A0A5K4F7T0_SCHMA Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A5K4F7T0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 145 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
1M57.3Low81.9Confident117 Ų11759.2 Ų59.258%0.57633%0.325SS*.  0-43.70-80.7-179.2171.100113.3K3 T4 I130M1-K3 VanDerWaalsContact C-N 3.28Å; M1-K3 PolarHBondContact O-N 3.26Å; M1-T4 WeakPolarHBondContact O-CB 3.19Å; M1-T4 PolarHBondContact O-N 3.38Å; M1-T4 VanDerWaalsContact O-N 3.1Å; M1-T4 PolarHBondContact O-OG1 3.15Å; M1-I130 HydrophobicContact CB-CG2 3.97Å; M1-I130 HydrophobicContact CG-CG2 4.3Å; M1-I130 HydrophobicContact SD-CG2 4.18Å
2T71.7Confident82.8Confident105 Ų10564.2 Ų64.264%0.64434%0.342SS*.Hα-helixtrans-56.3-37.6176.146.70000113.6T4 L5 S6T2-T4 VanDerWaalsContact C-N 3.32Å; T2-T4 PolarHBondContact O-N 3.21Å; T2-L5 PolarHBondContact O-N 3.27Å; T2-S6 PolarHBondContact O-N 3.04Å; T2-S6 VanDerWaalsContact O-N 3.13Å
3K75.2Confident83.7Confident64 Ų6462.9 Ų62.928%0.27834%0.341SS..Hα-helixtrans-57.5-40.2174.4-64.4-169.9179.7-177.90113.4M1 L5 S6 L7 D74M1-K3 VanDerWaalsContact C-N 3.28Å; M1-K3 PolarHBondContact O-N 3.26Å; K3-L5 VanDerWaalsContact C-N 3.31Å; K3-L5 PolarHBondContact O-N 2.99Å; K3-S6 WeakPolarHBondContact O-CB 3.42Å; K3-S6 PolarHBondContact O-N 3.36Å; K3-L7 WeakPolarHBondContact O-CB 3.04Å; K3-L7 VanDerWaalsContact O-CG 3.31Å; K3-L7 WeakPolarHBondContact O-CG 3.16Å; K3-L7 PolarHBondContact O-N 2.87Å; K3-D74 WeakPolarHBondContact CE-OD2 2.94Å; K3-D74 IonicContact NZ-OD1 3.95Å; K3-D74 PolarHBondContact NZ-OD1 3.4Å; K3-D74 IonicContact NZ-OD2 2.68Å; K3-D74 PolarHBondContact NZ-OD2 3.32Å
4T77Confident84.6Confident78 Ų7859.6 Ų59.648%0.47932%0.323SS..Hα-helixtrans-61.6-42.5179.8-46.90000111.1M1 T2 L7 I8M1-T4 WeakPolarHBondContact O-CB 3.19Å; M1-T4 PolarHBondContact O-N 3.38Å; M1-T4 VanDerWaalsContact O-N 3.1Å; M1-T4 PolarHBondContact O-OG1 3.15Å; T2-T4 VanDerWaalsContact C-N 3.32Å; T2-T4 PolarHBondContact O-N 3.21Å; T4-L7 PolarHBondContact O-N 3.2Å; T4-I8 HydrophobicContact CG2-CD1 4.18Å; T4-I8 VanDerWaalsContact O-CG1 3.31Å; T4-I8 WeakPolarHBondContact O-CG1 3.43Å; T4-I8 PolarHBondContact O-N 3.13Å; T4-I8 VanDerWaalsContact O-N 3.12Å
5L83.1Confident85.4Confident25 Ų2560.6 Ų60.613%0.13133%0.331CS..Hα-helixtrans-65-42.4176.8-173.9129.5000111.3T2 K3 I8 L9 L126 I127 I130T2-L5 PolarHBondContact O-N 3.27Å; K3-L5 VanDerWaalsContact C-N 3.31Å; K3-L5 PolarHBondContact O-N 2.99Å; L5-I8 PolarHBondContact O-N 3.4Å; L5-L9 HydrophobicContact CD1-CD1 4.44Å; L5-L9 HydrophobicContact CD2-CD1 3.39Å; L5-L9 HydrophobicContact CG-CD1 3.63Å; L5-L9 HydrophobicContact CG-CG 4.36Å; L5-L9 WeakPolarHBondContact O-CB 3.21Å; L5-L9 WeakPolarHBondContact O-CG 3.48Å; L5-L9 PolarHBondContact O-N 3.26Å; L5-L126 HydrophobicContact CD1-CB 3.44Å; L5-L126 VanDerWaalsContact CD1-CB 3.44Å; L5-I127 HydrophobicContact CD1-CG1 4.17Å; L5-I127 HydrophobicContact CD2-CG1 4.04Å; L5-I130 HydrophobicContact CB-CD1 4.07Å; L5-I130 HydrophobicContact CD1-CD1 3.54Å; L5-I130 HydrophobicContact CG-CD1 4.39Å
6S85.5Confident86Confident38 Ų3865 Ų6527%0.26635%0.347SS..Hα-helixtrans-61.5-45.2174.8-160.90000112T2 K3 I8 L9 Q10T2-S6 PolarHBondContact O-N 3.04Å; T2-S6 VanDerWaalsContact O-N 3.13Å; K3-S6 WeakPolarHBondContact O-CB 3.42Å; K3-S6 PolarHBondContact O-N 3.36Å; S6-I8 PolarHBondContact O-N 2.85Å; S6-L9 PolarHBondContact O-N 3.49Å; S6-Q10 WeakPolarHBondContact O-CB 3.1Å; S6-Q10 PolarHBondContact O-N 3.01Å
7L86.3Confident86.6Confident37 Ų3763 Ų6319%0.19434%0.336CS..Hα-helixtrans-64-26.5179.9-78.4163.1000113.9K3 T4 P11 F61 E64 L65 I68K3-L7 WeakPolarHBondContact O-CB 3.04Å; K3-L7 VanDerWaalsContact O-CG 3.31Å; K3-L7 WeakPolarHBondContact O-CG 3.16Å; K3-L7 PolarHBondContact O-N 2.87Å; T4-L7 PolarHBondContact O-N 3.2Å; L7-P11 WeakPolarHBondContact O-CD 3.04Å; L7-P11 WeakPolarHBondContact O-CG 3.39Å; L7-F61 HydrophobicContact CD2-CE2 4.21Å; L7-E64 HydrophobicContact CD2-CB 4.38Å; L7-E64 HydrophobicContact CD2-CG 3.75Å; L7-E64 HydrophobicContact CG-CG 4.04Å; L7-L65 HydrophobicContact CD2-CD2 3.79Å; L7-I68 HydrophobicContact CD1-CD1 3.29Å; L7-I68 HydrophobicContact CD1-CG1 3.99Å; L7-I68 HydrophobicContact CD2-CD1 3.64Å; L7-I68 HydrophobicContact CG-CD1 4.07Å
8I87.8Confident87.1Confident89 Ų8963.6 Ų63.646%0.45634%0.338SS..Hα-helixtrans-85-54.4174.3-64.8166.8000109.1T4 L5 S6 Q10 P11 F12T4-I8 HydrophobicContact CG2-CD1 4.18Å; T4-I8 VanDerWaalsContact O-CG1 3.31Å; T4-I8 WeakPolarHBondContact O-CG1 3.43Å; T4-I8 PolarHBondContact O-N 3.13Å; T4-I8 VanDerWaalsContact O-N 3.12Å; L5-I8 PolarHBondContact O-N 3.4Å; S6-I8 PolarHBondContact O-N 2.85Å; I8-Q10 PolarHBondContact O-N 3.43Å; I8-P11 WeakPolarHBondContact O-CD 3.37Å; I8-P11 VanDerWaalsContact O-CG 3.25Å; I8-P11 WeakPolarHBondContact O-CG 3.07Å; I8-F12 HydrophobicContact CG2-CD2 3.83Å; I8-F12 HydrophobicContact CG2-CE2 3.82Å; I8-F12 WeakPolarHBondContact O-CD2 3.02Å; I8-F12 PolarHBondContact O-N 3.22Å
9L91.5Very high87.6Confident46 Ų4664 Ų6424%0.24134%0.339CS..Hα-helixtrans-67.1-32.9-171.5-71.1173.2000114L5 S6 S13 Q123 L126L5-L9 HydrophobicContact CD1-CD1 4.44Å; L5-L9 HydrophobicContact CD2-CD1 3.39Å; L5-L9 HydrophobicContact CG-CD1 3.63Å; L5-L9 HydrophobicContact CG-CG 4.36Å; L5-L9 WeakPolarHBondContact O-CB 3.21Å; L5-L9 WeakPolarHBondContact O-CG 3.48Å; L5-L9 PolarHBondContact O-N 3.26Å; S6-L9 PolarHBondContact O-N 3.49Å; L9-S13 WeakPolarHBondContact O-CB 3.46Å; L9-S13 PolarHBondContact O-N 3.47Å; L9-Q123 HydrophobicContact CD1-CG 4.26Å; L9-L126 HydrophobicContact CD1-CD1 4.28Å; L9-L126 HydrophobicContact CD2-CD1 3.87Å; L9-L126 HydrophobicContact CG-CD1 4.43Å
10Q91Very high87.8Confident13 Ų1363 Ų636%0.06134%0.34CS..Hα-helixtrans-68-48.4-177.8-170.9164.8-11.300113.8S6 I8 F12 S13 I14 L57 F61S6-Q10 WeakPolarHBondContact O-CB 3.1Å; S6-Q10 PolarHBondContact O-N 3.01Å; I8-Q10 PolarHBondContact O-N 3.43Å; Q10-F12 VanDerWaalsContact C-N 3.33Å; Q10-F12 PolarHBondContact O-N 3.13Å; Q10-S13 PolarHBondContact O-N 3.35Å; Q10-S13 PolarHBondContact O-OG 3.32Å; Q10-I14 HydrophobicContact CG-CD1 4.31Å; Q10-I14 WeakPolarHBondContact O-CG1 3.3Å; Q10-I14 PolarHBondContact O-N 2.02Å; Q10-L57 PolarHBondContact NE2-O 3.08Å; Q10-F61 HydrophobicContact CB-CD2 4.29Å; Q10-F61 HydrophobicContact CG-CB 4.19Å; Q10-F61 HydrophobicContact CG-CD2 4.18Å
11P94.3Very high88.1Confident39 Ų3960.5 Ų60.525%0.25333%0.327SS..Hα-helixtrans-65.6-36.5174.224.2-33.3000112L7 I8 S13 I14 V15 F61L7-P11 WeakPolarHBondContact O-CD 3.04Å; L7-P11 WeakPolarHBondContact O-CG 3.39Å; I8-P11 WeakPolarHBondContact O-CD 3.37Å; I8-P11 VanDerWaalsContact O-CG 3.25Å; I8-P11 WeakPolarHBondContact O-CG 3.07Å; P11-S13 VanDerWaalsContact C-N 3.33Å; P11-S13 PolarHBondContact O-N 3.12Å; P11-I14 PolarHBondContact O-N 2.86Å; P11-V15 WeakPolarHBondContact O-CB 3.23Å; P11-V15 VanDerWaalsContact O-CG2 3.29Å; P11-V15 WeakPolarHBondContact O-CG2 3.43Å; P11-V15 PolarHBondContact O-N 3.46Å; P11-F61 HydrophobicContact CB-CE2 4.2Å; P11-F61 HydrophobicContact CB-CZ 4.13Å; P11-F61 HydrophobicContact CG-CE2 3.91Å; P11-F61 HydrophobicContact CG-CZ 4.16Å
12F93.6Very high89.8Confident119 Ų11960.5 Ų60.552%0.52233%0.328SS..Hα-helixtrans-59.2-44.4173.4-86.9-71.6000111.5I8 Q10 V15 F16I8-F12 HydrophobicContact CG2-CD2 3.83Å; I8-F12 HydrophobicContact CG2-CE2 3.82Å; I8-F12 WeakPolarHBondContact O-CD2 3.02Å; I8-F12 PolarHBondContact O-N 3.22Å; Q10-F12 VanDerWaalsContact C-N 3.33Å; Q10-F12 PolarHBondContact O-N 3.13Å; F12-V15 PolarHBondContact O-N 3.36Å; F12-F16 HydrophobicContact CB-CD2 4.42Å; F12-F16 HydrophobicContact CB-CE2 4.32Å; F12-F16 AromaticContact CD1-CE2 3.96Å; F12-F16 HydrophobicContact CD1-CE2 3.96Å; F12-F16 WeakPolarHBondContact O-CD2 3.49Å; F12-F16 PolarHBondContact O-N 3.23Å
13S94.4Very high90.8Very high48 Ų4859.2 Ų59.234%0.33632%0.317SS..Hα-helixtrans-63.4-43.9178.174.10000111.9L9 Q10 P11 V15 F16 I17L9-S13 WeakPolarHBondContact O-CB 3.46Å; L9-S13 PolarHBondContact O-N 3.47Å; Q10-S13 PolarHBondContact O-N 3.35Å; Q10-S13 PolarHBondContact O-OG 3.32Å; P11-S13 VanDerWaalsContact C-N 3.33Å; P11-S13 PolarHBondContact O-N 3.12Å; S13-V15 PolarHBondContact O-N 2.9Å; S13-F16 PolarHBondContact O-N 3.39Å; S13-I17 WeakPolarHBondContact O-CD1 3.33Å; S13-I17 WeakPolarHBondContact O-CG1 3.42Å; S13-I17 PolarHBondContact O-N 2.88Å
14I96.3Very high91.3Very high17 Ų1761 Ų619%0.08733%0.329CS..Hα-helixtrans-58.5-48.9175.7-67166.3000110.6Q10 P11 F16 I17 I18 L54 L57 F61Q10-I14 HydrophobicContact CG-CD1 4.31Å; Q10-I14 WeakPolarHBondContact O-CG1 3.3Å; Q10-I14 PolarHBondContact O-N 2.02Å; P11-I14 PolarHBondContact O-N 2.86Å; I14-F16 PolarHBondContact O-N 2.8Å; I14-I17 PolarHBondContact O-N 3.11Å; I14-I18 HydrophobicContact CG2-CD1 3.77Å; I14-I18 HydrophobicContact CG2-CG1 4.49Å; I14-I18 VanDerWaalsContact O-CG1 3.31Å; I14-I18 WeakPolarHBondContact O-CG1 3.44Å; I14-I18 PolarHBondContact O-N 3.25Å; I14-L54 HydrophobicContact CG2-CD2 4.2Å; I14-L57 HydrophobicContact CD1-CB 4.39Å; I14-L57 HydrophobicContact CG1-CB 4.2Å; I14-F61 HydrophobicContact CD1-CB 4.19Å
15V96.4Very high91.9Very high74 Ų7465.8 Ų65.845%0.44835%0.345SS..Hα-helixtrans-60.4-47.1179.3168.70000111.2P11 F12 S13 I17 I18 I19P11-V15 WeakPolarHBondContact O-CB 3.23Å; P11-V15 VanDerWaalsContact O-CG2 3.29Å; P11-V15 WeakPolarHBondContact O-CG2 3.43Å; P11-V15 PolarHBondContact O-N 3.46Å; F12-V15 PolarHBondContact O-N 3.36Å; S13-V15 PolarHBondContact O-N 2.9Å; V15-I17 VanDerWaalsContact C-N 3.33Å; V15-I17 PolarHBondContact O-N 2.87Å; V15-I18 PolarHBondContact O-N 3.46Å; V15-I19 HydrophobicContact CG1-CD1 3.65Å; V15-I19 HydrophobicContact CG1-CG1 4.35Å; V15-I19 WeakPolarHBondContact O-CB 3.29Å; V15-I19 VanDerWaalsContact O-CG1 3.27Å; V15-I19 WeakPolarHBondContact O-CG1 3.31Å; V15-I19 PolarHBondContact O-N 2.99Å
16F95.3Very high92.1Very high131 Ų13166.3 Ų66.358%0.57535%0.346SS*.Hα-helixtrans-64.3-36.8178.6-76.7-57.9000112.8F12 S13 I14 I19 A20F12-F16 HydrophobicContact CB-CD2 4.42Å; F12-F16 HydrophobicContact CB-CE2 4.32Å; F12-F16 AromaticContact CD1-CE2 3.96Å; F12-F16 HydrophobicContact CD1-CE2 3.96Å; F12-F16 WeakPolarHBondContact O-CD2 3.49Å; F12-F16 PolarHBondContact O-N 3.23Å; S13-F16 PolarHBondContact O-N 3.39Å; I14-F16 PolarHBondContact O-N 2.8Å; F16-I19 PolarHBondContact O-N 3.49Å; F16-A20 WeakPolarHBondContact O-CB 3.48Å; F16-A20 PolarHBondContact O-N 2.95Å
17I95.5Very high92.1Very high31 Ų3169.5 Ų69.516%0.15936%0.36CS..Hα-helixtrans-64.9-44.9174.5-66162.1000110.2S13 I14 V15 I19 A20 L21 F50 L54 L57 I94S13-I17 WeakPolarHBondContact O-CD1 3.33Å; S13-I17 WeakPolarHBondContact O-CG1 3.42Å; S13-I17 PolarHBondContact O-N 2.88Å; I14-I17 PolarHBondContact O-N 3.11Å; V15-I17 VanDerWaalsContact C-N 3.33Å; V15-I17 PolarHBondContact O-N 2.87Å; I17-I19 PolarHBondContact O-N 2.89Å; I17-A20 WeakPolarHBondContact O-CB 3.41Å; I17-A20 PolarHBondContact O-N 3.36Å; I17-L21 WeakPolarHBondContact O-CG 3.4Å; I17-L21 PolarHBondContact O-N 2.82Å; I17-F50 HydrophobicContact CG2-CD1 4.43Å; I17-L54 HydrophobicContact CB-CD2 3.95Å; I17-L54 HydrophobicContact CG2-CD1 4.1Å; I17-L54 HydrophobicContact CG2-CD2 3.62Å; I17-L54 HydrophobicContact CG2-CG 3.89Å; I17-L57 HydrophobicContact CD1-CD1 4.11Å; I17-I94 HydrophobicContact CD1-CD1 4.49Å; I17-I94 HydrophobicContact CD1-CG1 4.39Å; I17-I94 HydrophobicContact CD1-CG2 4.26Å; I17-I94 HydrophobicContact CG2-CD1 4.28Å
