A0A060XA50_ONCMY Loading...

ER lumen protein-retaining receptor

AlphaFold DB (A0A1S3Q507), UniProt , Accession A0A060XA50, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene kdelr2b, Length 212 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M75.2Confident90.1Very high143 Ų14357.9 Ų57.970%0.70429%0.289SS*.  0125.20-170.46982.100106.8R5 Y59M1-R5 HydrophobicContact SD-CB 4.3Å; M1-R5 HydrophobicContact SD-CG 3.97Å; M1-Y59 HydrophobicContact CE-CE1 4.36Å
2N89.4Confident90.5Very high21 Ų2153.7 Ų53.711%0.11227%0.268CS..  trans-120.9170.3177.263.547.9000110.6F4 R5 L6 N165N2-F4 VanDerWaalsContact C-N 3.28Å; N2-F4 PolarHBondContact O-N 3.03Å; N2-F4 PolarHBondContact OD1-N 3.42Å; N2-R5 PolarHBondContact O-N 3.36Å; N2-R5 PolarHBondContact OD1-N 3.4Å; N2-L6 PolarHBondContact O-N 3.09Å; N2-N165 PolarHBondContact ND2-OD1 3.38Å; N2-N165 PolarHBondContact OD1-OD1 2.88Å
3I91.5Very high90.7Very high107 Ų10751.6 Ų51.655%0.54926%0.258SS..Hα-helixtrans-61.7-34.5-174.8-168.761.6000112.8L6 T7I3-L6 PolarHBondContact O-N 3.08Å; I3-T7 HydrophobicContact CD1-CG2 4.2Å; I3-T7 HydrophobicContact CG1-CG2 4.33Å; I3-T7 WeakPolarHBondContact O-CB 3.39Å; I3-T7 WeakPolarHBondContact O-CG2 3.31Å; I3-T7 PolarHBondContact O-N 2.85Å; I3-T7 PolarHBondContact O-OG1 2.64Å
4F91.4Very high91Very high52 Ų5250.3 Ų50.323%0.22826%0.259CS..Hα-helixtrans-69.3-42.6-179.4-56.9-68.5000111.5N2 T7 G8 I164 N165 W168N2-F4 VanDerWaalsContact C-N 3.28Å; N2-F4 PolarHBondContact O-N 3.03Å; N2-F4 PolarHBondContact OD1-N 3.42Å; F4-T7 PolarHBondContact O-OG1 3.04Å; F4-G8 PolarHBondContact O-N 2.95Å; F4-I164 HydrophobicContact CD1-CB 4.21Å; F4-I164 HydrophobicContact CD1-CG2 3.56Å; F4-I164 HydrophobicContact CD2-CG2 4.02Å; F4-I164 HydrophobicContact CE1-CG2 3.59Å; F4-I164 HydrophobicContact CE2-CG2 4.06Å; F4-I164 HydrophobicContact CG-CB 4.36Å; F4-I164 HydrophobicContact CG-CG2 3.78Å; F4-I164 HydrophobicContact CZ-CG2 3.84Å; F4-N165 HydrophobicContact CB-CB 3.85Å; F4-W168 HydrophobicContact CD2-CB 4.34Å; F4-W168 HydrophobicContact CD2-CD2 4.46Å; F4-W168 HydrophobicContact CD2-CE3 4.38Å; F4-W168 HydrophobicContact CD2-CG 4.47Å; F4-W168 HydrophobicContact CE2-CD2 4.07Å; F4-W168 AromaticContact CE2-CE3 3.57Å; F4-W168 HydrophobicContact CE2-CE3 3.57Å; F4-W168 HydrophobicContact CE2-CG 4.48Å; F4-W168 HydrophobicContact CE2-CZ3 4.13Å; F4-W168 HydrophobicContact CZ-CE3 4.48Å
5R89.3Confident91.2Very high82 Ų8246.9 Ų46.931%0.30924%0.242SC..Hα-helixtrans-63.6-46.2173.9-173.6171.7176.7177.60.5111.6M1 N2 G8 D9M1-R5 HydrophobicContact SD-CB 4.3Å; M1-R5 HydrophobicContact SD-CG 3.97Å; N2-R5 PolarHBondContact O-N 3.36Å; N2-R5 PolarHBondContact OD1-N 3.4Å; R5-G8 PolarHBondContact O-N 3.13Å; R5-D9 VanDerWaalsContact O-CG 3.25Å; R5-D9 PolarHBondContact O-N 3.37Å
6L90.3Very high91.4Very high63 Ų6345 Ų4533%0.3323%0.232SC..Hα-helixtrans-61.7-49.1-179.7179.463.2000111.8N2 I3 G8 D9 L10N2-L6 PolarHBondContact O-N 3.09Å; I3-L6 PolarHBondContact O-N 3.08Å; L6-G8 VanDerWaalsContact C-N 3.31Å; L6-G8 PolarHBondContact O-N 2.72Å; L6-D9 PolarHBondContact O-N 3.31Å; L6-L10 HydrophobicContact CD1-CD1 4.43Å; L6-L10 HydrophobicContact CG-CD1 4.29Å; L6-L10 VanDerWaalsContact O-CG 3.31Å; L6-L10 WeakPolarHBondContact O-CG 3.31Å; L6-L10 PolarHBondContact O-N 2.7Å
7T92.7Very high91.6Very high53 Ų5346.5 Ų46.533%0.32524%0.239SC..Hα-helixtrans-66.4-34177.9510000112.1I3 F4 S11I3-T7 HydrophobicContact CD1-CG2 4.2Å; I3-T7 HydrophobicContact CG1-CG2 4.33Å; I3-T7 WeakPolarHBondContact O-CB 3.39Å; I3-T7 WeakPolarHBondContact O-CG2 3.31Å; I3-T7 PolarHBondContact O-N 2.85Å; I3-T7 PolarHBondContact O-OG1 2.64Å; F4-T7 PolarHBondContact O-OG1 3.04Å; T7-S11 VanDerWaalsContact O-CB 3.31Å; T7-S11 WeakPolarHBondContact O-CB 3.49Å; T7-S11 PolarHBondContact O-N 3.02Å
8G93Very high91.7Very high0 Ų046.3 Ų46.30%024%0.239CC..Hα-helixtrans-59-53.9169.600000111.9F4 R5 L6 L10 S11 H12 Y158F4-G8 PolarHBondContact O-N 2.95Å; R5-G8 PolarHBondContact O-N 3.13Å; L6-G8 VanDerWaalsContact C-N 3.31Å; L6-G8 PolarHBondContact O-N 2.72Å; G8-L10 VanDerWaalsContact C-N 3.3Å; G8-L10 PolarHBondContact O-N 3.48Å; G8-S11 WeakPolarHBondContact O-CB 3.3Å; G8-S11 PolarHBondContact O-N 3.32Å; G8-S11 VanDerWaalsContact O-N 3.09Å; G8-H12 PolarHBondContact O-N 3.44Å; G8-Y158 WeakPolarHBondContact O-CB 3.26Å
9D91.1Very high91.9Very high17 Ų1744.1 Ų44.19%0.09123%0.227CC..Hα-helixtrans-59.3-41.1-179.6-67.7-19.4000111.8R5 L6 H12 L13 Y67 Y162R5-D9 VanDerWaalsContact O-CG 3.25Å; R5-D9 PolarHBondContact O-N 3.37Å; L6-D9 PolarHBondContact O-N 3.31Å; D9-H12 PolarHBondContact O-N 3.36Å; D9-L13 WeakPolarHBondContact O-CB 3.39Å; D9-L13 PolarHBondContact O-N 2.66Å; D9-Y67 PolarHBondContact O-OH 3.37Å; D9-Y162 VanDerWaalsContact OD1-CE2 3.29Å; D9-Y162 WeakPolarHBondContact OD1-CE2 3.42Å; D9-Y162 VanDerWaalsContact OD1-CZ 3.32Å; D9-Y162 PolarHBondContact OD1-OH 3.28Å
