..Hα-helixtrans-60-40.6173.417988.5000112.3F145 R193 V194 D200 N201F145-W197 HydrophobicContact CD1-CB 4.44Å; F145-W197 HydrophobicContact CE1-CB 3.65Å; F145-W197 HydrophobicContact CE1-CD2 4.19Å; F145-W197 AromaticContact CE1-CG 3.66Å; F145-W197 HydrophobicContact CE1-CG 3.66Å; F145-W197 HydrophobicContact CZ-CD2 4.32Å; F145-W197 HydrophobicContact CZ-CG 4.26Å; R193-W197 WeakPolarHBondContact O-CB 3.48Å; R193-W197 PolarHBondContact O-N 3.26Å; V194-W197 PolarHBondContact O-N 3.12Å; W197-D200 PolarHBondContact O-N 3.22Å; W197-N201 PolarHBondContact NE1-ND2 2.87Å; W197-N201 WeakPolarHBondContact O-CB 2.94Å; W197-N201 PolarHBondContact O-N 3.08Å; W197-N201 VanDerWaalsContact O-N 3.13Å; W197-N201 PolarHBondContact O-ND2 3.44Å
198L90.9Very high93.4Very high68 Ų6877.5 Ų77.536%0.35638%0.384SS..Hα-helixtrans-62.7-43.8173.7-75.1170.2000111.1V194 K195 D196 D200 N201 L202 L205V194-L198 HydrophobicContact CG1-CD1 4.25Å; V194-L198 WeakPolarHBondContact O-CG 3.37Å; V194-L198 PolarHBondContact O-N 2.94Å; K195-L198 WeakPolarHBondContact O-CB 2.9Å; K195-L198 PolarHBondContact O-N 2.01Å; D196-L198 VanDerWaalsContact C-N 3.3Å; D196-L198 PolarHBondContact O-N 3.49Å; L198-D200 PolarHBondContact O-N 3.41Å; L198-N201 CarbonylContact O-C 3.56Å; L198-N201 VanDerWaalsContact O-C 3.3Å; L198-N201 PolarHBondContact O-N 3.43Å; L198-N201 VanDerWaalsContact O-N 3.14Å; L198-L202 WeakPolarHBondContact O-CG 3.39Å; L198-L202 PolarHBondContact O-N 3.44Å; L198-L205 HydrophobicContact CD2-CD1 4.19Å
199N92.1Very high93.3Very high78 Ų7878.7 Ų78.742%0.41739%0.394SS..Hα-helixtrans-59.2-45.2177.3-76.7-29.2000112.1K195 D196 N201 L202K195-N199 WeakPolarHBondContact O-CB 2.98Å; K195-N199 VanDerWaalsContact O-CG 3.29Å; K195-N199 PolarHBondContact O-N 3.41Å; K195-N199 PolarHBondContact O-ND2 2.85Å; D196-N199 WeakPolarHBondContact O-CB 3.44Å; D196-N199 PolarHBondContact O-N 3.48Å; D196-N199 VanDerWaalsContact O-N 3.11Å; N199-N201 PolarHBondContact O-N 3.17Å; N199-L202 HydrophobicContact CB-CD1 4.31Å; N199-L202 WeakPolarHBondContact O-CB 3.33Å; N199-L202 WeakPolarHBondContact O-CG 3.29Å; N199-L202 PolarHBondContact O-N 3.18Å
200D93.8Very high93.2Very high134 Ų13482.8 Ų82.872%0.71741%0.414SS*.Hα-helixtrans-63.6-30.4177.3-70.7-19.1000112.1D196 W197 L198D196-D200 PolarHBondContact O-N 3.12Å; W197-D200 PolarHBondContact O-N 3.22Å; L198-D200 PolarHBondContact O-N 3.41Å
201N93.1Very high93.2Very high65 Ų6585.7 Ų85.735%0.34843%0.434SS..THydrogen-bonded Turntrans-102.612.2-179.8-66.8-81.8000113.7W197 L198 N199 V203 A204 L205W197-N201 PolarHBondContact NE1-ND2 2.87Å; W197-N201 WeakPolarHBondContact O-CB 2.94Å; W197-N201 PolarHBondContact O-N 3.08Å; W197-N201 VanDerWaalsContact O-N 3.13Å; W197-N201 PolarHBondContact O-ND2 3.44Å; L198-N201 CarbonylContact O-C 3.56Å; L198-N201 VanDerWaalsContact O-C 3.3Å; L198-N201 PolarHBondContact O-N 3.43Å; L198-N201 VanDerWaalsContact O-N 3.14Å; N199-N201 PolarHBondContact O-N 3.17Å; N201-V203 PolarHBondContact O-N 3.22Å; N201-V203 VanDerWaalsContact O-N 3.13Å; N201-A204 WeakPolarHBondContact O-CB 3.44Å; N201-A204 PolarHBondContact O-N 3.05Å; N201-L205 PolarHBondContact O-N 3.44Å