18I96.4Very high92.1Very high73 Ų7368.8 Ų68.837%0.37436%0.358SS..Hα-helixtrans-60.5-46.8177-69167.3000110.7I14 V15 A20 L21 I22 L54I14-I18 HydrophobicContact CG2-CD1 3.77Å; I14-I18 HydrophobicContact CG2-CG1 4.49Å; I14-I18 VanDerWaalsContact O-CG1 3.31Å; I14-I18 WeakPolarHBondContact O-CG1 3.44Å; I14-I18 PolarHBondContact O-N 3.25Å; V15-I18 PolarHBondContact O-N 3.46Å; I18-A20 VanDerWaalsContact C-N 3.3Å; I18-A20 PolarHBondContact O-N 3.02Å; I18-L21 PolarHBondContact O-N 3.1Å; I18-L21 VanDerWaalsContact O-N 3.16Å; I18-I22 HydrophobicContact CG2-CD1 3.74Å; I18-I22 WeakPolarHBondContact O-CG1 3.35Å; I18-I22 PolarHBondContact O-N 3.16Å; I18-I22 VanDerWaalsContact O-N 3.1Å; I18-L54 HydrophobicContact CG1-CD1 4.14Å; I18-L54 HydrophobicContact CG1-CD2 4.13Å
19I95.5Very high92.1Very high72 Ų7265.7 Ų65.737%0.36935%0.347SS..Hα-helixtrans-58.3-44.3176.6-70.1168.5000110.4V15 F16 I17 L21 I22 I23V15-I19 HydrophobicContact CG1-CD1 3.65Å; V15-I19 HydrophobicContact CG1-CG1 4.35Å; V15-I19 WeakPolarHBondContact O-CB 3.29Å; V15-I19 VanDerWaalsContact O-CG1 3.27Å; V15-I19 WeakPolarHBondContact O-CG1 3.31Å; V15-I19 PolarHBondContact O-N 2.99Å; F16-I19 PolarHBondContact O-N 3.49Å; I17-I19 PolarHBondContact O-N 2.89Å; I19-L21 VanDerWaalsContact C-N 3.3Å; I19-L21 PolarHBondContact O-N 3.33Å; I19-I22 PolarHBondContact O-N 3.39Å; I19-I22 VanDerWaalsContact O-N 3.16Å; I19-I23 HydrophobicContact CG2-CD1 3.48Å; I19-I23 VanDerWaalsContact CG2-CD1 3.48Å; I19-I23 HydrophobicContact CG2-CG1 4.14Å; I19-I23 VanDerWaalsContact O-CG1 3.29Å; I19-I23 WeakPolarHBondContact O-CG1 3.42Å; I19-I23 PolarHBondContact O-N 3.14Å
20A92.6Very high91.9Very high43 Ų4363.6 Ų63.636%0.35534%0.337SS..Hα-helixtrans-60.4-38177.600000112.7F16 I17 I18 W26F16-A20 WeakPolarHBondContact O-CB 3.48Å; F16-A20 PolarHBondContact O-N 2.95Å; I17-A20 WeakPolarHBondContact O-CB 3.41Å; I17-A20 PolarHBondContact O-N 3.36Å; I18-A20 VanDerWaalsContact C-N 3.3Å; I18-A20 PolarHBondContact O-N 3.02Å; A20-W26 HydrophobicContact CB-CZ2 4.44Å; A20-W26 WeakPolarHBondContact O-CZ2 3.33Å; A20-W26 PolarHBondContact O-NE1 2.94Å
21L93.2Very high91.7Very high11 Ų1163 Ų636%0.05833%0.334CS..Hα-helixtrans-68.5-32.9176.5-68.3176.8000113.1I17 I18 I19 W26 L31 F32 F50 L54I17-L21 WeakPolarHBondContact O-CG 3.4Å; I17-L21 PolarHBondContact O-N 2.82Å; I18-L21 PolarHBondContact O-N 3.1Å; I18-L21 VanDerWaalsContact O-N 3.16Å; I19-L21 VanDerWaalsContact C-N 3.3Å; I19-L21 PolarHBondContact O-N 3.33Å; L21-W26 HydrophobicContact CD2-CZ2 4.46Å; L21-L31 HydrophobicContact CD2-CD2 3.63Å; L21-F32 HydrophobicContact CB-CE2 4.25Å; L21-F32 WeakPolarHBondContact O-CE2 3.15Å; L21-F50 HydrophobicContact CD1-CB 4.2Å; L21-F50 HydrophobicContact CD2-CB 3.99Å; L21-F50 HydrophobicContact CD2-CD1 4.25Å; L21-F50 HydrophobicContact CD2-CD2 3.78Å; L21-F50 HydrophobicContact CD2-CE2 4.3Å; L21-F50 HydrophobicContact CD2-CG 3.77Å; L21-L54 HydrophobicContact CD1-CD1 3.54Å
22I93.2Very high91.5Very high118 Ų11865 Ų6561%0.60534%0.339SS*.Hα-helixtrans-78.9-35.3-179.7-65.4167000111.3I18 I19 N24I18-I22 HydrophobicContact CG2-CD1 3.74Å; I18-I22 WeakPolarHBondContact O-CG1 3.35Å; I18-I22 PolarHBondContact O-N 3.16Å; I18-I22 VanDerWaalsContact O-N 3.1Å; I19-I22 PolarHBondContact O-N 3.39Å; I19-I22 VanDerWaalsContact O-N 3.16Å; I22-N24 PolarHBondContact O-N 2.95Å
23I92.2Very high91.3Very high78 Ų7863.2 Ų63.240%0.434%0.338SS..  trans-66.8127.3-178.5-73172000110.6I19 H25 W26I19-I23 HydrophobicContact CG2-CD1 3.48Å; I19-I23 VanDerWaalsContact CG2-CD1 3.48Å; I19-I23 HydrophobicContact CG2-CG1 4.14Å; I19-I23 VanDerWaalsContact O-CG1 3.29Å; I19-I23 WeakPolarHBondContact O-CG1 3.42Å; I19-I23 PolarHBondContact O-N 3.14Å; I23-H25 HydrophobicContact CG2-CB 3.69Å; I23-H25 PolarHBondContact O-N 3.2Å; I23-W26 PolarHBondContact O-NE1 2.97Å; I23-W26 VanDerWaalsContact O-NE1 3.14Å
24N87.4Confident91.1Very high100 Ų10064.2 Ų64.254%0.53534%0.342SS..  trans-87.229.4-179.5-67.4-46.9000114I22 G29 G30I22-N24 PolarHBondContact O-N 2.95Å; N24-G29 CarbonylContact C-O 3.2Å; N24-G29 CarbonylContact O-C 3.28Å; N24-G29 VanDerWaalsContact O-C 3.28Å; N24-G29 VanDerWaalsContact O-O 3.08Å; N24-G30 WeakPolarHBondContact OD1-CA 3.48Å
25H88.7Confident90.6Very high179 Ų17963.4 Ų63.483%0.82934%0.338SS*.  trans-105.630-179.4-70.1-63.5000112.9I23I23-H25 HydrophobicContact CG2-CB 3.69Å; I23-H25 PolarHBondContact O-N 3.2Å
26W87Confident90.3Very high36 Ų3662.6 Ų62.614%0.13633%0.331CS..BIsolated β-bridgetrans-71.5161166.4-56.877.1000109A20 L21 I23 C28 G29 F50 I98 Y101A20-W26 HydrophobicContact CB-CZ2 4.44Å; A20-W26 WeakPolarHBondContact O-CZ2 3.33Å; A20-W26 PolarHBondContact O-NE1 2.94Å; L21-W26 HydrophobicContact CD2-CZ2 4.46Å; I23-W26 PolarHBondContact O-NE1 2.97Å; I23-W26 VanDerWaalsContact O-NE1 3.14Å; W26-C28 PolarHBondContact O-N 3.46Å; W26-C28 VanDerWaalsContact O-N 3.11Å; W26-G29 WeakPolarHBondContact CA-O 3.44Å; W26-G29 WeakPolarHBondContact CB-O 3.26Å; W26-G29 PolarHBondContact N-O 3.48Å; W26-G29 WeakPolarHBondContact O-CA 3.21Å; W26-G29 PolarHBondContact O-N 2.91Å; W26-F50 HydrophobicContact CH2-CE2 4.15Å; W26-F50 HydrophobicContact CH2-CZ 4.01Å; W26-I98 HydrophobicContact CZ3-CD1 4.27Å; W26-Y101 HydrophobicContact CE3-CD1 4.22Å; W26-Y101 HydrophobicContact CE3-CD2 4.03Å; W26-Y101 AromaticContact CE3-CE1 3.84Å; W26-Y101 HydrophobicContact CE3-CE1 3.84Å; W26-Y101 AromaticContact CE3-CE2 3.63Å; W26-Y101 HydrophobicContact CE3-CE2 3.63Å; W26-Y101 HydrophobicContact CE3-CG 4.31Å; W26-Y101 AromaticContact CE3-CZ 3.53Å; W26-Y101 HydrophobicContact CZ3-CD1 4.05Å; W26-Y101 HydrophobicContact CZ3-CD2 4.25Å; W26-Y101 HydrophobicContact CZ3-CE1 4.06Å; W26-Y101 HydrophobicContact CZ3-CE2 4.28Å; W26-Y101 HydrophobicContact CZ3-CG 4.15Å
27N85.3Confident90Very high106 Ų10666.1 Ų66.157%0.56734%0.34SS*.THydrogen-bonded Turntrans-59.9-29.1-176.1-167.639.5000112.4Y101 M105N27-Y101 WeakPolarHBondContact CB-OH 3.35Å; N27-Y101 PolarHBondContact N-OH 3.31Å; N27-M105 PolarHBondContact ND2-O 2.67Å
28C86.2Confident89.7Confident22 Ų2269.5 Ų69.515%0.14936%0.359CS..THydrogen-bonded Turntrans-94.27.9173.442.70000114.1W26 T34 C35W26-C28 PolarHBondContact O-N 3.46Å; W26-C28 VanDerWaalsContact O-N 3.11Å; C28-T34 WeakPolarHBondContact O-CB 3.33Å; C28-T34 WeakPolarHBondContact O-CG2 3.28Å; C28-C35 HydrophobicContact CB-CB 3.99Å; C28-C35 WeakPolarHBondContact CB-SG 3.41Å; C28-C35 WeakPolarHBondContact SG-CB 3.5Å; C28-C35 CovalentContact SG-SG 2.02Å; C28-C35 PolarHBondContact SG-SG 2.94Å
29G88.2Confident89.4Confident23 Ų2371.3 Ų71.324%0.23736%0.362CS..BIsolated β-bridgetrans98.1-121.8-176.200000112.8N24 W26N24-G29 CarbonylContact C-O 3.2Å; N24-G29 CarbonylContact O-C 3.28Å; N24-G29 VanDerWaalsContact O-C 3.28Å; N24-G29 VanDerWaalsContact O-O 3.08Å; W26-G29 WeakPolarHBondContact CA-O 3.44Å; W26-G29 WeakPolarHBondContact CB-O 3.26Å; W26-G29 PolarHBondContact N-O 3.48Å; W26-G29 WeakPolarHBondContact O-CA 3.21Å; W26-G29 PolarHBondContact O-N 2.91Å
30G88.3Confident89.1Confident2 Ų273.9 Ų73.92%0.02137%0.372CS..  trans-86.9134.1175.100000112.4N24 F32 T33 T34 C35N24-G30 WeakPolarHBondContact OD1-CA 3.48Å; G30-F32 VanDerWaalsContact C-N 3.28Å; G30-F32 PolarHBondContact O-N 3.49Å; G30-T33 WeakPolarHBondContact CA-OG1 3.45Å; G30-T33 PolarHBondContact O-N 2.86Å; G30-T33 PolarHBondContact O-OG1 3.31Å; G30-T34 PolarHBondContact O-N 2.88Å; G30-C35 WeakPolarHBondContact O-CB 3.34Å; G30-C35 PolarHBondContact O-N 3.01Å; G30-C35 PolarHBondContact O-SG 2.88Å; G30-C35 VanDerWaalsContact O-SG 3.32Å
31L86.4Confident89.2Confident0 Ų078.8 Ų78.80%039%0.391CS..Iπ-helixtrans-57.8-42.9178.4-16873.2000111.1L21 L36 T43 L46 I47 F50L21-L31 HydrophobicContact CD2-CD2 3.63Å; L31-L36 PolarHBondContact O-N 2.87Å; L31-T43 HydrophobicContact CD1-CG2 4.19Å; L31-T43 HydrophobicContact CG-CG2 4.27Å; L31-T43 WeakPolarHBondContact O-CG2 3.33Å; L31-L46 HydrophobicContact CD1-CD1 4.35Å; L31-I47 HydrophobicContact CD2-CG1 4.01Å; L31-I47 HydrophobicContact CG-CG1 4.24Å; L31-F50 HydrophobicContact CD2-CD2 4.24Å
32F89Confident89.2Confident82 Ų8280.6 Ų80.636%0.3640%0.4SS..Iπ-helixtrans-84.2-6-177.7-61.6-78.2000114.8L21 G30 I47 F51L21-F32 HydrophobicContact CB-CE2 4.25Å; L21-F32 WeakPolarHBondContact O-CE2 3.15Å; G30-F32 VanDerWaalsContact C-N 3.28Å; G30-F32 PolarHBondContact O-N 3.49Å; F32-I47 HydrophobicContact CD1-CD1 3.66Å; F32-I47 HydrophobicContact CD1-CG1 4.17Å; F32-I47 HydrophobicContact CE1-CB 4.48Å; F32-I47 HydrophobicContact CE1-CD1 3.74Å; F32-I47 HydrophobicContact CE1-CG1 3.75Å; F32-I47 HydrophobicContact CE1-CG2 3.91Å; F32-I47 HydrophobicContact CZ-CG1 4.39Å; F32-F51 AromaticContact CE1-CE2 3.83Å; F32-F51 HydrophobicContact CE1-CE2 3.83Å; F32-F51 HydrophobicContact CE1-CZ 4.5Å; F32-F51 AromaticContact CZ-CE2 3.81Å; F32-F51 HydrophobicContact CZ-CE2 3.81Å; F32-F51 HydrophobicContact CZ-CZ 4.33Å
33T90.4Very high89.3Confident82 Ų8275 Ų7550%0.50337%0.371SS..Iπ-helixtrans-120.9-90.5-173.454.20000110.5G30 L36 R37G30-T33 WeakPolarHBondContact CA-OG1 3.45Å; G30-T33 PolarHBondContact O-N 2.86Å; G30-T33 PolarHBondContact O-OG1 3.31Å; T33-L36 PolarHBondContact O-N 2.88Å; T33-R37 PolarHBondContact O-N 2.93Å
34T88.9Confident89.4Confident69 Ų6976 Ų7642%0.42338%0.377SS..Iπ-helixtrans-68.5-39-172.3-49.50000111.9C28 G30 R37 N38C28-T34 WeakPolarHBondContact O-CB 3.33Å; C28-T34 WeakPolarHBondContact O-CG2 3.28Å; G30-T34 PolarHBondContact O-N 2.88Å; T34-R37 PolarHBondContact O-N 3.27Å; T34-N38 PolarHBondContact O-N 3.3Å; T34-N38 VanDerWaalsContact O-N 3.15Å
35C87.2Confident89.8Confident0 Ų074.9 Ų74.90%037%0.37CS..Iπ-helixtrans-64.1-46175.1-600000111C28 G30 R37 N38 Y39 T43C28-C35 HydrophobicContact CB-CB 3.99Å; C28-C35 WeakPolarHBondContact CB-SG 3.41Å; C28-C35 WeakPolarHBondContact SG-CB 3.5Å; C28-C35 CovalentContact SG-SG 2.02Å; C28-C35 PolarHBondContact SG-SG 2.94Å; G30-C35 WeakPolarHBondContact O-CB 3.34Å; G30-C35 PolarHBondContact O-N 3.01Å; G30-C35 PolarHBondContact O-SG 2.88Å; G30-C35 VanDerWaalsContact O-SG 3.32Å; C35-R37 VanDerWaalsContact C-N 3.28Å; C35-R37 PolarHBondContact O-N 3.45Å; C35-N38 PolarHBondContact O-N 3.38Å; C35-Y39 PolarHBondContact O-N 2.99Å; C35-T43 HydrophobicContact CB-CG2 4.12Å; C35-T43 PolarHBondContact O-OG1 3.45Å; C35-T43 VanDerWaalsContact O-OG1 3.13Å