10L92.8Very high92.1Very high90 Ų9043.7 Ų43.747%0.47123%0.225SC..Hα-helixtrans-66.2-40.3174.8-67.7175000112.6L6 G8 H12 L13 A14L6-L10 HydrophobicContact CD1-CD1 4.43Å; L6-L10 HydrophobicContact CG-CD1 4.29Å; L6-L10 VanDerWaalsContact O-CG 3.31Å; L6-L10 WeakPolarHBondContact O-CG 3.31Å; L6-L10 PolarHBondContact O-N 2.7Å; G8-L10 VanDerWaalsContact C-N 3.3Å; G8-L10 PolarHBondContact O-N 3.48Å; L10-H12 VanDerWaalsContact C-N 3.34Å; L10-L13 PolarHBondContact O-N 3.24Å; L10-A14 WeakPolarHBondContact O-CB 3.4Å; L10-A14 PolarHBondContact O-N 2.93Å
11S94.9Very high92.2Very high9 Ų945.5 Ų45.56%0.06324%0.235CC..Hα-helixtrans-62-42.7174.2-175.70000111.2T7 G8 A14 A15 F154T7-S11 VanDerWaalsContact O-CB 3.31Å; T7-S11 WeakPolarHBondContact O-CB 3.49Å; T7-S11 PolarHBondContact O-N 3.02Å; G8-S11 WeakPolarHBondContact O-CB 3.3Å; G8-S11 PolarHBondContact O-N 3.32Å; G8-S11 VanDerWaalsContact O-N 3.09Å; S11-A14 PolarHBondContact O-N 2.97Å; S11-A15 PolarHBondContact O-N 3.18Å; S11-F154 PolarHBondContact OG-O 2.99Å
12H94.6Very high93.1Very high7 Ų739.1 Ų39.13%0.03220%0.203CC..Hα-helixtrans-63.8-44.8176.9-169.5-175.7000111.4G8 D9 L10 A14 A15 I16 F44 E127 Y158G8-H12 PolarHBondContact O-N 3.44Å; D9-H12 PolarHBondContact O-N 3.36Å; L10-H12 VanDerWaalsContact C-N 3.34Å; H12-A14 VanDerWaalsContact C-N 3.33Å; H12-A14 PolarHBondContact O-N 3.37Å; H12-A15 WeakPolarHBondContact O-CB 3.25Å; H12-A15 PolarHBondContact O-N 3.38Å; H12-I16 PolarHBondContact O-N 3.46Å; H12-I16 VanDerWaalsContact O-N 3.15Å; H12-F44 AromaticContact CE1-CE1 3.79Å; H12-F44 AromaticContact CE1-CZ 3.53Å; H12-F44 AromaticContact NE2-CZ 3.72Å; H12-E127 IonicContact CE1-OE1 2.79Å; H12-Y158 HydrophobicContact CB-CD1 4.13Å; H12-Y158 HydrophobicContact CB-CD2 3.86Å; H12-Y158 HydrophobicContact CB-CE2 4.35Å; H12-Y158 HydrophobicContact CB-CG 3.73Å; H12-Y158 AromaticContact CE1-CE2 3.95Å; H12-Y158 AromaticContact CE1-CZ 3.97Å; H12-Y158 AromaticContact CG-CD2 3.97Å; H12-Y158 AromaticContact CG-CE2 3.95Å; H12-Y158 AromaticContact ND1-CD2 3.98Å; H12-Y158 AromaticContact ND1-CE2 3.64Å
13L93.6Very high93.4Very high27 Ų2738.1 Ų38.114%0.14120%0.198CC..Hα-helixtrans-61.9-42.2176.3-179.261.3000111.5D9 L10 A15 I16 I17 M63 I66 Y67D9-L13 WeakPolarHBondContact O-CB 3.39Å; D9-L13 PolarHBondContact O-N 2.66Å; L10-L13 PolarHBondContact O-N 3.24Å; L13-A15 VanDerWaalsContact C-N 3.34Å; L13-A15 PolarHBondContact O-N 2.87Å; L13-I16 PolarHBondContact O-N 3.18Å; L13-I17 HydrophobicContact CD1-CD1 3.89Å; L13-I17 HydrophobicContact CD1-CG1 4.15Å; L13-I17 HydrophobicContact CD2-CD1 4.39Å; L13-I17 HydrophobicContact CG-CD1 3.79Å; L13-I17 HydrophobicContact CG-CG1 4.41Å; L13-I17 WeakPolarHBondContact O-CG1 3.43Å; L13-I17 PolarHBondContact O-N 3.34Å; L13-M63 HydrophobicContact CB-CE 4.35Å; L13-M63 HydrophobicContact CD2-CE 4.08Å; L13-M63 HydrophobicContact CD2-SD 4.21Å; L13-I66 HydrophobicContact CD1-CG2 3.59Å; L13-Y67 HydrophobicContact CB-CE1 4.15Å; L13-Y67 HydrophobicContact CD1-CE1 4.24Å
14A94.8Very high93.6Very high33 Ų3338.4 Ų38.427%0.27319%0.192SC..Hα-helixtrans-59.1-44.5175.400000111.6L10 S11 H12 I16 I17 I18L10-A14 WeakPolarHBondContact O-CB 3.4Å; L10-A14 PolarHBondContact O-N 2.93Å; S11-A14 PolarHBondContact O-N 2.97Å; H12-A14 VanDerWaalsContact C-N 3.33Å; H12-A14 PolarHBondContact O-N 3.37Å; A14-I16 PolarHBondContact O-N 3.22Å; A14-I17 PolarHBondContact O-N 3.5Å; A14-I18 WeakPolarHBondContact O-CB 3.36Å; A14-I18 WeakPolarHBondContact O-CD1 3.09Å; A14-I18 WeakPolarHBondContact O-CG1 3.33Å; A14-I18 PolarHBondContact O-N 3.4Å
15A94.3Very high93.7Very high0 Ų043.7 Ų43.70%022%0.215CC..Hα-helixtrans-56.6-48.4176.600000111.9S11 H12 L13 I18 L19 Y151 F154 L155S11-A15 PolarHBondContact O-N 3.18Å; H12-A15 WeakPolarHBondContact O-CB 3.25Å; H12-A15 PolarHBondContact O-N 3.38Å; L13-A15 VanDerWaalsContact C-N 3.34Å; L13-A15 PolarHBondContact O-N 2.87Å; A15-I18 PolarHBondContact O-N 3.26Å; A15-L19 PolarHBondContact O-N 3.33Å; A15-L19 VanDerWaalsContact O-N 3.08Å; A15-Y151 HydrophobicContact CB-CD2 4.06Å; A15-Y151 HydrophobicContact CB-CE2 4.5Å; A15-Y151 WeakPolarHBondContact O-CD2 3.47Å; A15-F154 HydrophobicContact CB-CB 3.75Å; A15-L155 HydrophobicContact CB-CB 4.08Å; A15-L155 HydrophobicContact CB-CD1 4.23Å
16I94.5Very high94Very high16 Ų1643.1 Ų43.18%0.08222%0.221CC..Hα-helixtrans-63.9-45.1-179.4-69169.1000111.2H12 L13 A14 L19 L20 F44 Y67 C70H12-I16 PolarHBondContact O-N 3.46Å; H12-I16 VanDerWaalsContact O-N 3.15Å; L13-I16 PolarHBondContact O-N 3.18Å; A14-I16 PolarHBondContact O-N 3.22Å; I16-L19 PolarHBondContact O-N 3.05Å; I16-L20 WeakPolarHBondContact O-CB 3.41Å; I16-L20 PolarHBondContact O-N 3.28Å; I16-F44 HydrophobicContact CD1-CE2 4.09Å; I16-F44 HydrophobicContact CD1-CZ 3.98Å; I16-Y67 HydrophobicContact CD1-CD1 3.45Å; I16-Y67 VanDerWaalsContact CD1-CD1 3.45Å; I16-Y67 HydrophobicContact CD1-CE1 3.76Å; I16-C70 HydrophobicContact CG2-CB 3.34Å