202L91.7Very high93.1Very high67 Ų6787.2 Ų87.235%0.35145%0.446SS..Hα-helixtrans-56.1-35.7-177.1-88.2169000112.5L198 N199 A204 L205 W206L198-L202 WeakPolarHBondContact O-CG 3.39Å; L198-L202 PolarHBondContact O-N 3.44Å; N199-L202 HydrophobicContact CB-CD1 4.31Å; N199-L202 WeakPolarHBondContact O-CB 3.33Å; N199-L202 WeakPolarHBondContact O-CG 3.29Å; N199-L202 PolarHBondContact O-N 3.18Å; L202-A204 VanDerWaalsContact C-N 3.26Å; L202-A204 PolarHBondContact O-N 3.4Å; L202-L205 HydrophobicContact CD2-CD1 4.37Å; L202-L205 WeakPolarHBondContact O-CB 3Å; L202-L205 PolarHBondContact O-N 3.24Å; L202-L205 VanDerWaalsContact O-N 3.15Å; L202-W206 PolarHBondContact O-N 2.96Å
203V93.1Very high93.1Very high103 Ų10383.1 Ų83.162%0.62443%0.432SS*.Hα-helixtrans-57.9-41.2178.81780000111.1N201 W206 I207N201-V203 PolarHBondContact O-N 3.22Å; N201-V203 VanDerWaalsContact O-N 3.13Å; V203-W206 PolarHBondContact O-N 2.63Å; V203-I207 HydrophobicContact CG1-CD1 3.9Å; V203-I207 VanDerWaalsContact O-CG1 3.26Å; V203-I207 WeakPolarHBondContact O-CG1 3.27Å; V203-I207 PolarHBondContact O-N 3.07Å
204A93.3Very high93Very high42 Ų4283 Ų8335%0.34744%0.438SS..Hα-helixtrans-64.2-4417800000111.2N201 L202 W206 I207 F208N201-A204 WeakPolarHBondContact O-CB 3.44Å; N201-A204 PolarHBondContact O-N 3.05Å; L202-A204 VanDerWaalsContact C-N 3.26Å; L202-A204 PolarHBondContact O-N 3.4Å; A204-W206 VanDerWaalsContact C-N 3.35Å; A204-W206 PolarHBondContact O-N 2.82Å; A204-I207 PolarHBondContact O-N 3.03Å; A204-F208 WeakPolarHBondContact O-CD2 3.46Å; A204-F208 PolarHBondContact O-N 2.91Å
205L90.4Very high93Very high87 Ų8783.6 Ų83.646%0.45544%0.442SS..Hα-helixtrans-60-43.8177.4-65.4175.4000111.8L198 N201 L202 I207 F208 A209L198-L205 HydrophobicContact CD2-CD1 4.19Å; N201-L205 PolarHBondContact O-N 3.44Å; L202-L205 HydrophobicContact CD2-CD1 4.37Å; L202-L205 WeakPolarHBondContact O-CB 3Å; L202-L205 PolarHBondContact O-N 3.24Å; L202-L205 VanDerWaalsContact O-N 3.15Å; L205-I207 PolarHBondContact O-N 3.33Å; L205-F208 PolarHBondContact O-N 3.15Å; L205-A209 WeakPolarHBondContact O-CB 3.47Å; L205-A209 PolarHBondContact O-N 2.03Å
206W90.8Very high93.1Very high129 Ų12980.9 Ų80.949%0.48943%0.43SS..Hα-helixtrans-64.3-38.5176.2-72.1117.5000112.8F105 L202 V203 A204 A209 L210F105-W206 AromaticContact CE2-CH2 3.75Å; F105-W206 HydrophobicContact CE2-CH2 3.75Å; F105-W206 HydrophobicContact CE2-CZ2 4.39Å; F105-W206 AromaticContact CZ-CH2 3.49Å; F105-W206 HydrophobicContact CZ-CH2 3.49Å; F105-W206 VanDerWaalsContact CZ-CH2 3.49Å; F105-W206 AromaticContact CZ-CZ2 3.66Å; F105-W206 HydrophobicContact CZ-CZ2 3.66Å; L202-W206 PolarHBondContact O-N 2.96Å; V203-W206 PolarHBondContact O-N 2.63Å; A204-W206 VanDerWaalsContact C-N 3.35Å; A204-W206 PolarHBondContact O-N 2.82Å; W206-A209 PolarHBondContact O-N 2.93Å; W206-L210 WeakPolarHBondContact O-CB 3.38Å; W206-L210 PolarHBondContact O-N 3.25Å
207I94.9Very high93.2Very high95 Ų9580.5 Ų80.549%0.48743%0.427SS..Hα-helixtrans-62.5-47.1174.4-70.1166.2000110.3V203 A204 L205 A209 L210 C211V203-I207 HydrophobicContact CG1-CD1 3.9Å; V203-I207 VanDerWaalsContact O-CG1 3.26Å; V203-I207 WeakPolarHBondContact O-CG1 3.27Å; V203-I207 PolarHBondContact O-N 3.07Å; A204-I207 PolarHBondContact O-N 3.03Å; L205-I207 PolarHBondContact O-N 3.33Å; I207-A209 PolarHBondContact O-N 3.47Å; I207-L210 PolarHBondContact O-N 3.27Å; I207-C211 WeakPolarHBondContact O-CB 3.31Å; I207-C211 PolarHBondContact O-N 3.01Å; I207-C211 PolarHBondContact O-SG 3.14Å