36L89.7Confident90.1Very high56 Ų5666.4 Ų66.429%0.29333%0.331SS..Hα-helixtrans-61.4-38.7179.2-176.162.2000111.4L31 T33 Q40 T43 I44 I47L31-L36 PolarHBondContact O-N 2.87Å; T33-L36 PolarHBondContact O-N 2.88Å; L36-Q40 WeakPolarHBondContact O-CA 3.37Å; L36-Q40 WeakPolarHBondContact O-CG 3.21Å; L36-Q40 PolarHBondContact O-N 2.94Å; L36-T43 HydrophobicContact CB-CG2 3.94Å; L36-T43 HydrophobicContact CD1-CG2 4.05Å; L36-I44 HydrophobicContact CD1-CD1 4.31Å; L36-I44 HydrophobicContact CD1-CG1 3.61Å; L36-I47 HydrophobicContact CD1-CD1 4.47Å
37R89.6Confident90.5Very high205 Ų20566.1 Ų66.177%0.77433%0.332SS*.Hα-helixtrans-65.8-42.6177.4-173.3175.5-179.2174.50113.1T33 T34 C35T33-R37 PolarHBondContact O-N 2.93Å; T34-R37 PolarHBondContact O-N 3.27Å; C35-R37 VanDerWaalsContact C-N 3.28Å; C35-R37 PolarHBondContact O-N 3.45Å
38N88Confident91.1Very high102 Ų10266.5 Ų66.555%0.54533%0.333SS..Hα-helixtrans-87.7-31-172.4-66.8-9.1000113.3T34 C35T34-N38 PolarHBondContact O-N 3.3Å; T34-N38 VanDerWaalsContact O-N 3.15Å; C35-N38 PolarHBondContact O-N 3.38Å
39Y90.1Very high91.6Very high112 Ų11267 Ų6744%0.43933%0.334SS..SBendtrans-13044.7-174-60.6-78.3000111.8C35 I41 I42 T43 M105C35-Y39 PolarHBondContact O-N 2.99Å; Y39-I41 PolarHBondContact O-N 3.39Å; Y39-I41 VanDerWaalsContact O-N 3.12Å; Y39-I42 PolarHBondContact O-N 3.32Å; Y39-T43 PolarHBondContact O-N 3.3Å; Y39-T43 PolarHBondContact O-OG1 3.41Å; Y39-M105 HydrophobicContact CD2-CE 4.05Å; Y39-M105 HydrophobicContact CG-CE 3.82Å
40Q90.2Very high92Very high125 Ų12566.3 Ų66.358%0.58433%0.325SS*.Hα-helixtrans-36.2-60.3-172.4-74.8-179.3-22.500114.3L36 I42 T43 I44L36-Q40 WeakPolarHBondContact O-CA 3.37Å; L36-Q40 WeakPolarHBondContact O-CG 3.21Å; L36-Q40 PolarHBondContact O-N 2.94Å; Q40-I42 PolarHBondContact O-N 2.84Å; Q40-T43 PolarHBondContact O-N 3.42Å; Q40-I44 WeakPolarHBondContact O-CB 2.96Å; Q40-I44 WeakPolarHBondContact O-CD1 3.34Å; Q40-I44 WeakPolarHBondContact O-CG1 3.45Å; Q40-I44 PolarHBondContact O-N 3.12Å
41I93.9Very high92.4Very high146 Ų14670.9 Ų70.975%0.74934%0.344SS*.Hα-helixtrans-61.8-46.7-174.9-59.7174.5000111.6Y39 L45Y39-I41 PolarHBondContact O-N 3.39Å; Y39-I41 VanDerWaalsContact O-N 3.12Å; I41-L45 PolarHBondContact O-N 2.88Å; I41-L45 VanDerWaalsContact O-N 3.13Å
42I94.1Very high93Very high49 Ų4975 Ų7525%0.25137%0.365SS..Hα-helixtrans-68.2-45.3-177.5-56.6176.5000109.2Y39 Q40 I44 L45 L46 I100 K104 M105Y39-I42 PolarHBondContact O-N 3.32Å; Q40-I42 PolarHBondContact O-N 2.84Å; I42-I44 PolarHBondContact O-N 2.85Å; I42-L45 WeakPolarHBondContact O-CB 3.42Å; I42-L45 PolarHBondContact O-N 2.7Å; I42-L46 HydrophobicContact CG2-CD1 4.29Å; I42-L46 HydrophobicContact CG2-CG 4.36Å; I42-L46 VanDerWaalsContact O-CG 3.29Å; I42-L46 WeakPolarHBondContact O-CG 3.22Å; I42-L46 PolarHBondContact O-N 2.92Å; I42-I100 HydrophobicContact CG2-CG2 4Å; I42-K104 HydrophobicContact CD1-CB 4.11Å; I42-K104 HydrophobicContact CD1-CD 4.48Å; I42-K104 HydrophobicContact CD1-CG 4.2Å; I42-K104 HydrophobicContact CG2-CB 4.37Å; I42-M105 HydrophobicContact CB-CE 4Å; I42-M105 HydrophobicContact CG2-CE 3.71Å
43T93.8Very high93.4Very high0 Ų071 Ų710%035%0.348CS..Hα-helixtrans-65.9-39.1-179-58.10000112.4L31 C35 L36 Y39 Q40 L45 L46 I47L31-T43 HydrophobicContact CD1-CG2 4.19Å; L31-T43 HydrophobicContact CG-CG2 4.27Å; L31-T43 WeakPolarHBondContact O-CG2 3.33Å; C35-T43 HydrophobicContact CB-CG2 4.12Å; C35-T43 PolarHBondContact O-OG1 3.45Å; C35-T43 VanDerWaalsContact O-OG1 3.13Å; L36-T43 HydrophobicContact CB-CG2 3.94Å; L36-T43 HydrophobicContact CD1-CG2 4.05Å; Y39-T43 PolarHBondContact O-N 3.3Å; Y39-T43 PolarHBondContact O-OG1 3.41Å; Q40-T43 PolarHBondContact O-N 3.42Å; T43-L45 VanDerWaalsContact C-N 3.32Å; T43-L45 PolarHBondContact O-N 3.35Å; T43-L46 WeakPolarHBondContact O-CB 3.48Å; T43-L46 PolarHBondContact O-N 3.39Å; T43-I47 HydrophobicContact CG2-CD1 3.87Å; T43-I47 HydrophobicContact CG2-CG1 4.34Å; T43-I47 WeakPolarHBondContact O-CB 3.18Å; T43-I47 VanDerWaalsContact O-CG1 3.23Å; T43-I47 WeakPolarHBondContact O-CG1 3.39Å; T43-I47 PolarHBondContact O-N 3.16Å
44I95Very high93.7Very high100 Ų10068 Ų6851%0.51333%0.329SS..Hα-helixtrans-60.2-44.5173.1-70.5165.5000110.4L36 Q40 I42 L46 I47 L48L36-I44 HydrophobicContact CD1-CD1 4.31Å; L36-I44 HydrophobicContact CD1-CG1 3.61Å; Q40-I44 WeakPolarHBondContact O-CB 2.96Å; Q40-I44 WeakPolarHBondContact O-CD1 3.34Å; Q40-I44 WeakPolarHBondContact O-CG1 3.45Å; Q40-I44 PolarHBondContact O-N 3.12Å; I42-I44 PolarHBondContact O-N 2.85Å; I44-L46 PolarHBondContact O-N 2.87Å; I44-I47 PolarHBondContact O-N 3.04Å; I44-L48 WeakPolarHBondContact O-CB 3.45Å; I44-L48 PolarHBondContact O-N 3.4Å
45L96.2Very high94.2Very high77 Ų7769.1 Ų69.140%0.40333%0.331SS..Hα-helixtrans-61.7-43.5176.3179.362.8000111.7I41 I42 T43 L48 L49 I100I41-L45 PolarHBondContact O-N 2.88Å; I41-L45 VanDerWaalsContact O-N 3.13Å; I42-L45 WeakPolarHBondContact O-CB 3.42Å; I42-L45 PolarHBondContact O-N 2.7Å; T43-L45 VanDerWaalsContact C-N 3.32Å; T43-L45 PolarHBondContact O-N 3.35Å; L45-L48 PolarHBondContact O-N 3.24Å; L45-L49 HydrophobicContact CD1-CD1 4.23Å; L45-L49 HydrophobicContact CD1-CG 4.34Å; L45-L49 HydrophobicContact CG-CD1 4.12Å; L45-L49 WeakPolarHBondContact O-CG 3.29Å; L45-L49 PolarHBondContact O-N 3.22Å; L45-I100 HydrophobicContact CD2-CD1 4.14Å
46L95.4Very high94.7Very high0 Ų070.9 Ų70.90%034%0.341CS..Hα-helixtrans-60-48.7176-69.6178.1000111.5L31 I42 T43 I44 L48 L49 F50 A97 I100 Y101 M105L31-L46 HydrophobicContact CD1-CD1 4.35Å; I42-L46 HydrophobicContact CG2-CD1 4.29Å; I42-L46 HydrophobicContact CG2-CG 4.36Å; I42-L46 VanDerWaalsContact O-CG 3.29Å; I42-L46 WeakPolarHBondContact O-CG 3.22Å; I42-L46 PolarHBondContact O-N 2.92Å; T43-L46 WeakPolarHBondContact O-CB 3.48Å; T43-L46 PolarHBondContact O-N 3.39Å; I44-L46 PolarHBondContact O-N 2.87Å; L46-L48 VanDerWaalsContact C-N 3.33Å; L46-L48 PolarHBondContact O-N 2.94Å; L46-L49 PolarHBondContact O-N 2.96Å; L46-F50 HydrophobicContact CB-CD2 4.44Å; L46-F50 WeakPolarHBondContact O-CB 3.32Å; L46-F50 WeakPolarHBondContact O-CD2 3.31Å; L46-F50 PolarHBondContact O-N 3.36Å; L46-A97 HydrophobicContact CD2-CB 4.22Å; L46-A97 WeakPolarHBondContact CD2-O 3.39Å; L46-I100 HydrophobicContact CD2-CB 3.89Å; L46-I100 HydrophobicContact CD2-CG2 3.84Å; L46-Y101 HydrophobicContact CD1-CD2 3.98Å; L46-Y101 HydrophobicContact CD1-CG 4.45Å; L46-M105 HydrophobicContact CD1-CE 4.18Å; L46-M105 HydrophobicContact CD1-SD 4.36Å
47I95.5Very high95Very high31 Ų3168.9 Ų68.916%0.15933%0.33CS..Hα-helixtrans-57.3-49.6177.6-72.1168.1000109.5L31 F32 L36 T43 I44 L49 F50 F51L31-I47 HydrophobicContact CD2-CG1 4.01Å; L31-I47 HydrophobicContact CG-CG1 4.24Å; F32-I47 HydrophobicContact CD1-CD1 3.66Å; F32-I47 HydrophobicContact CD1-CG1 4.17Å; F32-I47 HydrophobicContact CE1-CB 4.48Å; F32-I47 HydrophobicContact CE1-CD1 3.74Å; F32-I47 HydrophobicContact CE1-CG1 3.75Å; F32-I47 HydrophobicContact CE1-CG2 3.91Å; F32-I47 HydrophobicContact CZ-CG1 4.39Å; L36-I47 HydrophobicContact CD1-CD1 4.47Å; T43-I47 HydrophobicContact CG2-CD1 3.87Å; T43-I47 HydrophobicContact CG2-CG1 4.34Å; T43-I47 WeakPolarHBondContact O-CB 3.18Å; T43-I47 VanDerWaalsContact O-CG1 3.23Å; T43-I47 WeakPolarHBondContact O-CG1 3.39Å; T43-I47 PolarHBondContact O-N 3.16Å; I44-I47 PolarHBondContact O-N 3.04Å; I47-L49 PolarHBondContact O-N 3.48Å; I47-F50 PolarHBondContact O-N 3.47Å; I47-F51 HydrophobicContact CG2-CD2 3.6Å; I47-F51 HydrophobicContact CG2-CE2 3.78Å; I47-F51 VanDerWaalsContact O-CD2 3.3Å; I47-F51 WeakPolarHBondContact O-CD2 3.48Å; I47-F51 PolarHBondContact O-N 2.88Å
48L96.8Very high95.3Very high114 Ų11461.8 Ų61.860%0.59731%0.31SS*.Hα-helixtrans-57.8-46.7179.7-176.469.3000112.1I44 L45 L46 F51 L52I44-L48 WeakPolarHBondContact O-CB 3.45Å; I44-L48 PolarHBondContact O-N 3.4Å; L45-L48 PolarHBondContact O-N 3.24Å; L46-L48 VanDerWaalsContact C-N 3.33Å; L46-L48 PolarHBondContact O-N 2.94Å; L48-F51 PolarHBondContact O-N 3.21Å; L48-L52 WeakPolarHBondContact O-CB 3.38Å; L48-L52 PolarHBondContact O-N 3.5Å
49L97.7Very high95.7Very high31 Ų3160.4 Ų60.416%0.16230%0.301CS..Hα-helixtrans-65.5-41.6178.3-70.3170.4000111.9L45 L46 I47 G53 S93 A97 I100L45-L49 HydrophobicContact CD1-CD1 4.23Å; L45-L49 HydrophobicContact CD1-CG 4.34Å; L45-L49 HydrophobicContact CG-CD1 4.12Å; L45-L49 WeakPolarHBondContact O-CG 3.29Å; L45-L49 PolarHBondContact O-N 3.22Å; L46-L49 PolarHBondContact O-N 2.96Å; I47-L49 PolarHBondContact O-N 3.48Å; L49-G53 PolarHBondContact O-N 3.45Å; L49-S93 PolarHBondContact O-OG 3.04Å; L49-A97 HydrophobicContact CB-CB 3.75Å; L49-A97 HydrophobicContact CD1-CB 4.34Å; L49-I100 HydrophobicContact CD1-CD1 3.71Å
50F96.7Very high95.9Very high9 Ų955.1 Ų55.14%0.03928%0.281CS..Hα-helixtrans-63-46176.2-82.6-59.5000112.2I17 L21 W26 L31 L46 I47 G53 L54 I94 A97I17-F50 HydrophobicContact CG2-CD1 4.43Å; L21-F50 HydrophobicContact CD1-CB 4.2Å; L21-F50 HydrophobicContact CD2-CB 3.99Å; L21-F50 HydrophobicContact CD2-CD1 4.25Å; L21-F50 HydrophobicContact CD2-CD2 3.78Å; L21-F50 HydrophobicContact CD2-CE2 4.3Å; L21-F50 HydrophobicContact CD2-CG 3.77Å; W26-F50 HydrophobicContact CH2-CE2 4.15Å; W26-F50 HydrophobicContact CH2-CZ 4.01Å; L31-F50 HydrophobicContact CD2-CD2 4.24Å; L46-F50 HydrophobicContact CB-CD2 4.44Å; L46-F50 WeakPolarHBondContact O-CB 3.32Å; L46-F50 WeakPolarHBondContact O-CD2 3.31Å; L46-F50 PolarHBondContact O-N 3.36Å; I47-F50 PolarHBondContact O-N 3.47Å; F50-G53 PolarHBondContact O-N 2.92Å; F50-L54 WeakPolarHBondContact O-CB 3.34Å; F50-L54 WeakPolarHBondContact O-CG 3.29Å; F50-L54 PolarHBondContact O-N 2.71Å; F50-I94 HydrophobicContact CD1-CD1 3.75Å; F50-I94 HydrophobicContact CD1-CG2 4.47Å; F50-I94 HydrophobicContact CE1-CD1 4.47Å; F50-I94 HydrophobicContact CE1-CG2 4.19Å; F50-A97 HydrophobicContact CD1-CB 4.05Å; F50-A97 HydrophobicContact CD2-CB 3.87Å; F50-A97 HydrophobicContact CE1-CB 3.9Å; F50-A97 HydrophobicContact CE2-CB 3.71Å; F50-A97 HydrophobicContact CG-CB 4.02Å; F50-A97 HydrophobicContact CZ-CB 3.72Å
51F96.9Very high96.1Very high98 Ų9851.2 Ų51.243%0.4326%0.262SS..Hα-helixtrans-66.8-45.4178.3-88.1-80.6000112.3F32 I47 L48 G53 L54 I55F32-F51 AromaticContact CE1-CE2 3.83Å; F32-F51 HydrophobicContact CE1-CE2 3.83Å; F32-F51 HydrophobicContact CE1-CZ 4.5Å; F32-F51 AromaticContact CZ-CE2 3.81Å; F32-F51 HydrophobicContact CZ-CE2 3.81Å; F32-F51 HydrophobicContact CZ-CZ 4.33Å; I47-F51 HydrophobicContact CG2-CD2 3.6Å; I47-F51 HydrophobicContact CG2-CE2 3.78Å; I47-F51 VanDerWaalsContact O-CD2 3.3Å; I47-F51 WeakPolarHBondContact O-CD2 3.48Å; I47-F51 PolarHBondContact O-N 2.88Å; L48-F51 PolarHBondContact O-N 3.21Å; F51-G53 VanDerWaalsContact C-N 3.32Å; F51-G53 PolarHBondContact O-N 3.47Å; F51-L54 PolarHBondContact O-N 2.88Å; F51-I55 WeakPolarHBondContact O-CB 3.27Å; F51-I55 VanDerWaalsContact O-CG1 3.26Å; F51-I55 WeakPolarHBondContact O-CG1 3.43Å; F51-I55 PolarHBondContact O-N 3.41Å