17I94.1Very high94.2Very high70 Ų7046.1 Ų46.136%0.35923%0.227SC..Hα-helixtrans-65.5-42178.6-68.3174.2000111L13 A14 L19 L20 L21L13-I17 HydrophobicContact CD1-CD1 3.89Å; L13-I17 HydrophobicContact CD1-CG1 4.15Å; L13-I17 HydrophobicContact CD2-CD1 4.39Å; L13-I17 HydrophobicContact CG-CD1 3.79Å; L13-I17 HydrophobicContact CG-CG1 4.41Å; L13-I17 WeakPolarHBondContact O-CG1 3.43Å; L13-I17 PolarHBondContact O-N 3.34Å; A14-I17 PolarHBondContact O-N 3.5Å; I17-L19 VanDerWaalsContact C-N 3.34Å; I17-L19 PolarHBondContact O-N 2.99Å; I17-L20 PolarHBondContact O-N 3.48Å; I17-L21 HydrophobicContact CG2-CD1 3.65Å; I17-L21 HydrophobicContact CG2-CG 4.04Å; I17-L21 VanDerWaalsContact O-CB 3.3Å; I17-L21 WeakPolarHBondContact O-CB 3.34Å; I17-L21 VanDerWaalsContact O-CG 3.29Å; I17-L21 WeakPolarHBondContact O-CG 3.33Å; I17-L21 PolarHBondContact O-N 3.22Å
18I94.2Very high94.2Very high44 Ų4444.9 Ų44.923%0.22622%0.221CC..Hα-helixtrans-58.1-47.7177.3-73.6164.5000110.3A14 A15 K22 I147 F154A14-I18 WeakPolarHBondContact O-CB 3.36Å; A14-I18 WeakPolarHBondContact O-CD1 3.09Å; A14-I18 WeakPolarHBondContact O-CG1 3.33Å; A14-I18 PolarHBondContact O-N 3.4Å; A15-I18 PolarHBondContact O-N 3.26Å; I18-K22 VanDerWaalsContact O-CB 3.28Å; I18-K22 WeakPolarHBondContact O-CB 3.23Å; I18-K22 PolarHBondContact O-N 3.41Å; I18-I147 HydrophobicContact CG2-CG2 4.07Å; I18-F154 HydrophobicContact CD1-CD2 3.41Å; I18-F154 VanDerWaalsContact CD1-CD2 3.41Å; I18-F154 HydrophobicContact CD1-CE2 3.53Å; I18-F154 HydrophobicContact CD1-CG 4.44Å
19L94.8Very high94.3Very high3 Ų344.9 Ų44.92%0.01622%0.221CC..Hα-helixtrans-63-47.8179179.361000111.7A15 I16 I17 L21 K22 I23 I32 Q37 T74 Y151A15-L19 PolarHBondContact O-N 3.33Å; A15-L19 VanDerWaalsContact O-N 3.08Å; I16-L19 PolarHBondContact O-N 3.05Å; I17-L19 VanDerWaalsContact C-N 3.34Å; I17-L19 PolarHBondContact O-N 2.99Å; L19-L21 PolarHBondContact O-N 3.04Å; L19-K22 WeakPolarHBondContact O-CB 3.46Å; L19-K22 PolarHBondContact O-N 3.35Å; L19-I23 HydrophobicContact CD1-CD1 4Å; L19-I23 HydrophobicContact CD1-CG1 4.36Å; L19-I23 HydrophobicContact CG-CD1 4.09Å; L19-I23 WeakPolarHBondContact O-CG1 3.26Å; L19-I23 PolarHBondContact O-N 3.48Å; L19-I32 HydrophobicContact CD1-CD1 3.65Å; L19-I32 HydrophobicContact CD1-CG1 3.98Å; L19-I32 HydrophobicContact CD1-CG2 4.16Å; L19-Q37 HydrophobicContact CD2-CG 4.45Å; L19-T74 HydrophobicContact CD2-CG2 3.98Å; L19-T74 HydrophobicContact CG-CG2 4.32Å; L19-Y151 HydrophobicContact CB-CD2 3.94Å; L19-Y151 HydrophobicContact CB-CE2 4.35Å; L19-Y151 HydrophobicContact CB-CG 4.23Å; L19-Y151 HydrophobicContact CD2-CD2 4.34Å; L19-Y151 HydrophobicContact CD2-CE1 4.39Å; L19-Y151 HydrophobicContact CD2-CE2 3.97Å
20L94.8Very high94.3Very high37 Ų3745.7 Ų45.719%0.19423%0.23CC..Hα-helixtrans-62-45.5-179.3-170.374.5000111.4I16 I17 I23 W24 A73 T74 L77I16-L20 WeakPolarHBondContact O-CB 3.41Å; I16-L20 PolarHBondContact O-N 3.28Å; I17-L20 PolarHBondContact O-N 3.48Å; L20-I23 PolarHBondContact O-N 3.04Å; L20-W24 WeakPolarHBondContact O-CB 3.46Å; L20-W24 PolarHBondContact O-N 3.49Å; L20-A73 HydrophobicContact CD1-CB 3.96Å; L20-T74 WeakPolarHBondContact CD1-OG1 3.5Å; L20-L77 HydrophobicContact CD1-CD1 3.67Å; L20-L77 HydrophobicContact CG-CD1 4.47Å
21L94.4Very high94.1Very high81 Ų8142.8 Ų42.842%0.42422%0.222SC..Hα-helixtrans-66-36.8176.4-71.7179.3000112.1I17 L19 W24 K25I17-L21 HydrophobicContact CG2-CD1 3.65Å; I17-L21 HydrophobicContact CG2-CG 4.04Å; I17-L21 VanDerWaalsContact O-CB 3.3Å; I17-L21 WeakPolarHBondContact O-CB 3.34Å; I17-L21 VanDerWaalsContact O-CG 3.29Å; I17-L21 WeakPolarHBondContact O-CG 3.33Å; I17-L21 PolarHBondContact O-N 3.22Å; L19-L21 PolarHBondContact O-N 3.04Å; L21-W24 PolarHBondContact O-N 2.97Å; L21-K25 VanDerWaalsContact O-CB 3.27Å; L21-K25 WeakPolarHBondContact O-CB 3.49Å; L21-K25 WeakPolarHBondContact O-CG 3.33Å; L21-K25 PolarHBondContact O-N 2.93Å
22K94.3Very high94.1Very high9 Ų942.3 Ų42.34%0.03922%0.219CC..Hα-helixtrans-57.1-54.2174-177.5-94.8-177.3173.50110I18 L19 W24 T26 A30 E145 I147I18-K22 VanDerWaalsContact O-CB 3.28Å; I18-K22 WeakPolarHBondContact O-CB 3.23Å; I18-K22 PolarHBondContact O-N 3.41Å; L19-K22 WeakPolarHBondContact O-CB 3.46Å; L19-K22 PolarHBondContact O-N 3.35Å; K22-W24 VanDerWaalsContact C-N 3.33Å; K22-W24 PolarHBondContact O-N 3.31Å; K22-T26 WeakPolarHBondContact O-CB 3.37Å; K22-T26 WeakPolarHBondContact O-CG2 3.38Å; K22-T26 PolarHBondContact O-N 3.08Å; K22-T26 PolarHBondContact O-OG1 2.98Å; K22-A30 PolarHBondContact NZ-O 2.77Å; K22-A30 VanDerWaalsContact NZ-O 3.11Å; K22-E145 WeakPolarHBondContact CE-OE2 3.36Å; K22-E145 IonicContact NZ-OE2 3.42Å; K22-E145 PolarHBondContact NZ-OE2 2.97Å; K22-I147 HydrophobicContact CB-CG2 3.8Å; K22-I147 HydrophobicContact CG-CB 4.15Å; K22-I147 HydrophobicContact CG-CD1 4.44Å; K22-I147 HydrophobicContact CG-CG2 3.62Å