208F92.4Very high93.2Very high148 Ų14878.6 Ų78.665%0.64943%0.426SS*.Hα-helixtrans-60.9-44.8177-78.9-67.5000112.2A204 L205 L210 C211 T212A204-F208 WeakPolarHBondContact O-CD2 3.46Å; A204-F208 PolarHBondContact O-N 2.91Å; L205-F208 PolarHBondContact O-N 3.15Å; F208-L210 PolarHBondContact O-N 2.72Å; F208-C211 PolarHBondContact O-N 3.34Å; F208-T212 PolarHBondContact O-N 2.96Å; F208-T212 PolarHBondContact O-OG1 3.48Å
209A91.9Very high93.3Very high40 Ų4076 Ų7633%0.33142%0.416SS..Hα-helixtrans-60.4-45.1177.100000111.9L205 W206 I207 T212 A213L205-A209 WeakPolarHBondContact O-CB 3.47Å; L205-A209 PolarHBondContact O-N 2.03Å; W206-A209 PolarHBondContact O-N 2.93Å; I207-A209 PolarHBondContact O-N 3.47Å; A209-T212 PolarHBondContact O-N 2.91Å; A209-A213 PolarHBondContact O-N 3.19Å
210L94.4Very high93.5Very high107 Ų10773.3 Ų73.356%0.5640%0.401SS*.Hα-helixtrans-64.2-44.6178-178.962.2000112W206 I207 F208 T212 A213 L214W206-L210 WeakPolarHBondContact O-CB 3.38Å; W206-L210 PolarHBondContact O-N 3.25Å; I207-L210 PolarHBondContact O-N 3.27Å; F208-L210 PolarHBondContact O-N 2.72Å; L210-T212 VanDerWaalsContact C-N 3.32Å; L210-T212 PolarHBondContact O-N 2.97Å; L210-A213 PolarHBondContact O-N 3.17Å; L210-L214 HydrophobicContact CD1-CD1 4.31Å; L210-L214 HydrophobicContact CD1-CG 4.26Å; L210-L214 HydrophobicContact CG-CD1 4.09Å; L210-L214 HydrophobicContact CG-CG 4.46Å; L210-L214 WeakPolarHBondContact O-CB 3.4Å; L210-L214 VanDerWaalsContact O-CG 3.31Å; L210-L214 WeakPolarHBondContact O-CG 3.42Å; L210-L214 PolarHBondContact O-N 2.8Å
211C94.8Very high93.4Very high66 Ų6670.5 Ų70.545%0.44639%0.389SS..Hα-helixtrans-59.9-42.7176.5-74.60000111.8I207 F208 T215I207-C211 WeakPolarHBondContact O-CB 3.31Å; I207-C211 PolarHBondContact O-N 3.01Å; I207-C211 PolarHBondContact O-SG 3.14Å; F208-C211 PolarHBondContact O-N 3.34Å; C211-T215 WeakPolarHBondContact O-CB 3.37Å; C211-T215 PolarHBondContact O-N 3.36Å; C211-T215 PolarHBondContact O-OG1 3.38Å
212T93.2Very high93.4Very high62 Ų6269.7 Ų69.738%0.3838%0.382SS..Hα-helixtrans-61.9-49.4176.2-60.70000111.1F208 A209 L210 L214 T215 Q216F208-T212 PolarHBondContact O-N 2.96Å; F208-T212 PolarHBondContact O-OG1 3.48Å; A209-T212 PolarHBondContact O-N 2.91Å; L210-T212 VanDerWaalsContact C-N 3.32Å; L210-T212 PolarHBondContact O-N 2.97Å; T212-L214 PolarHBondContact O-N 2.99Å; T212-T215 WeakPolarHBondContact O-CB 3.23Å; T212-T215 PolarHBondContact O-N 2.75Å; T212-Q216 WeakPolarHBondContact O-CG 3.43Å; T212-Q216 PolarHBondContact O-N 3.34Å
213A94.6Very high93.4Very high26 Ų2666.5 Ų66.522%0.21537%0.366CS..Hα-helixtrans-60.4-44.7178.800000112.3A209 L210 T215 Q216 I217A209-A213 PolarHBondContact O-N 3.19Å; L210-A213 PolarHBondContact O-N 3.17Å; A213-T215 VanDerWaalsContact C-N 3.34Å; A213-T215 PolarHBondContact O-N 3.36Å; A213-Q216 PolarHBondContact O-N 3.43Å; A213-I217 VanDerWaalsContact O-CG1 3.3Å; A213-I217 WeakPolarHBondContact O-CG1 3.15Å; A213-I217 PolarHBondContact O-N 3.29Å