52L97.8Very high96.1Very high86 Ų8648.6 Ų48.645%0.4525%0.249SC..Hα-helixtrans-59.4-46.6176.4-178.963.4000110.7L48 I55 L56L48-L52 WeakPolarHBondContact O-CB 3.38Å; L48-L52 PolarHBondContact O-N 3.5Å; L52-I55 PolarHBondContact O-N 3.25Å; L52-L56 HydrophobicContact CD1-CD1 4.21Å; L52-L56 HydrophobicContact CD1-CG 4.41Å; L52-L56 HydrophobicContact CG-CD1 4.1Å; L52-L56 WeakPolarHBondContact O-CB 3.32Å; L52-L56 VanDerWaalsContact O-CG 3.28Å; L52-L56 WeakPolarHBondContact O-CG 3.33Å; L52-L56 PolarHBondContact O-N 2.92Å
53G97.8Very high96Very high0 Ų048 Ų480%025%0.246CC..Hα-helixtrans-58.5-48175.700000112.9L49 F50 F51 I55 L56 L57L49-G53 PolarHBondContact O-N 3.45Å; F50-G53 PolarHBondContact O-N 2.92Å; F51-G53 VanDerWaalsContact C-N 3.32Å; F51-G53 PolarHBondContact O-N 3.47Å; G53-I55 PolarHBondContact O-N 3.12Å; G53-L56 PolarHBondContact O-N 2.9Å; G53-L57 WeakPolarHBondContact O-CB 3.26Å; G53-L57 VanDerWaalsContact O-CG 3.26Å; G53-L57 WeakPolarHBondContact O-CG 3.39Å; G53-L57 PolarHBondContact O-N 3.44Å
54L97.5Very high95.8Very high17 Ų1748.2 Ų48.29%0.08925%0.247CC..Hα-helixtrans-61.8-43.8178.2-82.8175000112.7I14 I17 I18 L21 F50 F51 L57 T58I14-L54 HydrophobicContact CG2-CD2 4.2Å; I17-L54 HydrophobicContact CB-CD2 3.95Å; I17-L54 HydrophobicContact CG2-CD1 4.1Å; I17-L54 HydrophobicContact CG2-CD2 3.62Å; I17-L54 HydrophobicContact CG2-CG 3.89Å; I18-L54 HydrophobicContact CG1-CD1 4.14Å; I18-L54 HydrophobicContact CG1-CD2 4.13Å; L21-L54 HydrophobicContact CD1-CD1 3.54Å; F50-L54 WeakPolarHBondContact O-CB 3.34Å; F50-L54 WeakPolarHBondContact O-CG 3.29Å; F50-L54 PolarHBondContact O-N 2.71Å; F51-L54 PolarHBondContact O-N 2.88Å; L54-L57 PolarHBondContact O-N 2.88Å; L54-T58 WeakPolarHBondContact O-CB 3.31Å; L54-T58 PolarHBondContact O-N 3.36Å; L54-T58 PolarHBondContact O-OG1 2.91Å
55I98Very high95.5Very high94 Ų9447 Ų4748%0.48224%0.241SC..Hα-helixtrans-60.9-49.8177.2-70.1164.8000109.6F51 L52 G53 L57 T58 I59F51-I55 WeakPolarHBondContact O-CB 3.27Å; F51-I55 VanDerWaalsContact O-CG1 3.26Å; F51-I55 WeakPolarHBondContact O-CG1 3.43Å; F51-I55 PolarHBondContact O-N 3.41Å; L52-I55 PolarHBondContact O-N 3.25Å; G53-I55 PolarHBondContact O-N 3.12Å; I55-L57 PolarHBondContact O-N 2.88Å; I55-T58 PolarHBondContact O-N 3.48Å; I55-I59 HydrophobicContact CG2-CD1 3.86Å; I55-I59 HydrophobicContact CG2-CG1 4.46Å; I55-I59 WeakPolarHBondContact O-CG1 3.41Å; I55-I59 PolarHBondContact O-N 3.24Å
56L98Very high95.2Very high37 Ų3746 Ų4619%0.19424%0.238CC..Hα-helixtrans-62.7-42.8179.8-68.2173.2000112.3L52 G53 T58 I59 A60 I86 C89L52-L56 HydrophobicContact CD1-CD1 4.21Å; L52-L56 HydrophobicContact CD1-CG 4.41Å; L52-L56 HydrophobicContact CG-CD1 4.1Å; L52-L56 WeakPolarHBondContact O-CB 3.32Å; L52-L56 VanDerWaalsContact O-CG 3.28Å; L52-L56 WeakPolarHBondContact O-CG 3.33Å; L52-L56 PolarHBondContact O-N 2.92Å; G53-L56 PolarHBondContact O-N 2.9Å; L56-T58 VanDerWaalsContact C-N 3.3Å; L56-T58 PolarHBondContact O-N 3.12Å; L56-I59 PolarHBondContact O-N 3.41Å; L56-A60 WeakPolarHBondContact O-CB 3.35Å; L56-A60 PolarHBondContact O-N 3.02Å; L56-I86 HydrophobicContact CB-CG2 4.16Å; L56-I86 HydrophobicContact CD2-CG2 4.07Å; L56-I86 VanDerWaalsContact O-CG2 3.27Å; L56-I86 WeakPolarHBondContact O-CG2 3.42Å; L56-C89 HydrophobicContact CD1-CB 3.88Å
57L96.6Very high94.8Very high14 Ų1446.2 Ų46.27%0.07324%0.239CC..Hα-helixtrans-63.5-36.5176-72.2175.2000112.3Q10 I14 I17 G53 L54 I55 A60 F61 L87 I94Q10-L57 PolarHBondContact NE2-O 3.08Å; I14-L57 HydrophobicContact CD1-CB 4.39Å; I14-L57 HydrophobicContact CG1-CB 4.2Å; I17-L57 HydrophobicContact CD1-CD1 4.11Å; G53-L57 WeakPolarHBondContact O-CB 3.26Å; G53-L57 VanDerWaalsContact O-CG 3.26Å; G53-L57 WeakPolarHBondContact O-CG 3.39Å; G53-L57 PolarHBondContact O-N 3.44Å; L54-L57 PolarHBondContact O-N 2.88Å; I55-L57 PolarHBondContact O-N 2.88Å; L57-A60 PolarHBondContact O-N 3.27Å; L57-F61 WeakPolarHBondContact O-CB 3.47Å; L57-F61 PolarHBondContact O-N 3.33Å; L57-L87 HydrophobicContact CD2-CD1 4.17Å; L57-I94 HydrophobicContact CD1-CG1 4.08Å
58T96.5Very high94.2Very high56 Ų5649.1 Ų49.134%0.34425%0.254SS..Hα-helixtrans-68.7-43.6176-55.90000110.9L54 I55 L56 A60 F61 I62L54-T58 WeakPolarHBondContact O-CB 3.31Å; L54-T58 PolarHBondContact O-N 3.36Å; L54-T58 PolarHBondContact O-OG1 2.91Å; I55-T58 PolarHBondContact O-N 3.48Å; L56-T58 VanDerWaalsContact C-N 3.3Å; L56-T58 PolarHBondContact O-N 3.12Å; T58-A60 VanDerWaalsContact C-N 3.35Å; T58-A60 PolarHBondContact O-N 3.21Å; T58-F61 WeakPolarHBondContact O-CB 3.3Å; T58-F61 PolarHBondContact O-N 3.31Å; T58-I62 HydrophobicContact CG2-CD1 4.18Å; T58-I62 WeakPolarHBondContact O-CG1 3.31Å; T58-I62 PolarHBondContact O-N 3.34Å
59I96.4Very high93.7Very high72 Ų7249 Ų4937%0.36926%0.262SS..Hα-helixtrans-59.4-47.8173.7-67.3170.2000109.9I55 L56 F61 I62 L63 I86I55-I59 HydrophobicContact CG2-CD1 3.86Å; I55-I59 HydrophobicContact CG2-CG1 4.46Å; I55-I59 WeakPolarHBondContact O-CG1 3.41Å; I55-I59 PolarHBondContact O-N 3.24Å; L56-I59 PolarHBondContact O-N 3.41Å; I59-F61 PolarHBondContact O-N 2.84Å; I59-I62 PolarHBondContact O-N 2.84Å; I59-L63 HydrophobicContact CG2-CD1 4.17Å; I59-L63 HydrophobicContact CG2-CG 4.37Å; I59-L63 WeakPolarHBondContact O-CG 3.29Å; I59-L63 PolarHBondContact O-N 3.37Å; I59-I86 HydrophobicContact CB-CG2 4.36Å; I59-I86 HydrophobicContact CG2-CD1 4.27Å; I59-I86 HydrophobicContact CG2-CG2 4.26Å
60A94.2Very high93.1Very high1 Ų149.7 Ų49.71%0.00827%0.269CS..Hα-helixtrans-59.1-37.217700000112.3L56 L57 T58 L63 E64 I86 L87L56-A60 WeakPolarHBondContact O-CB 3.35Å; L56-A60 PolarHBondContact O-N 3.02Å; L57-A60 PolarHBondContact O-N 3.27Å; T58-A60 VanDerWaalsContact C-N 3.35Å; T58-A60 PolarHBondContact O-N 3.21Å; A60-L63 PolarHBondContact O-N 3.47Å; A60-E64 PolarHBondContact O-N 3.43Å; A60-I86 HydrophobicContact CB-CG2 4.12Å; A60-L87 HydrophobicContact CB-CB 4.16Å; A60-L87 HydrophobicContact CB-CD1 3.77Å
61F94Very high92.2Very high43 Ų4356.7 Ų56.719%0.18930%0.302CS..Hα-helixtrans-67.1-43.7176.9177.3-112.6000111.5L7 Q10 P11 I14 L57 T58 I59 L63 E64 L65L7-F61 HydrophobicContact CD2-CE2 4.21Å; Q10-F61 HydrophobicContact CB-CD2 4.29Å; Q10-F61 HydrophobicContact CG-CB 4.19Å; Q10-F61 HydrophobicContact CG-CD2 4.18Å; P11-F61 HydrophobicContact CB-CE2 4.2Å; P11-F61 HydrophobicContact CB-CZ 4.13Å; P11-F61 HydrophobicContact CG-CE2 3.91Å; P11-F61 HydrophobicContact CG-CZ 4.16Å; I14-F61 HydrophobicContact CD1-CB 4.19Å; L57-F61 WeakPolarHBondContact O-CB 3.47Å; L57-F61 PolarHBondContact O-N 3.33Å; T58-F61 WeakPolarHBondContact O-CB 3.3Å; T58-F61 PolarHBondContact O-N 3.31Å; I59-F61 PolarHBondContact O-N 2.84Å; F61-L63 VanDerWaalsContact C-N 3.31Å; F61-L63 PolarHBondContact O-N 3.28Å; F61-E64 WeakPolarHBondContact O-CB 3.34Å; F61-E64 PolarHBondContact O-N 3.43Å; F61-L65 HydrophobicContact CD1-CD1 4.09Å; F61-L65 HydrophobicContact CE1-CD1 3.57Å; F61-L65 HydrophobicContact CE1-CG 4.19Å; F61-L65 HydrophobicContact CE2-CD2 4.4Å; F61-L65 HydrophobicContact CE2-CG 4.37Å; F61-L65 HydrophobicContact CZ-CD1 3.85Å; F61-L65 HydrophobicContact CZ-CD2 4.11Å; F61-L65 HydrophobicContact CZ-CG 4.07Å; F61-L65 WeakPolarHBondContact O-CG 3.34Å; F61-L65 PolarHBondContact O-N 3.41Å
62I93.5Very high91.4Very high91 Ų9156.1 Ų56.147%0.46731%0.31SS..Hα-helixtrans-60.7-43.7174.7-66164.7000110.3T58 I59 E64 L65 V66T58-I62 HydrophobicContact CG2-CD1 4.18Å; T58-I62 WeakPolarHBondContact O-CG1 3.31Å; T58-I62 PolarHBondContact O-N 3.34Å; I59-I62 PolarHBondContact O-N 2.84Å; I62-E64 VanDerWaalsContact C-N 3.28Å; I62-E64 PolarHBondContact O-N 2.85Å; I62-L65 WeakPolarHBondContact O-CB 3.25Å; I62-L65 PolarHBondContact O-N 2.91Å; I62-L65 VanDerWaalsContact O-N 3.17Å; I62-V66 HydrophobicContact CG2-CG2 4.5Å; I62-V66 WeakPolarHBondContact O-CG2 3.45Å; I62-V66 PolarHBondContact O-N 2.94Å
63L91.7Very high90.4Very high37 Ų3754.7 Ų54.719%0.19430%0.302CS..Hα-helixtrans-61.1-36.6176.4-68175.8000112.2I59 A60 F61 T67 Y79 R83 I86I59-L63 HydrophobicContact CG2-CD1 4.17Å; I59-L63 HydrophobicContact CG2-CG 4.37Å; I59-L63 WeakPolarHBondContact O-CG 3.29Å; I59-L63 PolarHBondContact O-N 3.37Å; A60-L63 PolarHBondContact O-N 3.47Å; F61-L63 VanDerWaalsContact C-N 3.31Å; F61-L63 PolarHBondContact O-N 3.28Å; L63-T67 WeakPolarHBondContact O-CG2 3.49Å; L63-T67 PolarHBondContact O-N 3.48Å; L63-Y79 WeakPolarHBondContact CA-OH 3.33Å; L63-Y79 HydrophobicContact CB-CE1 4.42Å; L63-Y79 WeakPolarHBondContact CB-OH 3.27Å; L63-Y79 HydrophobicContact CD2-CE2 3.89Å; L63-Y79 VanDerWaalsContact CD2-OH 3.27Å; L63-Y79 WeakPolarHBondContact CD2-OH 3.45Å; L63-Y79 PolarHBondContact O-OH 3.48Å; L63-R83 HydrophobicContact CB-CG 4.08Å; L63-R83 HydrophobicContact CD1-CB 4.33Å; L63-R83 HydrophobicContact CD1-CG 4.35Å; L63-I86 HydrophobicContact CD1-CD1 3.85Å
64E89.2Confident89.2Confident4 Ų457.2 Ų57.22%0.01932%0.316CS..Hα-helixtrans-64.1-47.4173.2-166.679.2-151.900110.7L7 A60 F61 I62 V66 T67 I68 R83L7-E64 HydrophobicContact CD2-CB 4.38Å; L7-E64 HydrophobicContact CD2-CG 3.75Å; L7-E64 HydrophobicContact CG-CG 4.04Å; A60-E64 PolarHBondContact O-N 3.43Å; F61-E64 WeakPolarHBondContact O-CB 3.34Å; F61-E64 PolarHBondContact O-N 3.43Å; I62-E64 VanDerWaalsContact C-N 3.28Å; I62-E64 PolarHBondContact O-N 2.85Å; E64-V66 VanDerWaalsContact C-N 3.3Å; E64-V66 PolarHBondContact O-N 3.19Å; E64-T67 PolarHBondContact O-N 2.95Å; E64-T67 VanDerWaalsContact O-N 3.1Å; E64-T67 PolarHBondContact O-OG1 2.93Å; E64-I68 PolarHBondContact O-N 3.32Å; E64-R83 IonicContact OE1-CZ 3.01Å; E64-R83 IonicContact OE1-NH2 2.65Å; E64-R83 PolarHBondContact OE1-NH2 3.36Å; E64-R83 IonicContact OE2-CZ 3.96Å; E64-R83 IonicContact OE2-NE 2.82Å; E64-R83 PolarHBondContact OE2-NE 3.4Å; E64-R83 IonicContact OE2-NH1 3.31Å; E64-R83 IonicContact OE2-NH2 2.95Å; E64-R83 PolarHBondContact OE2-NH2 3.45Å
65L89.5Confident88.3Confident74 Ų7463.4 Ų63.439%0.38735%0.348SS..Hα-helixtrans-58-42.2177.5-69177000112.2L7 F61 I62 T67 I68 C69L7-L65 HydrophobicContact CD2-CD2 3.79Å; F61-L65 HydrophobicContact CD1-CD1 4.09Å; F61-L65 HydrophobicContact CE1-CD1 3.57Å; F61-L65 HydrophobicContact CE1-CG 4.19Å; F61-L65 HydrophobicContact CE2-CD2 4.4Å; F61-L65 HydrophobicContact CE2-CG 4.37Å; F61-L65 HydrophobicContact CZ-CD1 3.85Å; F61-L65 HydrophobicContact CZ-CD2 4.11Å; F61-L65 HydrophobicContact CZ-CG 4.07Å; F61-L65 WeakPolarHBondContact O-CG 3.34Å; F61-L65 PolarHBondContact O-N 3.41Å; I62-L65 WeakPolarHBondContact O-CB 3.25Å; I62-L65 PolarHBondContact O-N 2.91Å; I62-L65 VanDerWaalsContact O-N 3.17Å; L65-T67 VanDerWaalsContact C-N 3.3Å; L65-T67 PolarHBondContact O-N 2.9Å; L65-I68 HydrophobicContact CD2-CD1 4.03Å; L65-I68 WeakPolarHBondContact O-CB 3.44Å; L65-I68 PolarHBondContact O-N 3.48Å; L65-I68 VanDerWaalsContact O-N 3.13Å; L65-C69 PolarHBondContact O-N 2.95Å
66V90.1Very high87.8Confident58 Ų5862.6 Ų62.635%0.35235%0.345SS..Hα-helixtrans-60.6-39.4177172.10000111.5I62 E64 I68 C69 S70 L73I62-V66 HydrophobicContact CG2-CG2 4.5Å; I62-V66 WeakPolarHBondContact O-CG2 3.45Å; I62-V66 PolarHBondContact O-N 2.94Å; E64-V66 VanDerWaalsContact C-N 3.3Å; E64-V66 PolarHBondContact O-N 3.19Å; V66-I68 PolarHBondContact O-N 3.18Å; V66-C69 PolarHBondContact O-N 3.3Å; V66-C69 VanDerWaalsContact O-N 3.13Å; V66-S70 PolarHBondContact O-N 3.43Å; V66-L73 HydrophobicContact CG1-CD2 4.36Å