23I95.6Very high94.1Very high0 Ų042 Ų420%022%0.217CC..Hα-helixtrans-63-43-178.4-62.6166.7000110.4L19 L20 R27 S28 C29 T74 L77 I78 F82L19-I23 HydrophobicContact CD1-CD1 4Å; L19-I23 HydrophobicContact CD1-CG1 4.36Å; L19-I23 HydrophobicContact CG-CD1 4.09Å; L19-I23 WeakPolarHBondContact O-CG1 3.26Å; L19-I23 PolarHBondContact O-N 3.48Å; L20-I23 PolarHBondContact O-N 3.04Å; I23-R27 WeakPolarHBondContact O-CA 3.38Å; I23-R27 PolarHBondContact O-N 3.14Å; I23-S28 WeakPolarHBondContact CA-O 3.47Å; I23-S28 PolarHBondContact O-N 2.94Å; I23-C29 HydrophobicContact CG1-CB 4.42Å; I23-C29 HydrophobicContact CG2-CB 4.26Å; I23-T74 HydrophobicContact CD1-CG2 3.95Å; I23-L77 HydrophobicContact CB-CD1 4.25Å; I23-L77 HydrophobicContact CG2-CB 3.81Å; I23-L77 HydrophobicContact CG2-CD1 3.9Å; I23-L77 HydrophobicContact CG2-CG 4.47Å; I23-I78 HydrophobicContact CD1-CD1 4.36Å; I23-I78 HydrophobicContact CD1-CG1 4.18Å; I23-F82 HydrophobicContact CG2-CD2 3.57Å; I23-F82 HydrophobicContact CG2-CE2 4.01Å
24W95.6Very high94.3Very high114 Ų11440.7 Ų40.743%0.43221%0.211SC..Hα-helixtrans-66.3-45.7-179.1-175.3-97.4000113.6L20 L21 K22 R27 L77 K81L20-W24 WeakPolarHBondContact O-CB 3.46Å; L20-W24 PolarHBondContact O-N 3.49Å; L21-W24 PolarHBondContact O-N 2.97Å; K22-W24 VanDerWaalsContact C-N 3.33Å; K22-W24 PolarHBondContact O-N 3.31Å; W24-R27 VanDerWaalsContact O-CD 3.29Å; W24-R27 WeakPolarHBondContact O-CD 3.27Å; W24-L77 HydrophobicContact CE3-CD1 4.4Å; W24-L77 HydrophobicContact CE3-CD2 4.05Å; W24-L77 HydrophobicContact CZ3-CD2 4.22Å; W24-K81 VanDerWaalsContact CH2-NZ 3.34Å; W24-K81 HydrophobicContact CZ3-CD 4.18Å; W24-K81 VanDerWaalsContact CZ3-NZ 3.3Å
25K95.1Very high94.5Very high162 Ų16241.6 Ų41.670%0.70421%0.208SC*.Hα-helixtrans-74.4-40.5-177.1-72.5-175175.1-175.50112.2L21 R27L21-K25 VanDerWaalsContact O-CB 3.27Å; L21-K25 WeakPolarHBondContact O-CB 3.49Å; L21-K25 WeakPolarHBondContact O-CG 3.33Å; L21-K25 PolarHBondContact O-N 2.93Å; K25-R27 VanDerWaalsContact C-N 3.29Å
26T94.1Very high94.6Very high70 Ų7041.6 Ų41.643%0.42921%0.208SC..Hα-helixtrans-80.6-11.5178.8630000113.1K22 S28K22-T26 WeakPolarHBondContact O-CB 3.37Å; K22-T26 WeakPolarHBondContact O-CG2 3.38Å; K22-T26 PolarHBondContact O-N 3.08Å; K22-T26 PolarHBondContact O-OG1 2.98Å; T26-S28 PolarHBondContact O-N 2.94Å; T26-S28 VanDerWaalsContact O-N 3.15Å; T26-S28 PolarHBondContact OG1-N 3.46Å; T26-S28 PolarHBondContact OG1-O 3.15Å
27R95.1Very high94.8Very high126 Ų12641.4 Ų41.448%0.47521%0.207SC..THydrogen-bonded Turntrans54.827.4-174.3-54.7-65.8-171.1-171.77.9112.6I23 W24 K25 F82I23-R27 WeakPolarHBondContact O-CA 3.38Å; I23-R27 PolarHBondContact O-N 3.14Å; W24-R27 VanDerWaalsContact O-CD 3.29Å; W24-R27 WeakPolarHBondContact O-CD 3.27Å; K25-R27 VanDerWaalsContact C-N 3.29Å; R27-F82 HydrophobicContact CB-CD1 4.3Å; R27-F82 HydrophobicContact CB-CE1 3.76Å; R27-F82 HydrophobicContact CB-CZ 4.23Å; R27-F82 VanDerWaalsContact CD-CZ 3.5Å; R27-F82 HydrophobicContact CG-CE1 4.31Å; R27-F82 HydrophobicContact CG-CZ 4.49Å; R27-F82 VanDerWaalsContact O-CD1 3.24Å; R27-F82 WeakPolarHBondContact O-CD1 3.44Å
28S93.3Very high95Very high27 Ų2741.7 Ų41.719%0.18921%0.208CC..  trans-145.1140.6-174.1178.20000111.3I23 T26 A30 T85I23-S28 WeakPolarHBondContact CA-O 3.47Å; I23-S28 PolarHBondContact O-N 2.94Å; T26-S28 PolarHBondContact O-N 2.94Å; T26-S28 VanDerWaalsContact O-N 3.15Å; T26-S28 PolarHBondContact OG1-N 3.46Å; T26-S28 PolarHBondContact OG1-O 3.15Å; S28-A30 WeakPolarHBondContact OG-CB 3.42Å; S28-A30 PolarHBondContact OG-N 3.37Å; S28-T85 WeakPolarHBondContact CA-OG1 3.34Å
29C93.7Very high95.2Very high0 Ų039.7 Ų39.70%020%0.198CC..  trans-110.618.7171.962.90000113I23 G31 I32 I78 F82 T85I23-C29 HydrophobicContact CG1-CB 4.42Å; I23-C29 HydrophobicContact CG2-CB 4.26Å; C29-G31 PolarHBondContact O-N 2.87Å; C29-I32 WeakPolarHBondContact O-CB 3.33Å; C29-I32 PolarHBondContact O-N 2.76Å; C29-I78 HydrophobicContact CB-CG1 3.88Å; C29-F82 PolarHBondContact SG-O 3.38Å; C29-T85 PolarHBondContact N-OG1 3.02Å; C29-T85 PolarHBondContact SG-OG1 2.98Å
30A91.3Very high95.3Very high34 Ų3440 Ų4028%0.28120%0.199SC..THydrogen-bonded Turntrans-54.5137.6174.500000111.5K22 S28 I32 T85K22-A30 PolarHBondContact NZ-O 2.77Å; K22-A30 VanDerWaalsContact NZ-O 3.11Å; S28-A30 WeakPolarHBondContact OG-CB 3.42Å; S28-A30 PolarHBondContact OG-N 3.37Å; A30-I32 VanDerWaalsContact C-N 3.27Å; A30-I32 PolarHBondContact O-N 2.9Å; A30-T85 PolarHBondContact N-O 3.48Å