214L94.8Very high93.3Very high93 Ų9364.5 Ų64.549%0.48735%0.35SS..Hα-helixtrans-61.6-43.2176.6-72.8174.2000111.9L210 T212 Q216 I217 L218L210-L214 HydrophobicContact CD1-CD1 4.31Å; L210-L214 HydrophobicContact CD1-CG 4.26Å; L210-L214 HydrophobicContact CG-CD1 4.09Å; L210-L214 HydrophobicContact CG-CG 4.46Å; L210-L214 WeakPolarHBondContact O-CB 3.4Å; L210-L214 VanDerWaalsContact O-CG 3.31Å; L210-L214 WeakPolarHBondContact O-CG 3.42Å; L210-L214 PolarHBondContact O-N 2.8Å; T212-L214 PolarHBondContact O-N 2.99Å; L214-Q216 VanDerWaalsContact C-N 3.34Å; L214-Q216 PolarHBondContact O-N 2.96Å; L214-I217 PolarHBondContact O-N 3.15Å; L214-L218 WeakPolarHBondContact O-CG 3.3Å; L214-L218 PolarHBondContact O-N 3.16Å
215T93.2Very high93.1Very high58 Ų5865 Ų6536%0.35635%0.349SS..Hα-helixtrans-62-42.6177.5-58.70000111.5F20 C211 T212 A213 L218 G219F20-T215 HydrophobicContact CE2-CG2 3.61Å; F20-T215 HydrophobicContact CZ-CG2 3.55Å; C211-T215 WeakPolarHBondContact O-CB 3.37Å; C211-T215 PolarHBondContact O-N 3.36Å; C211-T215 PolarHBondContact O-OG1 3.38Å; T212-T215 WeakPolarHBondContact O-CB 3.23Å; T212-T215 PolarHBondContact O-N 2.75Å; A213-T215 VanDerWaalsContact C-N 3.34Å; A213-T215 PolarHBondContact O-N 3.36Å; T215-L218 PolarHBondContact O-N 3.49Å; T215-G219 PolarHBondContact O-N 3.01Å
216Q95.1Very high93Very high18 Ų1861.4 Ų61.48%0.08433%0.33CS..Hα-helixtrans-63.6-45.2176.7-73.4178.34.600112I93 E97 T212 A213 L214 L218 G219 L220I93-Q216 VanDerWaalsContact CG2-NE2 3.35Å; E97-Q216 PolarHBondContact OE1-NE2 2.98Å; E97-Q216 PolarHBondContact OE2-NE2 3.38Å; E97-Q216 PolarHBondContact OE2-OE1 2.97Å; T212-Q216 WeakPolarHBondContact O-CG 3.43Å; T212-Q216 PolarHBondContact O-N 3.34Å; A213-Q216 PolarHBondContact O-N 3.43Å; L214-Q216 VanDerWaalsContact C-N 3.34Å; L214-Q216 PolarHBondContact O-N 2.96Å; Q216-L218 VanDerWaalsContact C-N 3.32Å; Q216-L218 PolarHBondContact O-N 3.09Å; Q216-G219 WeakPolarHBondContact O-CA 3.24Å; Q216-G219 PolarHBondContact O-N 2.8Å; Q216-G219 VanDerWaalsContact O-N 3.11Å; Q216-L220 WeakPolarHBondContact O-CG 3.22Å; Q216-L220 PolarHBondContact O-N 2.98Å
217I95.1Very high92.9Very high74 Ų7457.6 Ų57.638%0.37932%0.317SS..Hα-helixtrans-59.5-45177.3-68.2166.3000110.4F94 A213 L214 G219 L220 V221F94-I217 HydrophobicContact CE2-CD1 4.39Å; F94-I217 HydrophobicContact CE2-CG1 4.27Å; A213-I217 VanDerWaalsContact O-CG1 3.3Å; A213-I217 WeakPolarHBondContact O-CG1 3.15Å; A213-I217 PolarHBondContact O-N 3.29Å; L214-I217 PolarHBondContact O-N 3.15Å; I217-G219 VanDerWaalsContact C-N 3.33Å; I217-G219 PolarHBondContact O-N 3.36Å; I217-L220 PolarHBondContact O-N 2.95Å; I217-V221 HydrophobicContact CG2-CG2 4.46Å; I217-V221 VanDerWaalsContact O-CG2 3.32Å; I217-V221 WeakPolarHBondContact O-CG2 3.36Å; I217-V221 PolarHBondContact O-N 2.8Å
218L93.4Very high92.5Very high91 Ų9156.2 Ų56.248%0.47632%0.315SS..Hα-helixtrans-60.1-43.8174.8-70.7174.1000111.5L214 T215 Q216 L220 V221 F222L214-L218 WeakPolarHBondContact O-CG 3.3Å; L214-L218 PolarHBondContact O-N 3.16Å; T215-L218 PolarHBondContact O-N 3.49Å; Q216-L218 VanDerWaalsContact C-N 3.32Å; Q216-L218 PolarHBondContact O-N 3.09Å; L218-L220 PolarHBondContact O-N 2.87Å; L218-V221 PolarHBondContact O-N 3.14Å; L218-F222 HydrophobicContact CB-CE2 4.36Å; L218-F222 HydrophobicContact CD2-CZ 4.21Å; L218-F222 WeakPolarHBondContact O-CB 3.38Å; L218-F222 WeakPolarHBondContact O-CG 3.47Å; L218-F222 PolarHBondContact O-N 3.36Å