67T86.2Confident87.4Confident3 Ų365.2 Ų65.22%0.01836%0.364CS..Hα-helixtrans-68.9-19.6177.957.50000114.3L63 E64 L65 L73 Y79L63-T67 WeakPolarHBondContact O-CG2 3.49Å; L63-T67 PolarHBondContact O-N 3.48Å; E64-T67 PolarHBondContact O-N 2.95Å; E64-T67 VanDerWaalsContact O-N 3.1Å; E64-T67 PolarHBondContact O-OG1 2.93Å; L65-T67 VanDerWaalsContact C-N 3.3Å; L65-T67 PolarHBondContact O-N 2.9Å; T67-L73 HydrophobicContact CG2-CB 4.48Å; T67-Y79 HydrophobicContact CG2-CD1 3.85Å; T67-Y79 HydrophobicContact CG2-CE1 3.18Å
68I83.6Confident87Confident92 Ų9268.6 Ų68.647%0.47239%0.386SS..Hα-helixtrans-70.9-40.8171.6-56168.9000109.8L7 E64 L65 V66L7-I68 HydrophobicContact CD1-CD1 3.29Å; L7-I68 HydrophobicContact CD1-CG1 3.99Å; L7-I68 HydrophobicContact CD2-CD1 3.64Å; L7-I68 HydrophobicContact CG-CD1 4.07Å; E64-I68 PolarHBondContact O-N 3.32Å; L65-I68 HydrophobicContact CD2-CD1 4.03Å; L65-I68 WeakPolarHBondContact O-CB 3.44Å; L65-I68 PolarHBondContact O-N 3.48Å; L65-I68 VanDerWaalsContact O-N 3.13Å; V66-I68 PolarHBondContact O-N 3.18Å
69C85.2Confident86.7Confident112 Ų11267.6 Ų67.676%0.75738%0.376SS*.Hα-helixtrans-79.2-19.8-178.9-61.60000113L65 V66L65-C69 PolarHBondContact O-N 2.95Å; V66-C69 PolarHBondContact O-N 3.3Å; V66-C69 VanDerWaalsContact O-N 3.13Å
70S85.9Confident86.3Confident45 Ų4569.3 Ų69.332%0.31538%0.381SS..  trans-140.986-173.8-62.80000111.1V66 S72 L73V66-S70 PolarHBondContact O-N 3.43Å; S70-S72 PolarHBondContact O-N 3.05Å; S70-S72 VanDerWaalsContact O-N 3.15Å; S70-L73 PolarHBondContact O-N 3.04Å
71E77Confident86.2Confident156 Ų15672.7 Ų72.773%0.72940%0.401SS*.Hα-helixtrans-59.7-25.3179.7-165.1167.9-161.100112.6L73 D74E71-L73 VanDerWaalsContact C-N 3.27Å; E71-L73 PolarHBondContact O-N 2.75Å; E71-D74 WeakPolarHBondContact O-CB 3.4Å; E71-D74 PolarHBondContact O-N 3.48Å
72S80.9Confident86.1Confident86 Ų8674.8 Ų74.860%0.60141%0.414SS*.Hα-helixtrans-60.7-31.4173.860.70000113.8S70 D74S70-S72 PolarHBondContact O-N 3.05Å; S70-S72 VanDerWaalsContact O-N 3.15Å; S72-D74 VanDerWaalsContact C-N 3.31Å
73L77Confident86Confident56 Ų5671.9 Ų71.929%0.29340%0.397SS..Hα-helixtrans-73.5-26.8175.9-80.595.8000112V66 T67 S70 E71 L75 N76 Y79V66-L73 HydrophobicContact CG1-CD2 4.36Å; T67-L73 HydrophobicContact CG2-CB 4.48Å; S70-L73 PolarHBondContact O-N 3.04Å; E71-L73 VanDerWaalsContact C-N 3.27Å; E71-L73 PolarHBondContact O-N 2.75Å; L73-L75 VanDerWaalsContact C-N 3.27Å; L73-L75 PolarHBondContact O-N 2.9Å; L73-N76 WeakPolarHBondContact O-CB 3.35Å; L73-N76 PolarHBondContact O-N 2.88Å; L73-N76 VanDerWaalsContact O-N 3.14Å; L73-Y79 HydrophobicContact CD2-CD2 3.72Å; L73-Y79 HydrophobicContact CD2-CE2 3.53Å; L73-Y79 HydrophobicContact CD2-CG 4.41Å
74D73.2Confident86Confident54 Ų5475 Ų7529%0.28941%0.409SS..Hα-helixtrans-71.7-26.6-179.3-154.657.8000112.2K3 E71 S72 N76K3-D74 WeakPolarHBondContact CE-OD2 2.94Å; K3-D74 IonicContact NZ-OD1 3.95Å; K3-D74 PolarHBondContact NZ-OD1 3.4Å; K3-D74 IonicContact NZ-OD2 2.68Å; K3-D74 PolarHBondContact NZ-OD2 3.32Å; E71-D74 WeakPolarHBondContact O-CB 3.4Å; E71-D74 PolarHBondContact O-N 3.48Å; S72-D74 VanDerWaalsContact C-N 3.31Å; D74-N76 PolarHBondContact O-N 3.31Å
75L78.7Confident86.4Confident146 Ų14679.1 Ų79.176%0.76443%0.43SS*.THydrogen-bonded Turntrans-74-14.3172.8-65.6167.7000112.8L73 P77L73-L75 VanDerWaalsContact C-N 3.27Å; L73-L75 PolarHBondContact O-N 2.9Å; L75-P77 VanDerWaalsContact O-CD 3.25Å; L75-P77 WeakPolarHBondContact O-CD 3.4Å
76N87.5Confident86.7Confident78 Ų7877.2 Ų77.242%0.41742%0.42SS..  trans-85109.3179.9-169.1-28.4000110.4L73 D74 T78 Y79 F80L73-N76 WeakPolarHBondContact O-CB 3.35Å; L73-N76 PolarHBondContact O-N 2.88Å; L73-N76 VanDerWaalsContact O-N 3.14Å; D74-N76 PolarHBondContact O-N 3.31Å; N76-T78 PolarHBondContact O-N 3.18Å; N76-T78 WeakPolarHBondContact OD1-CB 3.18Å; N76-T78 PolarHBondContact OD1-N 3.49Å; N76-Y79 WeakPolarHBondContact O-CB 3.44Å; N76-Y79 PolarHBondContact O-N 2.99Å; N76-Y79 VanDerWaalsContact O-N 3.12Å; N76-F80 PolarHBondContact O-N 2.95Å
77P87.8Confident87Confident91 Ų9177.1 Ų77.159%0.59142%0.417SS*.Hα-helixtrans-61.3-33.8-17725.6-34.6000112.1L75 Y79 F80 T81L75-P77 VanDerWaalsContact O-CD 3.25Å; L75-P77 WeakPolarHBondContact O-CD 3.4Å; P77-Y79 VanDerWaalsContact C-N 3.33Å; P77-Y79 PolarHBondContact O-N 3.41Å; P77-F80 PolarHBondContact O-N 3.38Å; P77-T81 PolarHBondContact O-N 2.9Å; P77-T81 PolarHBondContact O-OG1 2.94Å
78T89.7Confident87.4Confident85 Ų8580 Ų8052%0.52143%0.432SS..Hα-helixtrans-63.5-40.3178.9-53.60000111.5N76 T81 I82N76-T78 PolarHBondContact O-N 3.18Å; N76-T78 WeakPolarHBondContact OD1-CB 3.18Å; N76-T78 PolarHBondContact OD1-N 3.49Å; T78-T81 PolarHBondContact O-N 3.42Å; T78-I82 HydrophobicContact CG2-CD1 3.87Å; T78-I82 HydrophobicContact CG2-CG1 4.48Å; T78-I82 VanDerWaalsContact O-CG1 3.27Å; T78-I82 WeakPolarHBondContact O-CG1 3.35Å; T78-I82 PolarHBondContact O-N 3.25Å
79Y89.3Confident88.1Confident36 Ų3678.6 Ų78.614%0.14143%0.43CS..Hα-helixtrans-63.7-45.9177.8-174.8-86.7000111.1L63 T67 L73 N76 P77 T81 I82 R83L63-Y79 WeakPolarHBondContact CA-OH 3.33Å; L63-Y79 HydrophobicContact CB-CE1 4.42Å; L63-Y79 WeakPolarHBondContact CB-OH 3.27Å; L63-Y79 HydrophobicContact CD2-CE2 3.89Å; L63-Y79 VanDerWaalsContact CD2-OH 3.27Å; L63-Y79 WeakPolarHBondContact CD2-OH 3.45Å; L63-Y79 PolarHBondContact O-OH 3.48Å; T67-Y79 HydrophobicContact CG2-CD1 3.85Å; T67-Y79 HydrophobicContact CG2-CE1 3.18Å; L73-Y79 HydrophobicContact CD2-CD2 3.72Å; L73-Y79 HydrophobicContact CD2-CE2 3.53Å; L73-Y79 HydrophobicContact CD2-CG 4.41Å; N76-Y79 WeakPolarHBondContact O-CB 3.44Å; N76-Y79 PolarHBondContact O-N 2.99Å; N76-Y79 VanDerWaalsContact O-N 3.12Å; P77-Y79 VanDerWaalsContact C-N 3.33Å; P77-Y79 PolarHBondContact O-N 3.41Å; Y79-T81 PolarHBondContact O-N 2.94Å; Y79-I82 PolarHBondContact O-N 3.4Å; Y79-R83 WeakPolarHBondContact O-CB 3.27Å; Y79-R83 PolarHBondContact O-N 3.42Å
80F87.8Confident88.7Confident107 Ų10773.3 Ų73.347%0.46939%0.394SS..Hα-helixtrans-59.6-45.5176.6-177.1-94.3000111.7N76 P77 R83 F84N76-F80 PolarHBondContact O-N 2.95Å; P77-F80 PolarHBondContact O-N 3.38Å; F80-R83 PolarHBondContact O-N 3.36Å; F80-F84 WeakPolarHBondContact O-CB 3.34Å; F80-F84 PolarHBondContact O-N 3.38Å
81T92.1Very high89.1Confident72 Ų7275 Ų7544%0.44240%0.399SS..Hα-helixtrans-62.2-45.7177.9-51.60000112P77 T78 Y79 R83 F84 I85P77-T81 PolarHBondContact O-N 2.9Å; P77-T81 PolarHBondContact O-OG1 2.94Å; T78-T81 PolarHBondContact O-N 3.42Å; Y79-T81 PolarHBondContact O-N 2.94Å; T81-R83 PolarHBondContact O-N 2.98Å; T81-F84 PolarHBondContact O-N 2.96Å; T81-I85 HydrophobicContact CG2-CD1 3.87Å; T81-I85 HydrophobicContact CG2-CG1 4.44Å; T81-I85 VanDerWaalsContact O-CG1 3.3Å; T81-I85 WeakPolarHBondContact O-CG1 3.45Å; T81-I85 PolarHBondContact O-N 3.28Å
82I92.9Very high90.1Very high87 Ų8772.4 Ų72.445%0.44639%0.39SS..Hα-helixtrans-60.7-47.3178.3-69.9167.1000110.4T78 Y79 F84 I85 I86T78-I82 HydrophobicContact CG2-CD1 3.87Å; T78-I82 HydrophobicContact CG2-CG1 4.48Å; T78-I82 VanDerWaalsContact O-CG1 3.27Å; T78-I82 WeakPolarHBondContact O-CG1 3.35Å; T78-I82 PolarHBondContact O-N 3.25Å; Y79-I82 PolarHBondContact O-N 3.4Å; I82-F84 VanDerWaalsContact C-N 3.3Å; I82-F84 PolarHBondContact O-N 2.98Å; I82-I85 PolarHBondContact O-N 3.26Å; I82-I86 HydrophobicContact CG2-CD1 3.7Å; I82-I86 HydrophobicContact CG2-CG1 4.42Å; I82-I86 VanDerWaalsContact O-CG1 3.3Å; I82-I86 WeakPolarHBondContact O-CG1 3.48Å; I82-I86 PolarHBondContact O-N 2.91Å
83R91.6Very high90.9Very high31 Ų3168.9 Ų68.912%0.11737%0.365CS..Hα-helixtrans-56.5-46.4176.9-172178.5100.2-13813.8111.4L63 E64 Y79 F80 T81 I86 L87L63-R83 HydrophobicContact CB-CG 4.08Å; L63-R83 HydrophobicContact CD1-CB 4.33Å; L63-R83 HydrophobicContact CD1-CG 4.35Å; E64-R83 IonicContact OE1-CZ 3.01Å; E64-R83 IonicContact OE1-NH2 2.65Å; E64-R83 PolarHBondContact OE1-NH2 3.36Å; E64-R83 IonicContact OE2-CZ 3.96Å; E64-R83 IonicContact OE2-NE 2.82Å; E64-R83 PolarHBondContact OE2-NE 3.4Å; E64-R83 IonicContact OE2-NH1 3.31Å; E64-R83 IonicContact OE2-NH2 2.95Å; E64-R83 PolarHBondContact OE2-NH2 3.45Å; Y79-R83 WeakPolarHBondContact O-CB 3.27Å; Y79-R83 PolarHBondContact O-N 3.42Å; F80-R83 PolarHBondContact O-N 3.36Å; T81-R83 PolarHBondContact O-N 2.98Å; R83-I86 PolarHBondContact O-N 2.92Å; R83-L87 WeakPolarHBondContact O-CB 3.44Å; R83-L87 PolarHBondContact O-N 3.44Å
84F91.9Very high91.9Very high103 Ų10367.2 Ų67.245%0.45236%0.356SS..Hα-helixtrans-64.1-43.1-179.9-175.6-110.7000112.4F80 T81 I82 L87 L88F80-F84 WeakPolarHBondContact O-CB 3.34Å; F80-F84 PolarHBondContact O-N 3.38Å; T81-F84 PolarHBondContact O-N 2.96Å; I82-F84 VanDerWaalsContact C-N 3.3Å; I82-F84 PolarHBondContact O-N 2.98Å; F84-L87 PolarHBondContact O-N 3.32Å; F84-L88 HydrophobicContact CD1-CD1 3.81Å; F84-L88 HydrophobicContact CD1-CG 4.38Å; F84-L88 HydrophobicContact CE1-CD1 3.27Å; F84-L88 HydrophobicContact CE1-CG 4.04Å; F84-L88 HydrophobicContact CE2-CD1 4.31Å; F84-L88 HydrophobicContact CE2-CG 4.23Å; F84-L88 HydrophobicContact CZ-CD1 3.56Å; F84-L88 HydrophobicContact CZ-CD2 4.25Å; F84-L88 HydrophobicContact CZ-CG 3.95Å; F84-L88 WeakPolarHBondContact O-CB 3.21Å; F84-L88 WeakPolarHBondContact O-CG 3.29Å; F84-L88 PolarHBondContact O-N 3.35Å
85I96.5Very high92.9Very high90 Ų9067.9 Ų67.946%0.46236%0.359SS..Hα-helixtrans-61.3-47.6176.3-69.6167.3000110.6T81 I82 L87 L88 C89T81-I85 HydrophobicContact CG2-CD1 3.87Å; T81-I85 HydrophobicContact CG2-CG1 4.44Å; T81-I85 VanDerWaalsContact O-CG1 3.3Å; T81-I85 WeakPolarHBondContact O-CG1 3.45Å; T81-I85 PolarHBondContact O-N 3.28Å; I82-I85 PolarHBondContact O-N 3.26Å; I85-L87 VanDerWaalsContact C-N 3.32Å; I85-L87 PolarHBondContact O-N 2.96Å; I85-L88 PolarHBondContact O-N 3.37Å; I85-C89 WeakPolarHBondContact O-CB 3.38Å; I85-C89 PolarHBondContact O-N 3.17Å; I85-C89 PolarHBondContact O-SG 2.99Å
86I96.7Very high93.8Very high34 Ų3463.3 Ų63.317%0.17434%0.339CS..Hα-helixtrans-59.4-45.8178.9-68.2168.1000110.5L56 I59 A60 L63 I82 R83 C89 G90L56-I86 HydrophobicContact CB-CG2 4.16Å; L56-I86 HydrophobicContact CD2-CG2 4.07Å; L56-I86 VanDerWaalsContact O-CG2 3.27Å; L56-I86 WeakPolarHBondContact O-CG2 3.42Å; I59-I86 HydrophobicContact CB-CG2 4.36Å; I59-I86 HydrophobicContact CG2-CD1 4.27Å; I59-I86 HydrophobicContact CG2-CG2 4.26Å; A60-I86 HydrophobicContact CB-CG2 4.12Å; L63-I86 HydrophobicContact CD1-CD1 3.85Å; I82-I86 HydrophobicContact CG2-CD1 3.7Å; I82-I86 HydrophobicContact CG2-CG1 4.42Å; I82-I86 VanDerWaalsContact O-CG1 3.3Å; I82-I86 WeakPolarHBondContact O-CG1 3.48Å; I82-I86 PolarHBondContact O-N 2.91Å; R83-I86 PolarHBondContact O-N 2.92Å; I86-C89 PolarHBondContact O-N 3.42Å; I86-G90 PolarHBondContact O-N 3.48Å