31G89.2Confident95.4Very high29 Ų2938.4 Ų38.430%0.29919%0.192SC..THydrogen-bonded Turntrans74.75.3-179.300000115.8C29 Q134C29-G31 PolarHBondContact O-N 2.87Å; G31-Q134 PolarHBondContact O-NE2 3.24Å
32I94.4Very high95.6Very high0 Ų037.7 Ų37.70%019%0.188CC..  trans-107127.3177.3-53.1-57.6000110L19 C29 A30 G34 Q37 I78 T148L19-I32 HydrophobicContact CD1-CD1 3.65Å; L19-I32 HydrophobicContact CD1-CG1 3.98Å; L19-I32 HydrophobicContact CD1-CG2 4.16Å; C29-I32 WeakPolarHBondContact O-CB 3.33Å; C29-I32 PolarHBondContact O-N 2.76Å; A30-I32 VanDerWaalsContact C-N 3.27Å; A30-I32 PolarHBondContact O-N 2.9Å; I32-G34 PolarHBondContact O-N 3.48Å; I32-Q37 HydrophobicContact CG2-CG 4.3Å; I32-I78 HydrophobicContact CG2-CD1 3.93Å; I32-T148 HydrophobicContact CD1-CG2 3.75Å
33S96Very high95.8Very high0 Ų037.2 Ų37.20%019%0.186CC..  trans-74.7111.8173.1173.10000109.7K35 S36 Q37 D91 P133S33-K35 PolarHBondContact O-N 2.67Å; S33-K35 PolarHBondContact OG-N 3.1Å; S33-S36 PolarHBondContact O-N 3.36Å; S33-S36 PolarHBondContact OG-N 3.03Å; S33-Q37 PolarHBondContact O-N 3.01Å; S33-D91 WeakPolarHBondContact CA-OD2 3.29Å; S33-D91 WeakPolarHBondContact CB-OD1 3.28Å; S33-D91 VanDerWaalsContact OG-CG 3.23Å; S33-D91 PolarHBondContact OG-OD1 2.91Å; S33-D91 PolarHBondContact OG-OD2 3.44Å; S33-P133 VanDerWaalsContact OG-CB 3.27Å; S33-P133 WeakPolarHBondContact OG-CB 3.27Å
34G96.9Very high95.9Very high0 Ų037.4 Ų37.40%019%0.187CC..Hα-helixtrans-65.4-29.917300000111.4I32 Q37 I38 Y79 D91I32-G34 PolarHBondContact O-N 3.48Å; G34-Q37 PolarHBondContact O-N 3.2Å; G34-I38 WeakPolarHBondContact O-CG1 3.32Å; G34-I38 PolarHBondContact O-N 3.5Å; G34-Y79 WeakPolarHBondContact CA-OH 3.37Å; G34-Y79 PolarHBondContact O-OH 3.04Å; G34-D91 PolarHBondContact N-OD2 2.79Å
35K97.9Very high96Very high52 Ų5234 Ų3423%0.22618%0.179CC..Hα-helixtrans-62.5-47.1176.1-74175.4174.1172.30112S33 Q37 I38 L39 Y79 D91 F93 V95 P133S33-K35 PolarHBondContact O-N 2.67Å; S33-K35 PolarHBondContact OG-N 3.1Å; K35-Q37 VanDerWaalsContact C-N 3.29Å; K35-Q37 PolarHBondContact O-N 3.22Å; K35-I38 PolarHBondContact O-N 3.29Å; K35-L39 WeakPolarHBondContact O-CG 3.46Å; K35-L39 PolarHBondContact O-N 3.06Å; K35-Y79 PolarHBondContact N-OH 3.13Å; K35-D91 WeakPolarHBondContact CD-O 3.43Å; K35-D91 VanDerWaalsContact CE-O 3.26Å; K35-D91 WeakPolarHBondContact CE-O 3.17Å; K35-D91 PolarHBondContact N-OD2 2.84Å; K35-D91 VanDerWaalsContact N-OD2 3.1Å; K35-D91 PolarHBondContact NZ-O 3.46Å; K35-F93 VanDerWaalsContact CD-O 3.23Å; K35-F93 WeakPolarHBondContact CD-O 3.45Å; K35-F93 WeakPolarHBondContact CE-O 3.49Å; K35-F93 PolarHBondContact NZ-O 3.24Å; K35-V95 HydrophobicContact CB-CG1 3.85Å; K35-V95 HydrophobicContact CD-CG1 4.09Å; K35-V95 HydrophobicContact CG-CG1 4.14Å; K35-P133 HydrophobicContact CB-CB 3.83Å; K35-P133 HydrophobicContact CB-CG 4.17Å
36S97.1Very high96.1Very high0 Ų026.8 Ų26.80%015%0.149CC..Hα-helixtrans-58.5-40.6173.9-82.10000112.3S33 I38 L39 F40 A130 P133 Q134S33-S36 PolarHBondContact O-N 3.36Å; S33-S36 PolarHBondContact OG-N 3.03Å; S36-I38 PolarHBondContact O-N 3.06Å; S36-L39 PolarHBondContact O-N 3.03Å; S36-F40 WeakPolarHBondContact O-CD2 3.43Å; S36-F40 PolarHBondContact O-N 3.26Å; S36-A130 WeakPolarHBondContact CA-O 3.35Å; S36-A130 VanDerWaalsContact CB-O 3.29Å; S36-A130 WeakPolarHBondContact CB-O 3.15Å; S36-A130 PolarHBondContact OG-O 2.86Å; S36-P133 WeakPolarHBondContact OG-CB 3.49Å; S36-P133 WeakPolarHBondContact OG-CD 3.31Å; S36-Q134 PolarHBondContact OG-N 3.33Å
37Q98.1Very high96.2Very high12 Ų1224.9 Ų24.96%0.05613%0.134CC..Hα-helixtrans-67.1-35.7178.9-58.8-51.4-49.800112.8L19 I32 S33 G34 K35 F40 A41 T74 V75 I78 Y151L19-Q37 HydrophobicContact CD2-CG 4.45Å; I32-Q37 HydrophobicContact CG2-CG 4.3Å; S33-Q37 PolarHBondContact O-N 3.01Å; G34-Q37 PolarHBondContact O-N 3.2Å; K35-Q37 VanDerWaalsContact C-N 3.29Å; K35-Q37 PolarHBondContact O-N 3.22Å; Q37-F40 PolarHBondContact O-N 3.15Å; Q37-A41 WeakPolarHBondContact O-CB 3.48Å; Q37-A41 PolarHBondContact O-N 3.37Å; Q37-T74 HydrophobicContact CB-CG2 4.39Å; Q37-T74 HydrophobicContact CG-CG2 3.91Å; Q37-V75 HydrophobicContact CB-CG2 4.04Å; Q37-I78 HydrophobicContact CB-CD1 4.12Å; Q37-I78 HydrophobicContact CG-CD1 3.63Å; Q37-Y151 PolarHBondContact NE2-OH 3.46Å
38I98.3Very high96.2Very high75 Ų7520.3 Ų20.339%0.38512%0.117SC..Hα-helixtrans-62.5-44.3171.2-70.5170.4000110.6G34 K35 S36 A41 L42 V75 Y79G34-I38 WeakPolarHBondContact O-CG1 3.32Å; G34-I38 PolarHBondContact O-N 3.5Å; K35-I38 PolarHBondContact O-N 3.29Å; S36-I38 PolarHBondContact O-N 3.06Å; I38-A41 PolarHBondContact O-N 3.22Å; I38-L42 WeakPolarHBondContact O-CB 3.32Å; I38-L42 PolarHBondContact O-N 3.22Å; I38-V75 HydrophobicContact CG1-CG1 4.2Å; I38-V75 HydrophobicContact CG1-CG2 4.3Å; I38-Y79 HydrophobicContact CD1-CD2 4.31Å; I38-Y79 HydrophobicContact CD1-CE2 3.45Å; I38-Y79 VanDerWaalsContact CD1-CE2 3.45Å; I38-Y79 WeakPolarHBondContact CD1-OH 3.4Å; I38-Y79 HydrophobicContact CG1-CE2 3.8Å