219G93.6Very high92.1Very high13 Ų1352.1 Ų52.113%0.13430%0.298CS..Hα-helixtrans-58-45.417500000113.1T215 Q216 I217 F222 S223T215-G219 PolarHBondContact O-N 3.01Å; Q216-G219 WeakPolarHBondContact O-CA 3.24Å; Q216-G219 PolarHBondContact O-N 2.8Å; Q216-G219 VanDerWaalsContact O-N 3.11Å; I217-G219 VanDerWaalsContact C-N 3.33Å; I217-G219 PolarHBondContact O-N 3.36Å; G219-F222 PolarHBondContact O-N 3.12Å; G219-S223 WeakPolarHBondContact O-CB 3.34Å; G219-S223 PolarHBondContact O-N 3.3Å; G219-S223 PolarHBondContact O-OG 3.02Å; G219-S223 VanDerWaalsContact O-OG 3.13Å
220L95.3Very high91.6Very high21 Ų2151.1 Ų51.111%0.1129%0.29CS..Hα-helixtrans-61.7-49.6176.8-70.1168.9000111.2F87 L90 L91 Q216 I217 L218 F222 S223 M224F87-L220 HydrophobicContact CD2-CB 4.24Å; F87-L220 HydrophobicContact CD2-CD2 3.44Å; F87-L220 VanDerWaalsContact CD2-CD2 3.44Å; F87-L220 HydrophobicContact CD2-CG 4.47Å; F87-L220 HydrophobicContact CE2-CB 4.05Å; F87-L220 HydrophobicContact CE2-CD2 3.53Å; F87-L220 HydrophobicContact CE2-CG 4.38Å; F87-L220 HydrophobicContact CG-CD2 4.12Å; F87-L220 HydrophobicContact CZ-CD2 4.24Å; F87-L220 WeakPolarHBondContact O-CD2 3.48Å; L90-L220 HydrophobicContact CB-CD2 3.65Å; L90-L220 HydrophobicContact CB-CG 4.13Å; L90-L220 HydrophobicContact CD1-CG 4.48Å; L91-L220 HydrophobicContact CB-CD2 4.04Å; L91-L220 HydrophobicContact CD1-CD1 4.43Å; Q216-L220 WeakPolarHBondContact O-CG 3.22Å; Q216-L220 PolarHBondContact O-N 2.98Å; I217-L220 PolarHBondContact O-N 2.95Å; L218-L220 PolarHBondContact O-N 2.87Å; L220-F222 PolarHBondContact O-N 3.47Å; L220-S223 PolarHBondContact O-N 2.96Å; L220-S223 PolarHBondContact O-OG 3.21Å; L220-M224 PolarHBondContact O-N 3.41Å
221V93.4Very high91.1Very high75 Ų7548.4 Ų48.446%0.45528%0.277SS..Hα-helixtrans-60.8-46.2178.5172.90000111.1I217 L218 M224 T225I217-V221 HydrophobicContact CG2-CG2 4.46Å; I217-V221 VanDerWaalsContact O-CG2 3.32Å; I217-V221 WeakPolarHBondContact O-CG2 3.36Å; I217-V221 PolarHBondContact O-N 2.8Å; L218-V221 PolarHBondContact O-N 3.14Å; V221-M224 PolarHBondContact O-N 2.8Å; V221-T225 HydrophobicContact CG1-CG2 4.41Å; V221-T225 WeakPolarHBondContact O-CB 3.37Å; V221-T225 VanDerWaalsContact O-CG2 3.28Å; V221-T225 WeakPolarHBondContact O-CG2 3.29Å; V221-T225 PolarHBondContact O-N 2.91Å; V221-T225 PolarHBondContact O-OG1 3.23Å
222F91.6Very high90.4Very high48 Ų4852.4 Ų52.421%0.21129%0.287CS..Hα-helixtrans-66.2-41.6180-66.4-11.1000112.2L9 M13 L218 G219 L220 M224 T225 M226L9-F222 HydrophobicContact CD2-CD1 3.73Å; L9-F222 HydrophobicContact CD2-CE1 3.46Å; L9-F222 VanDerWaalsContact CD2-CE1 3.46Å; L9-F222 HydrophobicContact CD2-CG 4.44Å; L9-F222 HydrophobicContact CD2-CZ 3.96Å; M13-F222 HydrophobicContact SD-CB 4.36Å; L218-F222 HydrophobicContact CB-CE2 4.36Å; L218-F222 HydrophobicContact CD2-CZ 4.21Å; L218-F222 WeakPolarHBondContact O-CB 3.38Å; L218-F222 WeakPolarHBondContact O-CG 3.47Å; L218-F222 PolarHBondContact O-N 3.36Å; G219-F222 PolarHBondContact O-N 3.12Å; L220-F222 PolarHBondContact O-N 3.47Å; F222-M224 PolarHBondContact O-N 2.72Å; F222-T225 WeakPolarHBondContact CA-OG1 3.31Å; F222-T225 PolarHBondContact O-OG1 3.18Å; F222-M226 WeakPolarHBondContact O-CB 3.32Å; F222-M226 VanDerWaalsContact O-CG 3.31Å; F222-M226 WeakPolarHBondContact O-CG 3.42Å; F222-M226 PolarHBondContact O-N 3.38Å