87L94.8Very high94.2Very high55 Ų5559.6 Ų59.629%0.28832%0.32SS..Hα-helixtrans-59.9-47.2177.8-169.691000111.4L57 A60 R83 F84 I85 G90 L91L57-L87 HydrophobicContact CD2-CD1 4.17Å; A60-L87 HydrophobicContact CB-CB 4.16Å; A60-L87 HydrophobicContact CB-CD1 3.77Å; R83-L87 WeakPolarHBondContact O-CB 3.44Å; R83-L87 PolarHBondContact O-N 3.44Å; F84-L87 PolarHBondContact O-N 3.32Å; I85-L87 VanDerWaalsContact C-N 3.32Å; I85-L87 PolarHBondContact O-N 2.96Å; L87-G90 PolarHBondContact O-N 3.17Å; L87-L91 WeakPolarHBondContact O-CB 3.27Å; L87-L91 PolarHBondContact O-N 2.92Å
88L95.8Very high94.4Very high65 Ų6557.5 Ų57.534%0.3430%0.303SS..Hα-helixtrans-63.5-45.3178.2-78.4-177.8000112F84 I85 G90 L91 L92F84-L88 HydrophobicContact CD1-CD1 3.81Å; F84-L88 HydrophobicContact CD1-CG 4.38Å; F84-L88 HydrophobicContact CE1-CD1 3.27Å; F84-L88 HydrophobicContact CE1-CG 4.04Å; F84-L88 HydrophobicContact CE2-CD1 4.31Å; F84-L88 HydrophobicContact CE2-CG 4.23Å; F84-L88 HydrophobicContact CZ-CD1 3.56Å; F84-L88 HydrophobicContact CZ-CD2 4.25Å; F84-L88 HydrophobicContact CZ-CG 3.95Å; F84-L88 WeakPolarHBondContact O-CB 3.21Å; F84-L88 WeakPolarHBondContact O-CG 3.29Å; F84-L88 PolarHBondContact O-N 3.35Å; I85-L88 PolarHBondContact O-N 3.37Å; L88-G90 VanDerWaalsContact C-N 3.3Å; L88-G90 PolarHBondContact O-N 2.82Å; L88-L91 PolarHBondContact O-N 2.74Å; L88-L92 WeakPolarHBondContact O-CB 3.05Å; L88-L92 VanDerWaalsContact O-CG 3.24Å; L88-L92 WeakPolarHBondContact O-CG 3.46Å; L88-L92 PolarHBondContact O-N 3.25Å
89C97.6Very high94.6Very high62 Ų6256.8 Ų56.842%0.41930%0.295SS..Hα-helixtrans-59.8-43.3176.1-72.30000111.2L56 I85 I86 S93L56-C89 HydrophobicContact CD1-CB 3.88Å; I85-C89 WeakPolarHBondContact O-CB 3.38Å; I85-C89 PolarHBondContact O-N 3.17Å; I85-C89 PolarHBondContact O-SG 2.99Å; I86-C89 PolarHBondContact O-N 3.42Å; C89-S93 WeakPolarHBondContact O-CB 3.25Å; C89-S93 PolarHBondContact O-N 2.82Å
90G97.4Very high94.8Very high0 Ų057.2 Ų57.20%030%0.3CS..Hα-helixtrans-60.3-50175.300000112.3I86 L87 L88 S93 I94I86-G90 PolarHBondContact O-N 3.48Å; L87-G90 PolarHBondContact O-N 3.17Å; L88-G90 VanDerWaalsContact C-N 3.3Å; L88-G90 PolarHBondContact O-N 2.82Å; G90-S93 WeakPolarHBondContact O-CB 3.04Å; G90-S93 PolarHBondContact O-N 3.28Å; G90-I94 WeakPolarHBondContact O-CG1 3.24Å; G90-I94 PolarHBondContact O-N 2.92Å; G90-I94 VanDerWaalsContact O-N 3.12Å
91L96.2Very high95.1Very high81 Ų8152.7 Ų52.742%0.42428%0.279SS..Hα-helixtrans-58.2-50.1177.6177.464.9000112.1L87 L88 S93 I94 I95L87-L91 WeakPolarHBondContact O-CB 3.27Å; L87-L91 PolarHBondContact O-N 2.92Å; L88-L91 PolarHBondContact O-N 2.74Å; L91-S93 PolarHBondContact O-N 3.01Å; L91-I94 PolarHBondContact O-N 3.04Å; L91-I95 HydrophobicContact CD1-CD1 3.8Å; L91-I95 HydrophobicContact CD1-CG1 4.16Å; L91-I95 HydrophobicContact CD2-CD1 4.38Å; L91-I95 HydrophobicContact CG-CD1 3.76Å; L91-I95 HydrophobicContact CG-CG1 4.41Å; L91-I95 WeakPolarHBondContact O-CB 3.37Å; L91-I95 WeakPolarHBondContact O-CG1 3.3Å; L91-I95 PolarHBondContact O-N 3.19Å
92L97.2Very high95Very high102 Ų10249.4 Ų49.453%0.53426%0.259SS..Hα-helixtrans-62.1-34.6-179.9-72174.1000111.7L88 S96L88-L92 WeakPolarHBondContact O-CB 3.05Å; L88-L92 VanDerWaalsContact O-CG 3.24Å; L88-L92 WeakPolarHBondContact O-CG 3.46Å; L88-L92 PolarHBondContact O-N 3.25Å; L92-S96 VanDerWaalsContact O-CB 3.22Å; L92-S96 WeakPolarHBondContact O-CB 3.49Å; L92-S96 PolarHBondContact O-N 2.89Å; L92-S96 PolarHBondContact O-OG 3.44Å
93S97.6Very high94.9Very high11 Ų1150 Ų508%0.07726%0.263CS..Hα-helixtrans-64-48.8175.7-159.70000111.5L49 C89 G90 L91 S96 A97L49-S93 PolarHBondContact O-OG 3.04Å; C89-S93 WeakPolarHBondContact O-CB 3.25Å; C89-S93 PolarHBondContact O-N 2.82Å; G90-S93 WeakPolarHBondContact O-CB 3.04Å; G90-S93 PolarHBondContact O-N 3.28Å; L91-S93 PolarHBondContact O-N 3.01Å; S93-S96 PolarHBondContact O-N 3.2Å; S93-A97 PolarHBondContact O-N 3.37Å
94I96.9Very high94.8Very high21 Ų2155.1 Ų55.111%0.10829%0.286CS..Hα-helixtrans-63.3-44.1176.8-59.7-63.5000111.6I17 F50 L57 G90 L91 S96 A97 I98I17-I94 HydrophobicContact CD1-CD1 4.49Å; I17-I94 HydrophobicContact CD1-CG1 4.39Å; I17-I94 HydrophobicContact CD1-CG2 4.26Å; I17-I94 HydrophobicContact CG2-CD1 4.28Å; F50-I94 HydrophobicContact CD1-CD1 3.75Å; F50-I94 HydrophobicContact CD1-CG2 4.47Å; F50-I94 HydrophobicContact CE1-CD1 4.47Å; F50-I94 HydrophobicContact CE1-CG2 4.19Å; L57-I94 HydrophobicContact CD1-CG1 4.08Å; G90-I94 WeakPolarHBondContact O-CG1 3.24Å; G90-I94 PolarHBondContact O-N 2.92Å; G90-I94 VanDerWaalsContact O-N 3.12Å; L91-I94 PolarHBondContact O-N 3.04Å; I94-S96 VanDerWaalsContact C-N 3.33Å; I94-S96 PolarHBondContact O-N 3.41Å; I94-A97 WeakPolarHBondContact O-CB 3.49Å; I94-A97 PolarHBondContact O-N 3.31Å; I94-I98 PolarHBondContact O-N 3.36Å
95I95.6Very high94.4Very high68 Ų6851.1 Ų51.135%0.34927%0.269SS..Hα-helixtrans-61.6-43.9176.9-71.6176.1000110.4L91 A97 I98 L99L91-I95 HydrophobicContact CD1-CD1 3.8Å; L91-I95 HydrophobicContact CD1-CG1 4.16Å; L91-I95 HydrophobicContact CD2-CD1 4.38Å; L91-I95 HydrophobicContact CG-CD1 3.76Å; L91-I95 HydrophobicContact CG-CG1 4.41Å; L91-I95 WeakPolarHBondContact O-CB 3.37Å; L91-I95 WeakPolarHBondContact O-CG1 3.3Å; L91-I95 PolarHBondContact O-N 3.19Å; I95-A97 VanDerWaalsContact C-N 3.32Å; I95-A97 PolarHBondContact O-N 2.92Å; I95-I98 VanDerWaalsContact O-CG2 3.31Å; I95-I98 WeakPolarHBondContact O-CG2 3.4Å; I95-I98 PolarHBondContact O-N 2.95Å; I95-L99 HydrophobicContact CG2-CD1 3.63Å; I95-L99 HydrophobicContact CG2-CG 4.18Å; I95-L99 VanDerWaalsContact O-CB 3.31Å; I95-L99 WeakPolarHBondContact O-CB 3.22Å; I95-L99 VanDerWaalsContact O-CG 3.25Å; I95-L99 WeakPolarHBondContact O-CG 3.49Å; I95-L99 PolarHBondContact O-N 3.06Å
96S96Very high93.7Very high51 Ų5148.4 Ų48.436%0.35726%0.256SS..Hα-helixtrans-62.3-42.2177.4-61.60000111.1L92 S93 I94 L99 I100L92-S96 VanDerWaalsContact O-CB 3.22Å; L92-S96 WeakPolarHBondContact O-CB 3.49Å; L92-S96 PolarHBondContact O-N 2.89Å; L92-S96 PolarHBondContact O-OG 3.44Å; S93-S96 PolarHBondContact O-N 3.2Å; I94-S96 VanDerWaalsContact C-N 3.33Å; I94-S96 PolarHBondContact O-N 3.41Å; S96-L99 PolarHBondContact O-N 3.44Å; S96-I100 WeakPolarHBondContact O-CB 3.28Å; S96-I100 WeakPolarHBondContact O-CD1 3.38Å; S96-I100 WeakPolarHBondContact O-CG1 3.5Å; S96-I100 PolarHBondContact O-N 3.12Å
97A95.9Very high92.8Very high0 Ų056.4 Ų56.40%028%0.284CS..Hα-helixtrans-58.7-52.7175.800000111.3L46 L49 F50 S93 I94 I95 L99 I100 Y101L46-A97 HydrophobicContact CD2-CB 4.22Å; L46-A97 WeakPolarHBondContact CD2-O 3.39Å; L49-A97 HydrophobicContact CB-CB 3.75Å; L49-A97 HydrophobicContact CD1-CB 4.34Å; F50-A97 HydrophobicContact CD1-CB 4.05Å; F50-A97 HydrophobicContact CD2-CB 3.87Å; F50-A97 HydrophobicContact CE1-CB 3.9Å; F50-A97 HydrophobicContact CE2-CB 3.71Å; F50-A97 HydrophobicContact CG-CB 4.02Å; F50-A97 HydrophobicContact CZ-CB 3.72Å; S93-A97 PolarHBondContact O-N 3.37Å; I94-A97 WeakPolarHBondContact O-CB 3.49Å; I94-A97 PolarHBondContact O-N 3.31Å; I95-A97 VanDerWaalsContact C-N 3.32Å; I95-A97 PolarHBondContact O-N 2.92Å; A97-L99 VanDerWaalsContact C-N 3.33Å; A97-L99 PolarHBondContact O-N 3.32Å; A97-I100 PolarHBondContact O-N 3.32Å; A97-Y101 WeakPolarHBondContact O-CB 3.13Å; A97-Y101 PolarHBondContact O-N 3.46Å
98I94Very high92.4Very high46 Ų4657.2 Ų57.224%0.23629%0.286CS..Hα-helixtrans-66.6-35.5-177.9-161.865.7000112.2W26 I94 I95 Y101 S102 L112W26-I98 HydrophobicContact CZ3-CD1 4.27Å; I94-I98 PolarHBondContact O-N 3.36Å; I95-I98 VanDerWaalsContact O-CG2 3.31Å; I95-I98 WeakPolarHBondContact O-CG2 3.4Å; I95-I98 PolarHBondContact O-N 2.95Å; I98-Y101 HydrophobicContact CD1-CD1 4.14Å; I98-Y101 PolarHBondContact O-N 2.96Å; I98-S102 WeakPolarHBondContact O-CB 3.46Å; I98-S102 PolarHBondContact O-N 3.13Å; I98-S102 PolarHBondContact O-OG 3.27Å; I98-S102 VanDerWaalsContact O-OG 3.12Å; I98-L112 HydrophobicContact CG1-CD1 3.66Å; I98-L112 HydrophobicContact CG2-CD1 4.19Å
99L93.6Very high91.9Very high70 Ų7057.8 Ų57.837%0.36629%0.286SS..Hα-helixtrans-65.3-45.9175.5-75.8173.3000111.9I95 S96 A97 Y101 S102 L103 L112I95-L99 HydrophobicContact CG2-CD1 3.63Å; I95-L99 HydrophobicContact CG2-CG 4.18Å; I95-L99 VanDerWaalsContact O-CB 3.31Å; I95-L99 WeakPolarHBondContact O-CB 3.22Å; I95-L99 VanDerWaalsContact O-CG 3.25Å; I95-L99 WeakPolarHBondContact O-CG 3.49Å; I95-L99 PolarHBondContact O-N 3.06Å; S96-L99 PolarHBondContact O-N 3.44Å; A97-L99 VanDerWaalsContact C-N 3.33Å; A97-L99 PolarHBondContact O-N 3.32Å; L99-Y101 VanDerWaalsContact C-N 3.3Å; L99-Y101 PolarHBondContact O-N 2.96Å; L99-S102 PolarHBondContact O-N 3.46Å; L99-L103 WeakPolarHBondContact O-CB 3Å; L99-L103 WeakPolarHBondContact O-CD1 3.17Å; L99-L103 WeakPolarHBondContact O-CG 3.17Å; L99-L103 PolarHBondContact O-N 3.3Å; L99-L112 HydrophobicContact CD2-CD2 3.9Å
100I93.8Very high91.5Very high46 Ų4659.6 Ų59.624%0.23630%0.299CS..Hα-helixtrans-59.8-44.6175.9-69.8164.2000109.8I42 L45 L46 L49 S96 A97 L103 K104I42-I100 HydrophobicContact CG2-CG2 4Å; L45-I100 HydrophobicContact CD2-CD1 4.14Å; L46-I100 HydrophobicContact CD2-CB 3.89Å; L46-I100 HydrophobicContact CD2-CG2 3.84Å; L49-I100 HydrophobicContact CD1-CD1 3.71Å; S96-I100 WeakPolarHBondContact O-CB 3.28Å; S96-I100 WeakPolarHBondContact O-CD1 3.38Å; S96-I100 WeakPolarHBondContact O-CG1 3.5Å; S96-I100 PolarHBondContact O-N 3.12Å; A97-I100 PolarHBondContact O-N 3.32Å; I100-L103 PolarHBondContact O-N 3.22Å; I100-K104 HydrophobicContact CG2-CG 4.39Å; I100-K104 VanDerWaalsContact O-CB 3.31Å; I100-K104 WeakPolarHBondContact O-CB 3.38Å; I100-K104 WeakPolarHBondContact O-CG 3.42Å; I100-K104 PolarHBondContact O-N 3.13Å
101Y92.4Very high91.1Very high11 Ų1167 Ų674%0.04333%0.327CS..Hα-helixtrans-60.2-49.2176.3173.5-97.4000111.8W26 N27 L46 A97 I98 L99 L103 K104 M105 D106W26-Y101 HydrophobicContact CE3-CD1 4.22Å; W26-Y101 HydrophobicContact CE3-CD2 4.03Å; W26-Y101 AromaticContact CE3-CE1 3.84Å; W26-Y101 HydrophobicContact CE3-CE1 3.84Å; W26-Y101 AromaticContact CE3-CE2 3.63Å; W26-Y101 HydrophobicContact CE3-CE2 3.63Å; W26-Y101 HydrophobicContact CE3-CG 4.31Å; W26-Y101 AromaticContact CE3-CZ 3.53Å; W26-Y101 HydrophobicContact CZ3-CD1 4.05Å; W26-Y101 HydrophobicContact CZ3-CD2 4.25Å; W26-Y101 HydrophobicContact CZ3-CE1 4.06Å; W26-Y101 HydrophobicContact CZ3-CE2 4.28Å; W26-Y101 HydrophobicContact CZ3-CG 4.15Å; N27-Y101 WeakPolarHBondContact CB-OH 3.35Å; N27-Y101 PolarHBondContact N-OH 3.31Å; L46-Y101 HydrophobicContact CD1-CD2 3.98Å; L46-Y101 HydrophobicContact CD1-CG 4.45Å; A97-Y101 WeakPolarHBondContact O-CB 3.13Å; A97-Y101 PolarHBondContact O-N 3.46Å; I98-Y101 HydrophobicContact CD1-CD1 4.14Å; I98-Y101 PolarHBondContact O-N 2.96Å; L99-Y101 VanDerWaalsContact C-N 3.3Å; L99-Y101 PolarHBondContact O-N 2.96Å; Y101-L103 PolarHBondContact O-N 3.34Å; Y101-K104 PolarHBondContact O-N 3.32Å; Y101-M105 HydrophobicContact CD2-CB 3.88Å; Y101-M105 HydrophobicContact CD2-CG 4.12Å; Y101-M105 HydrophobicContact CD2-SD 3.56Å; Y101-M105 VanDerWaalsContact CD2-SD 3.56Å; Y101-M105 HydrophobicContact CE2-CB 3.69Å; Y101-M105 HydrophobicContact CE2-CG 4.24Å; Y101-M105 HydrophobicContact CE2-SD 3.66Å; Y101-M105 WeakPolarHBondContact O-CA 3.31Å; Y101-M105 WeakPolarHBondContact O-CB 3.4Å; Y101-M105 PolarHBondContact O-N 3.39Å; Y101-D106 HydrophobicContact CD1-CB 4.29Å; Y101-D106 HydrophobicContact CE1-CB 3.6Å; Y101-D106 PolarHBondContact O-N 3.01Å