39L98.3Very high96.2Very high3 Ų322 Ų222%0.01612%0.123CC..Hα-helixtrans-62.8-43.5178.4-63.6-177.9000111.6K35 S36 L42 V43 V95 L98 V99 L126 A130 P133K35-L39 WeakPolarHBondContact O-CG 3.46Å; K35-L39 PolarHBondContact O-N 3.06Å; S36-L39 PolarHBondContact O-N 3.03Å; L39-L42 PolarHBondContact O-N 3.4Å; L39-V43 WeakPolarHBondContact O-CG2 3.33Å; L39-V43 PolarHBondContact O-N 3.4Å; L39-V95 HydrophobicContact CD1-CG1 4.15Å; L39-V95 HydrophobicContact CD2-CB 4.41Å; L39-V95 HydrophobicContact CD2-CG1 4.5Å; L39-V95 HydrophobicContact CG-CG1 4.44Å; L39-L98 HydrophobicContact CD1-CD1 3.95Å; L39-V99 HydrophobicContact CD2-CG2 3.77Å; L39-L126 HydrophobicContact CD2-CD1 4.24Å; L39-A130 HydrophobicContact CB-CB 3.8Å; L39-A130 HydrophobicContact CD1-CB 4.49Å; L39-P133 HydrophobicContact CD1-CG 4.04Å
40F97.7Very high96Very high8 Ų824.1 Ų24.14%0.03513%0.134CC..Hα-helixtrans-63.6-39.5174.6-72.4-55.9000112.7S36 Q37 L42 V43 F44 E127 A130 I131 L155S36-F40 WeakPolarHBondContact O-CD2 3.43Å; S36-F40 PolarHBondContact O-N 3.26Å; Q37-F40 PolarHBondContact O-N 3.15Å; F40-L42 VanDerWaalsContact C-N 3.33Å; F40-L42 PolarHBondContact O-N 3.33Å; F40-V43 WeakPolarHBondContact O-CB 3.4Å; F40-V43 PolarHBondContact O-N 3.18Å; F40-F44 WeakPolarHBondContact O-CD2 3.47Å; F40-F44 PolarHBondContact O-N 2.61Å; F40-F44 VanDerWaalsContact O-N 3.08Å; F40-E127 HydrophobicContact CE1-CG 4.45Å; F40-A130 HydrophobicContact CD1-CB 3.83Å; F40-A130 HydrophobicContact CE1-CB 3.6Å; F40-A130 HydrophobicContact CE2-CB 4.48Å; F40-A130 HydrophobicContact CG-CB 4.36Å; F40-A130 HydrophobicContact CZ-CB 3.95Å; F40-I131 HydrophobicContact CE2-CD1 3.99Å; F40-I131 HydrophobicContact CZ-CB 4.26Å; F40-I131 HydrophobicContact CZ-CD1 4.07Å; F40-L155 HydrophobicContact CE2-CD2 4.15Å; F40-L155 HydrophobicContact CZ-CD2 3.85Å
41A98.1Very high96Very high5 Ų524.8 Ų24.84%0.04113%0.133CC..Hα-helixtrans-61-44.2173.200000111.2Q37 I38 V43 F44 T45 A71 V75Q37-A41 WeakPolarHBondContact O-CB 3.48Å; Q37-A41 PolarHBondContact O-N 3.37Å; I38-A41 PolarHBondContact O-N 3.22Å; A41-V43 VanDerWaalsContact C-N 3.35Å; A41-V43 PolarHBondContact O-N 2.74Å; A41-F44 PolarHBondContact O-N 3.13Å; A41-T45 WeakPolarHBondContact O-CB 2.92Å; A41-T45 PolarHBondContact O-N 3.01Å; A41-T45 PolarHBondContact O-OG1 3.45Å; A41-A71 HydrophobicContact CB-CB 4.09Å; A41-V75 HydrophobicContact CB-CG2 4.16Å
42L98.1Very high95.9Very high65 Ų6530.8 Ų30.834%0.3416%0.158SC..Hα-helixtrans-63.1-38.6176.7-176.859.5000112.5I38 L39 F40 T45 S46 F122 L126I38-L42 WeakPolarHBondContact O-CB 3.32Å; I38-L42 PolarHBondContact O-N 3.22Å; L39-L42 PolarHBondContact O-N 3.4Å; F40-L42 VanDerWaalsContact C-N 3.33Å; F40-L42 PolarHBondContact O-N 3.33Å; L42-T45 PolarHBondContact O-N 2.94Å; L42-S46 WeakPolarHBondContact O-CB 3.22Å; L42-S46 PolarHBondContact O-N 3.39Å; L42-S46 PolarHBondContact O-OG 3.04Å; L42-F122 HydrophobicContact CD2-CE1 4.1Å; L42-F122 HydrophobicContact CD2-CZ 3.98Å; L42-F122 HydrophobicContact CG-CE1 4.03Å; L42-F122 HydrophobicContact CG-CZ 4.42Å; L42-L126 HydrophobicContact CB-CD2 4.18Å; L42-L126 HydrophobicContact CD2-CD2 3.77Å; L42-L126 HydrophobicContact CG-CD2 3.92Å
43V98.2Very high95.6Very high0 Ų035 Ų350%018%0.184CC..Hα-helixtrans-57-52.8172.4165.50000110.7L39 F40 A41 T45 S46 R47 L126 E127L39-V43 WeakPolarHBondContact O-CG2 3.33Å; L39-V43 PolarHBondContact O-N 3.4Å; F40-V43 WeakPolarHBondContact O-CB 3.4Å; F40-V43 PolarHBondContact O-N 3.18Å; A41-V43 VanDerWaalsContact C-N 3.35Å; A41-V43 PolarHBondContact O-N 2.74Å; V43-T45 PolarHBondContact O-N 3.11Å; V43-S46 PolarHBondContact O-N 2.86Å; V43-S46 PolarHBondContact O-OG 3.1Å; V43-S46 VanDerWaalsContact O-OG 3.11Å; V43-R47 WeakPolarHBondContact O-CB 3.29Å; V43-R47 PolarHBondContact O-N 2.85Å; V43-L126 HydrophobicContact CG2-CB 3.92Å; V43-L126 HydrophobicContact CG2-CD2 3.86Å; V43-L126 HydrophobicContact CG2-CG 3.85Å; V43-E127 HydrophobicContact CG1-CB 3.84Å; V43-E127 HydrophobicContact CG1-CG 4.09Å; V43-E127 HydrophobicContact CG2-CB 3.86Å
44F97.4Very high95.2Very high3 Ų338 Ų381%0.01320%0.204CC..Hα-helixtrans-67.1-38.4-178-63-46.7000112.5H12 I16 F40 A41 Y48 Y67 I68 A71H12-F44 AromaticContact CE1-CE1 3.79Å; H12-F44 AromaticContact CE1-CZ 3.53Å; H12-F44 AromaticContact NE2-CZ 3.72Å; I16-F44 HydrophobicContact CD1-CE2 4.09Å; I16-F44 HydrophobicContact CD1-CZ 3.98Å; F40-F44 WeakPolarHBondContact O-CD2 3.47Å; F40-F44 PolarHBondContact O-N 2.61Å; F40-F44 VanDerWaalsContact O-N 3.08Å; A41-F44 PolarHBondContact O-N 3.13Å; F44-Y48 HydrophobicContact CB-CD2 3.93Å; F44-Y48 HydrophobicContact CB-CE2 3.9Å; F44-Y48 HydrophobicContact CD1-CD2 4.26Å; F44-Y48 AromaticContact CD1-CE2 3.38Å; F44-Y48 HydrophobicContact CD1-CE2 3.38Å; F44-Y48 AromaticContact CD1-CZ 3.86Å; F44-Y48 HydrophobicContact CE1-CE2 4.23Å; F44-Y48 HydrophobicContact CG-CD2 4.49Å; F44-Y48 AromaticContact CG-CE2 3.95Å; F44-Y48 HydrophobicContact CG-CE2 3.95Å; F44-Y48 VanDerWaalsContact O-CB 3.31Å; F44-Y48 WeakPolarHBondContact O-CB 3.46Å; F44-Y48 VanDerWaalsContact O-CD2 3.3Å; F44-Y48 WeakPolarHBondContact O-CD2 3.41Å; F44-Y48 PolarHBondContact O-N 3.47Å; F44-Y67 HydrophobicContact CE1-CG 4.32Å; F44-Y67 HydrophobicContact CZ-CD1 4.35Å; F44-Y67 HydrophobicContact CZ-CG 4.4Å; F44-I68 HydrophobicContact CB-CG1 4.07Å; F44-A71 HydrophobicContact CD2-CB 3.72Å; F44-A71 HydrophobicContact CE2-CB 4.12Å