223S91.6Very high89.6Confident1 Ų153.4 Ų53.41%0.00729%0.293CS..Hα-helixtrans-64.1-40.7176.667.20000112.9F87 G219 L220 F227F87-S223 WeakPolarHBondContact CD2-OG 3.48Å; G219-S223 WeakPolarHBondContact O-CB 3.34Å; G219-S223 PolarHBondContact O-N 3.3Å; G219-S223 PolarHBondContact O-OG 3.02Å; G219-S223 VanDerWaalsContact O-OG 3.13Å; L220-S223 PolarHBondContact O-N 2.96Å; L220-S223 PolarHBondContact O-OG 3.21Å; S223-F227 VanDerWaalsContact O-CB 3.26Å; S223-F227 WeakPolarHBondContact O-CB 3.38Å; S223-F227 PolarHBondContact O-N 3.26Å
224M91.4Very high88.6Confident61 Ų6157.5 Ų57.530%0.331%0.308SS..Hα-helixtrans-71.9-40.3179.8-86.2-64.9-179.700112.4F87 L220 V221 F222 F227 C228F87-M224 HydrophobicContact CD1-CE 3.42Å; F87-M224 VanDerWaalsContact CD1-CE 3.42Å; F87-M224 HydrophobicContact CD2-CE 3.77Å; F87-M224 HydrophobicContact CD2-CG 3.51Å; F87-M224 HydrophobicContact CD2-SD 4.39Å; F87-M224 HydrophobicContact CE1-CE 3.28Å; F87-M224 HydrophobicContact CE2-CE 3.63Å; F87-M224 HydrophobicContact CE2-CG 3.36Å; F87-M224 HydrophobicContact CE2-SD 4.36Å; F87-M224 HydrophobicContact CG-CE 3.66Å; F87-M224 HydrophobicContact CG-CG 4.27Å; F87-M224 HydrophobicContact CZ-CE 3.39Å; F87-M224 HydrophobicContact CZ-CG 4.05Å; L220-M224 PolarHBondContact O-N 3.41Å; V221-M224 PolarHBondContact O-N 2.8Å; F222-M224 PolarHBondContact O-N 2.72Å; M224-F227 PolarHBondContact O-N 3.23Å; M224-C228 WeakPolarHBondContact O-CB 3.2Å; M224-C228 PolarHBondContact O-N 3.06Å; M224-C228 PolarHBondContact O-SG 2.92Å
225T90.1Very high87.6Confident51 Ų5157.8 Ų57.831%0.31331%0.314SS..Hα-helixtrans-61.7-45.3175.2490000111.4V221 F222 Q229V221-T225 HydrophobicContact CG1-CG2 4.41Å; V221-T225 WeakPolarHBondContact O-CB 3.37Å; V221-T225 VanDerWaalsContact O-CG2 3.28Å; V221-T225 WeakPolarHBondContact O-CG2 3.29Å; V221-T225 PolarHBondContact O-N 2.91Å; V221-T225 PolarHBondContact O-OG1 3.23Å; F222-T225 WeakPolarHBondContact CA-OG1 3.31Å; F222-T225 PolarHBondContact O-OG1 3.18Å; T225-Q229 VanDerWaalsContact O-CG 3.28Å; T225-Q229 WeakPolarHBondContact O-CG 3.49Å; T225-Q229 PolarHBondContact O-N 3.09Å; T225-Q229 VanDerWaalsContact O-N 3.11Å
226M87.1Confident86.5Confident13 Ų1363.3 Ų63.36%0.06433%0.333CS..Hα-helixtrans-63.5-42.6174.4-73.3-66.5-65.100112.4R10 M13 L83 F222 Q229 A230R10-M226 HydrophobicContact CB-CE 4.13Å; R10-M226 HydrophobicContact CB-SD 4.32Å; R10-M226 HydrophobicContact CG-CE 4Å; M13-M226 HydrophobicContact SD-CG 4.39Å; L83-M226 HydrophobicContact CD1-CB 4.16Å; F222-M226 WeakPolarHBondContact O-CB 3.32Å; F222-M226 VanDerWaalsContact O-CG 3.31Å; F222-M226 WeakPolarHBondContact O-CG 3.42Å; F222-M226 PolarHBondContact O-N 3.38Å; M226-Q229 PolarHBondContact O-N 3.22Å; M226-A230 PolarHBondContact O-N 2.96Å