102S91.5Very high90.7Very high3 Ų364.2 Ų64.22%0.02131%0.313CS..Iπ-helixtrans-63.6-38.5179-66.50000112.6I98 L99 R107I98-S102 WeakPolarHBondContact O-CB 3.46Å; I98-S102 PolarHBondContact O-N 3.13Å; I98-S102 PolarHBondContact O-OG 3.27Å; I98-S102 VanDerWaalsContact O-OG 3.12Å; L99-S102 PolarHBondContact O-N 3.46Å; S102-R107 VanDerWaalsContact O-CA 3.29Å; S102-R107 WeakPolarHBondContact O-CA 3.48Å; S102-R107 PolarHBondContact O-N 3.12Å
103L90.4Very high90.5Very high101 Ų10164.8 Ų64.853%0.52932%0.315SS..Iπ-helixtrans-68.6-37.2176.8-76.9160.9000113.1L99 I100 Y101 F109L99-L103 WeakPolarHBondContact O-CB 3Å; L99-L103 WeakPolarHBondContact O-CD1 3.17Å; L99-L103 WeakPolarHBondContact O-CG 3.17Å; L99-L103 PolarHBondContact O-N 3.3Å; I100-L103 PolarHBondContact O-N 3.22Å; Y101-L103 PolarHBondContact O-N 3.34Å; L103-F109 HydrophobicContact CB-CZ 4.33Å; L103-F109 HydrophobicContact CD2-CE1 4.01Å; L103-F109 HydrophobicContact CD2-CE2 4.38Å; L103-F109 HydrophobicContact CD2-CZ 3.4Å; L103-F109 HydrophobicContact CG-CE1 4.08Å; L103-F109 HydrophobicContact CG-CZ 3.69Å
104K89Confident90.4Very high137 Ų13767.8 Ų67.860%0.59634%0.335SS*.Iπ-helixtrans-100.5-25.1-170.6-62.1-63.1-175.3-1800114.6I42 I100 Y101I42-K104 HydrophobicContact CD1-CB 4.11Å; I42-K104 HydrophobicContact CD1-CD 4.48Å; I42-K104 HydrophobicContact CD1-CG 4.2Å; I42-K104 HydrophobicContact CG2-CB 4.37Å; I100-K104 HydrophobicContact CG2-CG 4.39Å; I100-K104 VanDerWaalsContact O-CB 3.31Å; I100-K104 WeakPolarHBondContact O-CB 3.38Å; I100-K104 WeakPolarHBondContact O-CG 3.42Å; I100-K104 PolarHBondContact O-N 3.13Å; Y101-K104 PolarHBondContact O-N 3.32Å
105M83.9Confident90.2Very high20 Ų2070.5 Ų70.510%0.09935%0.353CS..Iπ-helixtrans-127.5-44.6-168.3-59.8-172.3-179.500115N27 Y39 I42 L46 Y101N27-M105 PolarHBondContact ND2-O 2.67Å; Y39-M105 HydrophobicContact CD2-CE 4.05Å; Y39-M105 HydrophobicContact CG-CE 3.82Å; I42-M105 HydrophobicContact CB-CE 4Å; I42-M105 HydrophobicContact CG2-CE 3.71Å; L46-M105 HydrophobicContact CD1-CE 4.18Å; L46-M105 HydrophobicContact CD1-SD 4.36Å; Y101-M105 HydrophobicContact CD2-CB 3.88Å; Y101-M105 HydrophobicContact CD2-CG 4.12Å; Y101-M105 HydrophobicContact CD2-SD 3.56Å; Y101-M105 VanDerWaalsContact CD2-SD 3.56Å; Y101-M105 HydrophobicContact CE2-CB 3.69Å; Y101-M105 HydrophobicContact CE2-CG 4.24Å; Y101-M105 HydrophobicContact CE2-SD 3.66Å; Y101-M105 WeakPolarHBondContact O-CA 3.31Å; Y101-M105 WeakPolarHBondContact O-CB 3.4Å; Y101-M105 PolarHBondContact O-N 3.39Å
106D80.8Confident90.1Very high32 Ų3270.7 Ų70.717%0.17135%0.354CS..Iπ-helixtrans-98.5-33.5-171.4-165.830.2000112.9Y101 Q108Y101-D106 HydrophobicContact CD1-CB 4.29Å; Y101-D106 HydrophobicContact CE1-CB 3.6Å; Y101-D106 PolarHBondContact O-N 3.01Å; D106-Q108 WeakPolarHBondContact O-CG 3.34Å; D106-Q108 PolarHBondContact O-N 3.1Å; D106-Q108 PolarHBondContact OD1-NE2 3.27Å
107R78.4Confident90Very high203 Ų20370.1 Ų70.177%0.76636%0.356SS*.  trans51.97.4-174.8-65.2-173.5178.1176.30.8115.6S102 F109S102-R107 VanDerWaalsContact O-CA 3.29Å; S102-R107 WeakPolarHBondContact O-CA 3.48Å; S102-R107 PolarHBondContact O-N 3.12Å; R107-F109 VanDerWaalsContact C-N 3.31Å; R107-F109 PolarHBondContact O-N 3.39Å; R107-F109 VanDerWaalsContact O-N 3.08Å
108Q85.8Confident90Very high71 Ų7174.5 Ų74.533%0.33238%0.378SS..  trans-86.861.2179.1-62-173.552.800112.4D106 S110 R111 L112D106-Q108 WeakPolarHBondContact O-CG 3.34Å; D106-Q108 PolarHBondContact O-N 3.1Å; D106-Q108 PolarHBondContact OD1-NE2 3.27Å; Q108-S110 PolarHBondContact O-N 3.36Å; Q108-R111 HydrophobicContact CB-CB 4.21Å; Q108-R111 PolarHBondContact O-N 2.84Å; Q108-R111 VanDerWaalsContact O-N 3.12Å; Q108-L112 PolarHBondContact O-N 3.38Å
109F86.8Confident89.9Confident77 Ų7775.6 Ų75.634%0.33839%0.387SS..Hα-helixtrans-56.6-36.5-178.8-74.4-79000113.8L103 R107 R111 L112 I113L103-F109 HydrophobicContact CB-CZ 4.33Å; L103-F109 HydrophobicContact CD2-CE1 4.01Å; L103-F109 HydrophobicContact CD2-CE2 4.38Å; L103-F109 HydrophobicContact CD2-CZ 3.4Å; L103-F109 HydrophobicContact CG-CE1 4.08Å; L103-F109 HydrophobicContact CG-CZ 3.69Å; R107-F109 VanDerWaalsContact C-N 3.31Å; R107-F109 PolarHBondContact O-N 3.39Å; R107-F109 VanDerWaalsContact O-N 3.08Å; F109-R111 VanDerWaalsContact C-N 3.33Å; F109-R111 PolarHBondContact O-N 3.21Å; F109-L112 PolarHBondContact O-N 3.15Å; F109-I113 HydrophobicContact CB-CD1 4.48Å; F109-I113 WeakPolarHBondContact O-CB 3.35Å; F109-I113 VanDerWaalsContact O-CG1 3.29Å; F109-I113 WeakPolarHBondContact O-CG1 3.29Å; F109-I113 PolarHBondContact O-N 3.13Å
110S88.9Confident89.9Confident101 Ų10178.2 Ų78.271%0.70640%0.396SS*.Hα-helixtrans-59.3-43.9178.2-175.10000111.8Q108 I113 C114Q108-S110 PolarHBondContact O-N 3.36Å; S110-I113 PolarHBondContact O-N 3.26Å; S110-C114 WeakPolarHBondContact O-CB 3.34Å; S110-C114 PolarHBondContact O-N 3.41Å
111R87.9Confident90Very high155 Ų15578.6 Ų78.659%0.58541%0.406SS*.Hα-helixtrans-64.6-42.6177.6-169.7-171.5-62.2-155-1.5111.5Q108 F109 T115Q108-R111 HydrophobicContact CB-CB 4.21Å; Q108-R111 PolarHBondContact O-N 2.84Å; Q108-R111 VanDerWaalsContact O-N 3.12Å; F109-R111 VanDerWaalsContact C-N 3.33Å; F109-R111 PolarHBondContact O-N 3.21Å; R111-T115 WeakPolarHBondContact O-CB 3.33Å; R111-T115 PolarHBondContact O-N 2.9Å; R111-T115 PolarHBondContact O-OG1 3.46Å
112L89.4Confident89.9Confident23 Ų2382.2 Ų82.212%0.1243%0.425CS..Hα-helixtrans-61.9-52.4177.5-179.569.7000111.3I98 L99 Q108 F109 C114 T115 I116I98-L112 HydrophobicContact CG1-CD1 3.66Å; I98-L112 HydrophobicContact CG2-CD1 4.19Å; L99-L112 HydrophobicContact CD2-CD2 3.9Å; Q108-L112 PolarHBondContact O-N 3.38Å; F109-L112 PolarHBondContact O-N 3.15Å; L112-C114 VanDerWaalsContact C-N 3.32Å; L112-C114 PolarHBondContact O-N 3.03Å; L112-T115 PolarHBondContact O-N 2.68Å; L112-I116 HydrophobicContact CD1-CD1 4.23Å; L112-I116 HydrophobicContact CD2-CD1 4.49Å; L112-I116 HydrophobicContact CG-CD1 3.93Å; L112-I116 WeakPolarHBondContact O-CG1 3.36Å; L112-I116 PolarHBondContact O-N 3.31Å
113I92.6Very high89.9Confident114 Ų11485.5 Ų85.559%0.58544%0.44SS*.Hα-helixtrans-62.7-41.3-177.9-66.6166.4000110.5F109 S110 I116 G117F109-I113 HydrophobicContact CB-CD1 4.48Å; F109-I113 WeakPolarHBondContact O-CB 3.35Å; F109-I113 VanDerWaalsContact O-CG1 3.29Å; F109-I113 WeakPolarHBondContact O-CG1 3.29Å; F109-I113 PolarHBondContact O-N 3.13Å; S110-I113 PolarHBondContact O-N 3.26Å; I113-I116 PolarHBondContact O-N 3.4Å; I113-G117 PolarHBondContact O-N 2.93Å
114C94.4Very high89.9Confident74 Ų7484.6 Ų84.650%0.544%0.439SS..Hα-helixtrans-60.2-46.4174.7-177.20000111.6S110 L112 I116 G117 I118S110-C114 WeakPolarHBondContact O-CB 3.34Å; S110-C114 PolarHBondContact O-N 3.41Å; L112-C114 VanDerWaalsContact C-N 3.32Å; L112-C114 PolarHBondContact O-N 3.03Å; C114-I116 PolarHBondContact O-N 2.9Å; C114-G117 PolarHBondContact O-N 3.46Å; C114-I118 WeakPolarHBondContact O-CG1 3.34Å; C114-I118 PolarHBondContact O-N 3.05Å
115T92.5Very high90Very high77 Ų7781.2 Ų81.247%0.47243%0.432SS..Hα-helixtrans-61.7-43.1178.4-54.60000111.5R111 L112 I118 V119R111-T115 WeakPolarHBondContact O-CB 3.33Å; R111-T115 PolarHBondContact O-N 2.9Å; R111-T115 PolarHBondContact O-OG1 3.46Å; L112-T115 PolarHBondContact O-N 2.68Å; T115-I118 PolarHBondContact O-N 3.45Å; T115-V119 WeakPolarHBondContact O-CG2 3.44Å; T115-V119 PolarHBondContact O-N 3.41Å
116I93.8Very high90.1Very high72 Ų7283.2 Ų83.237%0.36944%0.443SS..Hα-helixtrans-60.8-46.1175.1-68.6168.6000110.7L112 I113 C114 I118 V119 F120L112-I116 HydrophobicContact CD1-CD1 4.23Å; L112-I116 HydrophobicContact CD2-CD1 4.49Å; L112-I116 HydrophobicContact CG-CD1 3.93Å; L112-I116 WeakPolarHBondContact O-CG1 3.36Å; L112-I116 PolarHBondContact O-N 3.31Å; I113-I116 PolarHBondContact O-N 3.4Å; C114-I116 PolarHBondContact O-N 2.9Å; I116-I118 VanDerWaalsContact C-N 3.32Å; I116-I118 PolarHBondContact O-N 3.25Å; I116-V119 PolarHBondContact O-N 3.31Å; I116-F120 HydrophobicContact CG2-CD2 3.65Å; I116-F120 HydrophobicContact CG2-CE2 3.45Å; I116-F120 VanDerWaalsContact CG2-CE2 3.45Å; I116-F120 VanDerWaalsContact O-CD2 3.28Å; I116-F120 WeakPolarHBondContact O-CD2 3.33Å; I116-F120 PolarHBondContact O-N 2.89Å
117G94.4Very high90.5Very high39 Ų3985.1 Ų85.140%0.40245%0.452SS..Hα-helixtrans-58.7-41.9176.800000112.7I113 C114 F120 A121I113-G117 PolarHBondContact O-N 2.93Å; C114-G117 PolarHBondContact O-N 3.46Å; G117-F120 PolarHBondContact O-N 3.06Å; G117-A121 WeakPolarHBondContact O-CB 3.31Å; G117-A121 PolarHBondContact O-N 3.14Å
118I95.7Very high90.9Very high92 Ų9280.4 Ų80.447%0.47244%0.442SS..Hα-helixtrans-62.5-44.5175.7-68.8165.2000110.9C114 T115 I116 F120 A121 I122C114-I118 WeakPolarHBondContact O-CG1 3.34Å; C114-I118 PolarHBondContact O-N 3.05Å; T115-I118 PolarHBondContact O-N 3.45Å; I116-I118 VanDerWaalsContact C-N 3.32Å; I116-I118 PolarHBondContact O-N 3.25Å; I118-F120 PolarHBondContact O-N 3.46Å; I118-A121 PolarHBondContact O-N 3.26Å; I118-I122 HydrophobicContact CG2-CD1 3.77Å; I118-I122 HydrophobicContact CG2-CG1 4.37Å; I118-I122 VanDerWaalsContact O-CG1 3.29Å; I118-I122 WeakPolarHBondContact O-CG1 3.4Å; I118-I122 PolarHBondContact O-N 3.5Å
119V93.1Very high90.9Very high70 Ų7081.8 Ų81.842%0.42445%0.451SS..Hα-helixtrans-61-45.3178.5172.30000111.1T115 I116 I122 Q123T115-V119 WeakPolarHBondContact O-CG2 3.44Å; T115-V119 PolarHBondContact O-N 3.41Å; I116-V119 PolarHBondContact O-N 3.31Å; V119-I122 PolarHBondContact O-N 3.37Å; V119-Q123 WeakPolarHBondContact O-CG 3.44Å; V119-Q123 PolarHBondContact O-N 2.65Å
120F92.5Very high90.6Very high125 Ų12580.6 Ų80.655%0.54845%0.447SS..Hα-helixtrans-64.1-41.7175.5-77.9-61.7000112.3I116 G117 I118 I122 Q123 V124I116-F120 HydrophobicContact CG2-CD2 3.65Å; I116-F120 HydrophobicContact CG2-CE2 3.45Å; I116-F120 VanDerWaalsContact CG2-CE2 3.45Å; I116-F120 VanDerWaalsContact O-CD2 3.28Å; I116-F120 WeakPolarHBondContact O-CD2 3.33Å; I116-F120 PolarHBondContact O-N 2.89Å; G117-F120 PolarHBondContact O-N 3.06Å; I118-F120 PolarHBondContact O-N 3.46Å; F120-I122 VanDerWaalsContact C-N 3.35Å; F120-I122 PolarHBondContact O-N 3.1Å; F120-Q123 PolarHBondContact O-N 3.01Å; F120-V124 WeakPolarHBondContact O-CG2 3.25Å; F120-V124 PolarHBondContact O-N 3.44Å