45T97.6Very high94.9Very high44 Ų4445.3 Ų45.327%0.2724%0.236SC..Hα-helixtrans-62.3-45.8177.1-60.70000111.8A41 L42 V43 L49 Y72A41-T45 WeakPolarHBondContact O-CB 2.92Å; A41-T45 PolarHBondContact O-N 3.01Å; A41-T45 PolarHBondContact O-OG1 3.45Å; L42-T45 PolarHBondContact O-N 2.94Å; V43-T45 PolarHBondContact O-N 3.11Å; T45-L49 WeakPolarHBondContact O-CD2 3.48Å; T45-L49 VanDerWaalsContact O-CG 3.29Å; T45-L49 WeakPolarHBondContact O-CG 3.39Å; T45-Y72 VanDerWaalsContact OG1-CE2 3.3Å; T45-Y72 WeakPolarHBondContact OG1-CE2 3.46Å; T45-Y72 PolarHBondContact OG1-OH 3.38Å
46S97.1Very high94.6Very high10 Ų1048.1 Ų48.17%0.0725%0.253CS..Hα-helixtrans-72.5-37179.351.20000113L42 V43 S123L42-S46 WeakPolarHBondContact O-CB 3.22Å; L42-S46 PolarHBondContact O-N 3.39Å; L42-S46 PolarHBondContact O-OG 3.04Å; V43-S46 PolarHBondContact O-N 2.86Å; V43-S46 PolarHBondContact O-OG 3.1Å; V43-S46 VanDerWaalsContact O-OG 3.11Å; S46-S123 WeakPolarHBondContact OG-CB 3.29Å
47R96.9Very high94.3Very high29 Ų2950.2 Ų50.211%0.10927%0.268CS..Hα-helixtrans-70.5-36.6-178.7-170.3171.4-67.5168.1-2.5114V43 S123 E127V43-R47 WeakPolarHBondContact O-CB 3.29Å; V43-R47 PolarHBondContact O-N 2.85Å; R47-S123 WeakPolarHBondContact CB-OG 3.49Å; R47-S123 PolarHBondContact NE-OG 3.17Å; R47-S123 VanDerWaalsContact NH2-C 3.32Å; R47-S123 PolarHBondContact NH2-O 3.41Å; R47-S123 PolarHBondContact NH2-OG 3.48Å; R47-E127 IonicContact CZ-OE2 3.87Å; R47-E127 VanDerWaalsContact NH1-CD 3.3Å; R47-E127 IonicContact NH1-OE1 3.74Å; R47-E127 PolarHBondContact NH1-OE1 3.35Å; R47-E127 IonicContact NH1-OE2 3.5Å; R47-E127 PolarHBondContact NH1-OE2 2.86Å; R47-E127 IonicContact NH2-OE2 3.94Å; R47-E127 PolarHBondContact NH2-OE2 3.42Å
48Y95.6Very high94Very high31 Ų3155.8 Ų55.812%0.12230%0.297CS..THydrogen-bonded Turntrans-105.520.5-168-56.8-33.7000113.2F44 D50 L51 K64 Y67 I68F44-Y48 HydrophobicContact CB-CD2 3.93Å; F44-Y48 HydrophobicContact CB-CE2 3.9Å; F44-Y48 HydrophobicContact CD1-CD2 4.26Å; F44-Y48 AromaticContact CD1-CE2 3.38Å; F44-Y48 HydrophobicContact CD1-CE2 3.38Å; F44-Y48 AromaticContact CD1-CZ 3.86Å; F44-Y48 HydrophobicContact CE1-CE2 4.23Å; F44-Y48 HydrophobicContact CG-CD2 4.49Å; F44-Y48 AromaticContact CG-CE2 3.95Å; F44-Y48 HydrophobicContact CG-CE2 3.95Å; F44-Y48 VanDerWaalsContact O-CB 3.31Å; F44-Y48 WeakPolarHBondContact O-CB 3.46Å; F44-Y48 VanDerWaalsContact O-CD2 3.3Å; F44-Y48 WeakPolarHBondContact O-CD2 3.41Å; F44-Y48 PolarHBondContact O-N 3.47Å; Y48-D50 WeakPolarHBondContact CA-OD1 3.31Å; Y48-D50 PolarHBondContact O-N 2.97Å; Y48-L51 VanDerWaalsContact O-CB 3.23Å; Y48-L51 WeakPolarHBondContact O-CB 3.43Å; Y48-L51 WeakPolarHBondContact O-CG 3.37Å; Y48-L51 PolarHBondContact O-N 3.16Å; Y48-K64 HydrophobicContact CD1-CB 4.42Å; Y48-K64 HydrophobicContact CD1-CD 3.72Å; Y48-K64 HydrophobicContact CD1-CG 3.64Å; Y48-K64 HydrophobicContact CD2-CB 3.96Å; Y48-K64 HydrophobicContact CD2-CG 4.02Å; Y48-K64 HydrophobicContact CE1-CD 4.34Å; Y48-K64 HydrophobicContact CE1-CG 3.87Å; Y48-K64 HydrophobicContact CE2-CB 4.36Å; Y48-K64 HydrophobicContact CE2-CG 4.23Å; Y48-K64 HydrophobicContact CG-CB 4Å; Y48-K64 HydrophobicContact CG-CD 3.91Å; Y48-K64 HydrophobicContact CG-CG 3.73Å; Y48-Y67 HydrophobicContact CE2-CD2 4.14Å; Y48-I68 HydrophobicContact CD2-CD1 4.1Å; Y48-I68 HydrophobicContact CD2-CG1 3.97Å
49L93Very high93.5Very high61 Ų6156.5 Ų56.532%0.31930%0.295SS..G310 helixtrans-59.8-25.5171.6-68.7178.1000112.5T45 L51 L52 L116 L119T45-L49 WeakPolarHBondContact O-CD2 3.48Å; T45-L49 VanDerWaalsContact O-CG 3.29Å; T45-L49 WeakPolarHBondContact O-CG 3.39Å; L49-L51 PolarHBondContact O-N 2.84Å; L49-L51 VanDerWaalsContact O-N 3.12Å; L49-L52 PolarHBondContact O-N 3.41Å; L49-L52 VanDerWaalsContact O-N 3.11Å; L49-L116 HydrophobicContact CB-CD2 4.05Å; L49-L119 HydrophobicContact CD1-CB 4.42Å; L49-L119 HydrophobicContact CD1-CD1 3.41Å; L49-L119 VanDerWaalsContact CD1-CD1 3.41Å; L49-L119 HydrophobicContact CD1-CG 4.45Å