227F88.9Confident84.9Confident48 Ų4871.9 Ų71.921%0.21137%0.366CS..Hα-helixtrans-62.1-49.1177.3179.2-90.8000112R80 L84 S223 M224 Q229 A230 V231R80-F227 HydrophobicContact CB-CD2 4.18Å; R80-F227 HydrophobicContact CB-CE2 3.87Å; R80-F227 HydrophobicContact CG-CD2 4.37Å; R80-F227 HydrophobicContact CG-CE2 4.26Å; L84-F227 HydrophobicContact CB-CD2 4.39Å; L84-F227 HydrophobicContact CB-CE2 4.14Å; S223-F227 VanDerWaalsContact O-CB 3.26Å; S223-F227 WeakPolarHBondContact O-CB 3.38Å; S223-F227 PolarHBondContact O-N 3.26Å; M224-F227 PolarHBondContact O-N 3.23Å; F227-Q229 VanDerWaalsContact C-N 3.25Å; F227-Q229 PolarHBondContact O-N 3.19Å; F227-A230 WeakPolarHBondContact O-CB 3.44Å; F227-A230 PolarHBondContact O-N 2.94Å; F227-V231 HydrophobicContact CD1-CG2 4.15Å; F227-V231 HydrophobicContact CE1-CG2 3.76Å; F227-V231 HydrophobicContact CZ-CG2 4.07Å; F227-V231 WeakPolarHBondContact O-CG2 3.11Å; F227-V231 PolarHBondContact O-N 3.01Å
228C87.3Confident83Confident66 Ų6674.9 Ų74.945%0.44640%0.402SS..Hα-helixtrans-61.4-34.6178.4-71.70000112.5M224 V231 K232M224-C228 WeakPolarHBondContact O-CB 3.2Å; M224-C228 PolarHBondContact O-N 3.06Å; M224-C228 PolarHBondContact O-SG 2.92Å; C228-V231 PolarHBondContact O-N 3.39Å; C228-K232 WeakPolarHBondContact O-CG 3.47Å; C228-K232 PolarHBondContact O-N 3.15Å
229Q83Confident82.5Confident62 Ų6274.1 Ų74.129%0.2940%0.398SS..Hα-helixtrans-68.4-46.9174.5-74.5173.32.400111.6M6 T225 M226 F227 V231 K232 V233M6-Q229 HydrophobicContact SD-CG 4.23Å; M6-Q229 PolarHBondContact SD-NE2 3.35Å; M6-Q229 PolarHBondContact SD-OE1 2.95Å; M6-Q229 VanDerWaalsContact SD-OE1 3.34Å; T225-Q229 VanDerWaalsContact O-CG 3.28Å; T225-Q229 WeakPolarHBondContact O-CG 3.49Å; T225-Q229 PolarHBondContact O-N 3.09Å; T225-Q229 VanDerWaalsContact O-N 3.11Å; M226-Q229 PolarHBondContact O-N 3.22Å; F227-Q229 VanDerWaalsContact C-N 3.25Å; F227-Q229 PolarHBondContact O-N 3.19Å; Q229-V231 PolarHBondContact O-N 2.93Å; Q229-K232 PolarHBondContact O-N 3.06Å; Q229-K232 VanDerWaalsContact O-N 3.09Å; Q229-V233 WeakPolarHBondContact O-CG2 3.43Å; Q229-V233 PolarHBondContact O-N 3.44Å
230A81.8Confident81.9Confident19 Ų1977.3 Ų77.316%0.15741%0.412CS..Hα-helixtrans-55.3-40.1174.900000111R80 M226 F227 E234R80-A230 HydrophobicContact CG-CB 3.95Å; R80-A230 VanDerWaalsContact NH2-C 3.35Å; R80-A230 PolarHBondContact NH2-O 3.27Å; M226-A230 PolarHBondContact O-N 2.96Å; F227-A230 WeakPolarHBondContact O-CB 3.44Å; F227-A230 PolarHBondContact O-N 2.94Å; A230-E234 PolarHBondContact O-N 3.41Å
231V83.9Confident81.2Confident50 Ų5080.4 Ų80.430%0.30343%0.429SS..Hα-helixtrans-59.1-52.4173.2175.60000112.5R80 F227 C228 Q229 V233 E234 T235R80-V231 PolarHBondContact NH2-O 2.81Å; F227-V231 HydrophobicContact CD1-CG2 4.15Å; F227-V231 HydrophobicContact CE1-CG2 3.76Å; F227-V231 HydrophobicContact CZ-CG2 4.07Å; F227-V231 WeakPolarHBondContact O-CG2 3.11Å; F227-V231 PolarHBondContact O-N 3.01Å; C228-V231 PolarHBondContact O-N 3.39Å; Q229-V231 PolarHBondContact O-N 2.93Å; V231-V233 VanDerWaalsContact C-N 3.28Å; V231-V233 PolarHBondContact O-N 3.3Å; V231-E234 PolarHBondContact O-N 3.16Å; V231-T235 PolarHBondContact O-N 3.07Å; V231-T235 PolarHBondContact O-OG1 3.17Å
232K81.3Confident80.5Confident150 Ų15080.8 Ų80.865%0.65243%0.428SS*.Hα-helixtrans-58.6-38.2-179.4-76.3178179.9-178.70113.1C228 Q229 T235 F236C228-K232 WeakPolarHBondContact O-CG 3.47Å; C228-K232 PolarHBondContact O-N 3.15Å; Q229-K232 PolarHBondContact O-N 3.06Å; Q229-K232 VanDerWaalsContact O-N 3.09Å; K232-T235 WeakPolarHBondContact CA-OG1 3.32Å; K232-T235 PolarHBondContact O-N 3.23Å; K232-T235 PolarHBondContact O-OG1 3.22Å; K232-F236 PolarHBondContact O-N 2.69Å