121A95.1Very high90.3Very high54 Ų5480.6 Ų80.645%0.44644%0.439SS..Hα-helixtrans-59.4-45.8176.600000111.4G117 I118 Q123 V124 S125G117-A121 WeakPolarHBondContact O-CB 3.31Å; G117-A121 PolarHBondContact O-N 3.14Å; I118-A121 PolarHBondContact O-N 3.26Å; A121-Q123 PolarHBondContact O-N 3.29Å; A121-V124 PolarHBondContact O-N 3.42Å; A121-S125 WeakPolarHBondContact O-CB 3.24Å; A121-S125 PolarHBondContact O-N 2.93Å; A121-S125 PolarHBondContact O-OG 2.84Å; A121-S125 VanDerWaalsContact O-OG 3.04Å
122I91.7Very high90.1Very high86 Ų8675 Ų7544%0.44142%0.423SS..Hα-helixtrans-58.6-47.6176.1-69.4166.5000110.7I118 V119 F120 V124 S125 L126I118-I122 HydrophobicContact CG2-CD1 3.77Å; I118-I122 HydrophobicContact CG2-CG1 4.37Å; I118-I122 VanDerWaalsContact O-CG1 3.29Å; I118-I122 WeakPolarHBondContact O-CG1 3.4Å; I118-I122 PolarHBondContact O-N 3.5Å; V119-I122 PolarHBondContact O-N 3.37Å; F120-I122 VanDerWaalsContact C-N 3.35Å; F120-I122 PolarHBondContact O-N 3.1Å; I122-V124 PolarHBondContact O-N 2.98Å; I122-S125 PolarHBondContact O-N 3.03Å; I122-L126 HydrophobicContact CG2-CD1 3.83Å; I122-L126 HydrophobicContact CG2-CG 4.35Å; I122-L126 WeakPolarHBondContact O-CB 3.49Å; I122-L126 VanDerWaalsContact O-CG 3.29Å; I122-L126 WeakPolarHBondContact O-CG 3.38Å; I122-L126 PolarHBondContact O-N 3.04Å
123Q89.9Confident89.4Confident73 Ų7378.7 Ų78.734%0.34145%0.449SS..Hα-helixtrans-60.6-47.2179.6-71.5173.42.600111.8L9 V119 F120 A121 L126 I127L9-Q123 HydrophobicContact CD1-CG 4.26Å; V119-Q123 WeakPolarHBondContact O-CG 3.44Å; V119-Q123 PolarHBondContact O-N 2.65Å; F120-Q123 PolarHBondContact O-N 3.01Å; A121-Q123 PolarHBondContact O-N 3.29Å; Q123-L126 PolarHBondContact O-N 3.38Å; Q123-I127 WeakPolarHBondContact O-CD1 3.29Å; Q123-I127 VanDerWaalsContact O-CG1 3.24Å; Q123-I127 WeakPolarHBondContact O-CG1 3.28Å; Q123-I127 PolarHBondContact O-N 2.87Å
124V90.8Very high88.5Confident82 Ų8277.7 Ų77.750%0.49745%0.451SS..Hα-helixtrans-63.7-43.2178.6172.30000111.3F120 A121 I122 I127 N128F120-V124 WeakPolarHBondContact O-CG2 3.25Å; F120-V124 PolarHBondContact O-N 3.44Å; A121-V124 PolarHBondContact O-N 3.42Å; I122-V124 PolarHBondContact O-N 2.98Å; V124-I127 PolarHBondContact O-N 3.49Å; V124-N128 WeakPolarHBondContact CG1-ND2 3.42Å; V124-N128 PolarHBondContact O-N 3.49Å; V124-N128 PolarHBondContact O-ND2 3.39Å
125S90.9Very high87.2Confident65 Ų6578 Ų7846%0.45545%0.447SS..Hα-helixtrans-61.7-45.7176.8-66.10000111.8A121 I122 I127 N128 I129A121-S125 WeakPolarHBondContact O-CB 3.24Å; A121-S125 PolarHBondContact O-N 2.93Å; A121-S125 PolarHBondContact O-OG 2.84Å; A121-S125 VanDerWaalsContact O-OG 3.04Å; I122-S125 PolarHBondContact O-N 3.03Å; S125-I127 PolarHBondContact O-N 3.35Å; S125-N128 PolarHBondContact O-N 3.48Å; S125-I129 VanDerWaalsContact O-CG1 3.28Å; S125-I129 WeakPolarHBondContact O-CG1 3.36Å; S125-I129 PolarHBondContact O-N 2.93Å
126L87.2Confident85.8Confident62 Ų6280.4 Ų80.433%0.32545%0.453SS..Hα-helixtrans-64.9-40178.8-71172.7000112.3L5 L9 I122 Q123 I129 I130L5-L126 HydrophobicContact CD1-CB 3.44Å; L5-L126 VanDerWaalsContact CD1-CB 3.44Å; L9-L126 HydrophobicContact CD1-CD1 4.28Å; L9-L126 HydrophobicContact CD2-CD1 3.87Å; L9-L126 HydrophobicContact CG-CD1 4.43Å; I122-L126 HydrophobicContact CG2-CD1 3.83Å; I122-L126 HydrophobicContact CG2-CG 4.35Å; I122-L126 WeakPolarHBondContact O-CB 3.49Å; I122-L126 VanDerWaalsContact O-CG 3.29Å; I122-L126 WeakPolarHBondContact O-CG 3.38Å; I122-L126 PolarHBondContact O-N 3.04Å; Q123-L126 PolarHBondContact O-N 3.38Å; L126-I129 PolarHBondContact O-N 3.41Å; L126-I130 WeakPolarHBondContact O-CG1 3.32Å; L126-I130 PolarHBondContact O-N 3.48Å
127I87.7Confident84.2Confident72 Ų7284.8 Ų84.837%0.36946%0.464SS..Hα-helixtrans-60.4-47.5175.1-70.8165.8000110.6L5 Q123 V124 S125 I129 I130 L131L5-I127 HydrophobicContact CD1-CG1 4.17Å; L5-I127 HydrophobicContact CD2-CG1 4.04Å; Q123-I127 WeakPolarHBondContact O-CD1 3.29Å; Q123-I127 VanDerWaalsContact O-CG1 3.24Å; Q123-I127 WeakPolarHBondContact O-CG1 3.28Å; Q123-I127 PolarHBondContact O-N 2.87Å; V124-I127 PolarHBondContact O-N 3.49Å; S125-I127 PolarHBondContact O-N 3.35Å; I127-I129 PolarHBondContact O-N 3.01Å; I127-I130 PolarHBondContact O-N 3.4Å; I127-L131 HydrophobicContact CG2-CD1 3.59Å; I127-L131 HydrophobicContact CG2-CG 4.36Å; I127-L131 VanDerWaalsContact O-CB 3.32Å; I127-L131 WeakPolarHBondContact O-CB 3.47Å; I127-L131 WeakPolarHBondContact O-CG 3.35Å; I127-L131 PolarHBondContact O-N 2.96Å
128N87.5Confident82.5Confident104 Ų10487.9 Ų87.956%0.55647%0.472SS*.Hα-helixtrans-64.8-38.1179.4-80.4-68.7000112.8V124 S125 S132V124-N128 WeakPolarHBondContact CG1-ND2 3.42Å; V124-N128 PolarHBondContact O-N 3.49Å; V124-N128 PolarHBondContact O-ND2 3.39Å; S125-N128 PolarHBondContact O-N 3.48Å; N128-S132 WeakPolarHBondContact O-CB 3.1Å; N128-S132 PolarHBondContact O-N 3.35Å
129I86.1Confident80.6Confident101 Ų10189.1 Ų89.152%0.51848%0.475SS..Hα-helixtrans-63.8-50.9176.4-70165.9000109.8S125 L126 I127 L131 S132 I135S125-I129 VanDerWaalsContact O-CG1 3.28Å; S125-I129 WeakPolarHBondContact O-CG1 3.36Å; S125-I129 PolarHBondContact O-N 2.93Å; L126-I129 PolarHBondContact O-N 3.41Å; I127-I129 PolarHBondContact O-N 3.01Å; I129-L131 PolarHBondContact O-N 3.33Å; I129-S132 WeakPolarHBondContact O-CB 3.19Å; I129-S132 PolarHBondContact O-N 3.08Å; I129-I135 HydrophobicContact CG2-CD1 4.05Å; I129-I135 WeakPolarHBondContact O-CD1 3.49Å
130I81.4Confident78.9Confident51 Ų5189.1 Ų89.126%0.26248%0.478SS..Hα-helixtrans-67.7-37.1-176.2-65.8177.6000112.2M1 L5 L126 I127 S132M1-I130 HydrophobicContact CB-CG2 3.97Å; M1-I130 HydrophobicContact CG-CG2 4.3Å; M1-I130 HydrophobicContact SD-CG2 4.18Å; L5-I130 HydrophobicContact CB-CD1 4.07Å; L5-I130 HydrophobicContact CD1-CD1 3.54Å; L5-I130 HydrophobicContact CG-CD1 4.39Å; L126-I130 WeakPolarHBondContact O-CG1 3.32Å; L126-I130 PolarHBondContact O-N 3.48Å; I127-I130 PolarHBondContact O-N 3.4Å; I130-S132 VanDerWaalsContact C-N 3.27Å
131L82Confident77.2Confident102 Ų10287.9 Ų87.953%0.53447%0.474SS..THydrogen-bonded Turntrans-83.2-1.1177.3-64.8176.1000113.2I127 I129I127-L131 HydrophobicContact CG2-CD1 3.59Å; I127-L131 HydrophobicContact CG2-CG 4.36Å; I127-L131 VanDerWaalsContact O-CB 3.32Å; I127-L131 WeakPolarHBondContact O-CB 3.47Å; I127-L131 WeakPolarHBondContact O-CG 3.35Å; I127-L131 PolarHBondContact O-N 2.96Å; I129-L131 PolarHBondContact O-N 3.33Å
132S83.6Confident75.3Confident36 Ų3694.2 Ų94.225%0.25249%0.487SS..  trans-60.6131.7-178.5-1780000111N128 I129 I130 C134 I135 H136N128-S132 WeakPolarHBondContact O-CB 3.1Å; N128-S132 PolarHBondContact O-N 3.35Å; I129-S132 WeakPolarHBondContact O-CB 3.19Å; I129-S132 PolarHBondContact O-N 3.08Å; I130-S132 VanDerWaalsContact C-N 3.27Å; S132-C134 PolarHBondContact O-N 3.19Å; S132-C134 VanDerWaalsContact O-N 3.08Å; S132-C134 PolarHBondContact OG-N 3.49Å; S132-I135 PolarHBondContact O-N 3.09Å; S132-H136 PolarHBondContact O-N 3.05Å
133P74.7Confident73.7Confident101 Ų10196.5 Ų96.566%0.65650%0.498SS*.Hα-helixtrans-54.5-29.7175.9-25.433.2000113.2I135 H136 R137P133-I135 VanDerWaalsContact C-N 3.3Å; P133-I135 PolarHBondContact O-N 3.31Å; P133-H136 PolarHBondContact O-N 3.19Å; P133-R137 WeakPolarHBondContact O-CB 3.42Å; P133-R137 PolarHBondContact O-N 3.12Å
134C73.7Confident72.2Confident94 Ų9499 Ų9964%0.63552%0.518SS*.Hα-helixtrans-61-37.7178.4-620000112.4S132S132-C134 PolarHBondContact O-N 3.19Å; S132-C134 VanDerWaalsContact O-N 3.08Å; S132-C134 PolarHBondContact OG-N 3.49Å
135I66.3Low70.2Confident80 Ų80102 Ų10241%0.4154%0.543SS..Hα-helixtrans-75-39176.9-60.2-170.4000110.1I129 S132 P133I129-I135 HydrophobicContact CG2-CD1 4.05Å; I129-I135 WeakPolarHBondContact O-CD1 3.49Å; S132-I135 PolarHBondContact O-N 3.09Å; P133-I135 VanDerWaalsContact C-N 3.3Å; P133-I135 PolarHBondContact O-N 3.31Å
136H64Low69.1Low128 Ų128103.9 Ų103.959%0.59355%0.548SS*.Hα-helixtrans-68.2-41.8-178.9-161.463.8000112.5S132 P133 N138 H139 S140S132-H136 PolarHBondContact O-N 3.05Å; P133-H136 PolarHBondContact O-N 3.19Å; H136-N138 PolarHBondContact O-N 3.46Å; H136-H139 WeakPolarHBondContact O-CB 3.46Å; H136-H139 PolarHBondContact O-N 3.38Å; H136-H139 VanDerWaalsContact O-N 3.12Å; H136-S140 PolarHBondContact O-N 2.84Å
137R60.7Low68.2Low163 Ų163106.1 Ų106.162%0.61556%0.56SS**Hα-helixtrans-64.2-40.5-178-170.2-178.4137.9143.1-0.9112.6P133 H139 S140 E141P133-R137 WeakPolarHBondContact O-CB 3.42Å; P133-R137 PolarHBondContact O-N 3.12Å; R137-H139 PolarHBondContact O-N 3.03Å; R137-S140 PolarHBondContact O-N 3.21Å; R137-S140 VanDerWaalsContact O-N 3.09Å; R137-E141 IonicContact CZ-OE1 3.21Å; R137-E141 IonicContact NE-OE1 2.98Å; R137-E141 PolarHBondContact NE-OE1 3.3Å; R137-E141 IonicContact NH2-OE1 2.74Å; R137-E141 PolarHBondContact NH2-OE1 3.36Å; R137-E141 PolarHBondContact O-N 3.37Å; R137-E141 VanDerWaalsContact O-N 3.11Å
138N58.1Low67.1Low104 Ų104108 Ų10856%0.55657%0.57SS**Hα-helixtrans-61.6-24.8175.9-76.8-1.6000113.1H136H136-N138 PolarHBondContact O-N 3.46Å
139H55.9Low65.9Low118 Ų118108.2 Ų108.255%0.54657%0.571SS.*Hα-helixtrans-81-31.9176.4-135.1-67.9000112.3H136 R137 I143H136-H139 WeakPolarHBondContact O-CB 3.46Å; H136-H139 PolarHBondContact O-N 3.38Å; H136-H139 VanDerWaalsContact O-N 3.12Å; R137-H139 PolarHBondContact O-N 3.03Å; H139-I143 WeakPolarHBondContact O-CG1 3.34Å
140S56.1Low64.6Low70 Ų70108.7 Ų108.749%0.4957%0.574SS.*Hα-helixtrans-73.8-38.7177.1-170.60000112.5H136 R137 R142 I143H136-S140 PolarHBondContact O-N 2.84Å; R137-S140 PolarHBondContact O-N 3.21Å; R137-S140 VanDerWaalsContact O-N 3.09Å; S140-R142 VanDerWaalsContact C-N 3.25Å; S140-R142 PolarHBondContact O-N 3.38Å; S140-I143 PolarHBondContact O-N 3.11Å
141E57.7Low63.5Low100 Ų100112.5 Ų112.547%0.46760%0.595SS.*Hα-helixtrans-64-32.1178.7-74.6178.7-173.800112R137 I143 V144R137-E141 IonicContact CZ-OE1 3.21Å; R137-E141 IonicContact NE-OE1 2.98Å; R137-E141 PolarHBondContact NE-OE1 3.3Å; R137-E141 IonicContact NH2-OE1 2.74Å; R137-E141 PolarHBondContact NH2-OE1 3.36Å; R137-E141 PolarHBondContact O-N 3.37Å; R137-E141 VanDerWaalsContact O-N 3.11Å; E141-I143 VanDerWaalsContact C-N 3.3Å; E141-I143 PolarHBondContact O-N 2.74Å; E141-V144 PolarHBondContact O-N 2.98Å
142R56.3Low62.2Low186 Ų186113.3 Ų113.370%0.70260%0.6SS**Hα-helixtrans-75.8-11.9-179.9-148.9-170.5-62.3-167.5-0.8114.6S140S140-R142 VanDerWaalsContact C-N 3.25Å; S140-R142 PolarHBondContact O-N 3.38Å
143I57.2Low60.6Low134 Ų134119.2 Ų119.269%0.68763%0.626SS**Hα-helixtrans-91.9-18177.2-61167.4000110.7H139 S140 E141H139-I143 WeakPolarHBondContact O-CG1 3.34Å; S140-I143 PolarHBondContact O-N 3.11Å; E141-I143 VanDerWaalsContact C-N 3.3Å; E141-I143 PolarHBondContact O-N 2.74Å
144V57.6Low59.4Low126 Ų126120.8 Ų120.876%0.76462%0.624SS**Hα-helixtrans-95.5-15.6-177.9-1770000112.5E141E141-V144 PolarHBondContact O-N 2.98Å
145S49.2Very low58.1Low146 Ų146123.2 Ų123.2100%1.02162%0.623SS**  trans-88.2017166.90000112

Retrieved 145 of 145 residues in 596.1 ms (Link to these results)

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