233V76.1Confident79.8Confident83 Ų8382.8 Ų82.850%0.50344%0.441SS..Hα-helixtrans-63.7-50.3-179.6173.90000110.9Q229 V231 T235 F236 Y237Q229-V233 WeakPolarHBondContact O-CG2 3.43Å; Q229-V233 PolarHBondContact O-N 3.44Å; V231-V233 VanDerWaalsContact C-N 3.28Å; V231-V233 PolarHBondContact O-N 3.3Å; V233-T235 PolarHBondContact O-N 3.12Å; V233-F236 WeakPolarHBondContact O-CB 3.31Å; V233-F236 PolarHBondContact O-N 3.31Å; V233-F236 VanDerWaalsContact O-N 3.09Å; V233-Y237 HydrophobicContact CG1-CD2 3.84Å; V233-Y237 HydrophobicContact CG1-CE2 3.92Å; V233-Y237 VanDerWaalsContact O-CD2 3.3Å; V233-Y237 WeakPolarHBondContact O-CD2 3.18Å; V233-Y237 PolarHBondContact O-N 3.33Å
234E72.8Confident79Confident112 Ų11288.3 Ų88.352%0.52347%0.47SS..Hα-helixtrans-65.4-37.7179-69.2176.7-164.800112.6R80 A230 V231 F236 Y237 A238R80-E234 IonicContact CZ-OE1 2.64Å; R80-E234 VanDerWaalsContact CZ-OE1 3.25Å; R80-E234 IonicContact CZ-OE2 3.25Å; R80-E234 IonicContact NE-OE1 3.22Å; R80-E234 VanDerWaalsContact NH1-CD 3.28Å; R80-E234 IonicContact NH1-OE1 2.68Å; R80-E234 IonicContact NH1-OE2 3.7Å; R80-E234 PolarHBondContact NH1-OE2 3.15Å; R80-E234 IonicContact NH2-OE1 3.36Å; R80-E234 PolarHBondContact NH2-OE1 3.08Å; R80-E234 IonicContact NH2-OE2 3.51Å; R80-E234 PolarHBondContact NH2-OE2 3.38Å; A230-E234 PolarHBondContact O-N 3.41Å; V231-E234 PolarHBondContact O-N 3.16Å; E234-F236 PolarHBondContact O-N 2.85Å; E234-F236 VanDerWaalsContact O-N 3.14Å; E234-Y237 PolarHBondContact O-N 2.89Å; E234-A238 WeakPolarHBondContact O-CB 3.47Å; E234-A238 PolarHBondContact O-N 2.99Å
235T74.7Confident78.1Confident100 Ų10090.2 Ų90.261%0.61348%0.482SS*.Hα-helixtrans-63.3-18.9176.246.80000113.4V231 K232 V233V231-T235 PolarHBondContact O-N 3.07Å; V231-T235 PolarHBondContact O-OG1 3.17Å; K232-T235 WeakPolarHBondContact CA-OG1 3.32Å; K232-T235 PolarHBondContact O-N 3.23Å; K232-T235 PolarHBondContact O-OG1 3.22Å; V233-T235 PolarHBondContact O-N 3.12Å
236F70.1Confident77.2Confident174 Ų17493.2 Ų93.276%0.76350%0.495SS*.Hα-helixtrans-87.8-23.7174.7-167.4-93.3000112.7K232 V233 E234K232-F236 PolarHBondContact O-N 2.69Å; V233-F236 WeakPolarHBondContact O-CB 3.31Å; V233-F236 PolarHBondContact O-N 3.31Å; V233-F236 VanDerWaalsContact O-N 3.09Å; E234-F236 PolarHBondContact O-N 2.85Å; E234-F236 VanDerWaalsContact O-N 3.14Å
237Y59.7Low76.3Confident197 Ų19799.9 Ų99.977%0.77353%0.531SS*.Hα-helixtrans-99.8-6.2-179.8-79.1-76.4000114.1V233 E234V233-Y237 HydrophobicContact CG1-CD2 3.84Å; V233-Y237 HydrophobicContact CG1-CE2 3.92Å; V233-Y237 VanDerWaalsContact O-CD2 3.3Å; V233-Y237 WeakPolarHBondContact O-CD2 3.18Å; V233-Y237 PolarHBondContact O-N 3.33Å; E234-Y237 PolarHBondContact O-N 2.89Å
238A56.6Low75.2Confident138 Ų138104.6 Ų104.6100%1.14156%0.56SS**  trans-99.10174.500000111.1E234E234-A238 WeakPolarHBondContact O-CB 3.47Å; E234-A238 PolarHBondContact O-N 2.99Å

Retrieved 238 of 238 residues in 44 ms (Link to these results)

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