50D89.7Confident93.1Very high45 Ų4558 Ų5824%0.24130%0.303CS..G310 helixtrans-62.3-12.6173.470.9-24.5000113.6Y48 L52 T53 S54 K64Y48-D50 WeakPolarHBondContact CA-OD1 3.31Å; Y48-D50 PolarHBondContact O-N 2.97Å; D50-L52 PolarHBondContact O-N 3.04Å; D50-T53 WeakPolarHBondContact CA-OG1 3.14Å; D50-T53 PolarHBondContact O-N 3.32Å; D50-T53 VanDerWaalsContact O-N 3.08Å; D50-T53 PolarHBondContact O-OG1 3.31Å; D50-S54 PolarHBondContact O-N 3.23Å; D50-K64 IonicContact OD1-NZ 2.65Å; D50-K64 PolarHBondContact OD1-NZ 3.09Å; D50-K64 IonicContact OD2-NZ 2.68Å; D50-K64 PolarHBondContact OD2-NZ 3.32Å
51L90.6Very high92.9Very high49 Ų4959.4 Ų59.426%0.25731%0.313SS..G310 helixtrans-54.9-30.2168.3-83.1172.5000112.9Y48 L49 T61 K64 V65 I68Y48-L51 VanDerWaalsContact O-CB 3.23Å; Y48-L51 WeakPolarHBondContact O-CB 3.43Å; Y48-L51 WeakPolarHBondContact O-CG 3.37Å; Y48-L51 PolarHBondContact O-N 3.16Å; L49-L51 PolarHBondContact O-N 2.84Å; L49-L51 VanDerWaalsContact O-N 3.12Å; L51-T61 HydrophobicContact CD2-CG2 3.86Å; L51-K64 HydrophobicContact CD1-CB 3.85Å; L51-K64 HydrophobicContact CD1-CD 4.38Å; L51-K64 HydrophobicContact CD2-CB 3.98Å; L51-K64 HydrophobicContact CD2-CD 3.75Å; L51-K64 HydrophobicContact CG-CB 4.11Å; L51-K64 HydrophobicContact CG-CD 3.78Å; L51-V65 HydrophobicContact CD1-CG2 4.45Å; L51-I68 HydrophobicContact CD1-CD1 3.81Å
52L87.4Confident92.7Very high155 Ų15562.1 Ų62.181%0.81233%0.329SS*.G310 helixtrans-83.6-17.5-178.9-57179.8000112.6L49 D50L49-L52 PolarHBondContact O-N 3.41Å; L49-L52 VanDerWaalsContact O-N 3.11Å; D50-L52 PolarHBondContact O-N 3.04Å
53T87.1Confident92.4Very high89 Ų8959.9 Ų59.955%0.54632%0.317SS..THydrogen-bonded Turntrans-117.9-21.4-170.259.30000113.4D50D50-T53 WeakPolarHBondContact CA-OG1 3.14Å; D50-T53 PolarHBondContact O-N 3.32Å; D50-T53 VanDerWaalsContact O-N 3.08Å; D50-T53 PolarHBondContact O-OG1 3.31Å
54S87.7Confident92.2Very high62 Ų6260.4 Ų60.443%0.43432%0.319SS..  trans-144.7126.9-167.1-57.40000112.2D50D50-S54 PolarHBondContact O-N 3.23Å
55F91.8Very high92.2Very high154 Ų15464.3 Ų64.368%0.67534%0.343SS*.  trans-105112170.4-179.8-96.1000109.7
56I89.8Confident92.1Very high110 Ų11065.2 Ų65.256%0.56435%0.346SS*.  trans-93.2-53.3178.9-58166.3000110.1N60I56-N60 HydrophobicContact CB-CB 4.25Å
57S91.2Very high92Very high45 Ų4565.1 Ų65.132%0.31534%0.344SS..  trans-164.9160.2177.169.50000110.9Y59 N60 T61S57-Y59 VanDerWaalsContact C-N 3.26Å; S57-Y59 PolarHBondContact O-N 3.25Å; S57-N60 PolarHBondContact O-N 2.99Å; S57-N60 VanDerWaalsContact O-N 3.16Å; S57-N60 WeakPolarHBondContact OG-CB 3.13Å; S57-N60 PolarHBondContact OG-N 2.96Å; S57-N60 VanDerWaalsContact OG-N 3.15Å; S57-T61 PolarHBondContact O-N 3.04Å; S57-T61 PolarHBondContact O-OG1 3.05Å
58L92.1Very high92Very high128 Ų12865.8 Ų65.867%0.6735%0.349SS*.Hα-helixtrans-56.6-41.9175.8-179.262.6000111.8T62L58-T62 WeakPolarHBondContact O-CB 3.43Å; L58-T62 PolarHBondContact O-N 3.44Å; L58-T62 PolarHBondContact O-OG1 3.23Å
59Y87.7Confident92.1Very high91 Ų9166.3 Ų66.336%0.35736%0.364SS..Hα-helixtrans-61-47.7176.8176.9-96.9000111.7M1 S57 T62 M63M1-Y59 HydrophobicContact CE-CE1 4.36Å; S57-Y59 VanDerWaalsContact C-N 3.26Å; S57-Y59 PolarHBondContact O-N 3.25Å; Y59-T62 PolarHBondContact O-N 3.23Å; Y59-M63 HydrophobicContact CD1-CG 4.3Å; Y59-M63 HydrophobicContact CD2-CG 4.22Å; Y59-M63 HydrophobicContact CE1-CG 3.92Å; Y59-M63 HydrophobicContact CE2-CG 3.83Å; Y59-M63 HydrophobicContact CE2-SD 4.18Å; Y59-M63 HydrophobicContact CG-CG 4.44Å; Y59-M63 WeakPolarHBondContact O-CB 3.43Å; Y59-M63 VanDerWaalsContact O-CG 3.26Å; Y59-M63 WeakPolarHBondContact O-CG 3.4Å; Y59-M63 PolarHBondContact O-N 3.36Å
60N89.6Confident92.3Very high34 Ų3464.5 Ų64.518%0.18236%0.356CS..Hα-helixtrans-61.8-49.4-179.6-176.6-90.6000111.6I56 S57 T62 M63 K64I56-N60 HydrophobicContact CB-CB 4.25Å; S57-N60 PolarHBondContact O-N 2.99Å; S57-N60 VanDerWaalsContact O-N 3.16Å; S57-N60 WeakPolarHBondContact OG-CB 3.13Å; S57-N60 PolarHBondContact OG-N 2.96Å; S57-N60 VanDerWaalsContact OG-N 3.15Å; N60-T62 PolarHBondContact O-N 2.95Å; N60-M63 PolarHBondContact O-N 3.37Å; N60-K64 WeakPolarHBondContact O-CG 3.48Å; N60-K64 PolarHBondContact O-N 3.31Å; N60-K64 WeakPolarHBondContact OD1-CE 3.38Å; N60-K64 PolarHBondContact OD1-NZ 3.16Å
61T93.4Very high92.7Very high37 Ų3762.6 Ų62.623%0.22735%0.346CS..Hα-helixtrans-60.5-46.4178.6-57.50000111.1L51 S57 M63 K64 V65L51-T61 HydrophobicContact CD2-CG2 3.86Å; S57-T61 PolarHBondContact O-N 3.04Å; S57-T61 PolarHBondContact O-OG1 3.05Å; T61-M63 PolarHBondContact O-N 3.1Å; T61-K64 PolarHBondContact O-N 2.61Å; T61-V65 WeakPolarHBondContact O-CG2 3.43Å; T61-V65 PolarHBondContact O-N 3.38Å
62T93.9Very high93Very high63 Ų6365.9 Ų65.939%0.38736%0.356SS..Hα-helixtrans-61.1-46.9179.9-59.60000111.4L58 Y59 N60 K64 V65 I66L58-T62 WeakPolarHBondContact O-CB 3.43Å; L58-T62 PolarHBondContact O-N 3.44Å; L58-T62 PolarHBondContact O-OG1 3.23Å; Y59-T62 PolarHBondContact O-N 3.23Å; N60-T62 PolarHBondContact O-N 2.95Å; T62-K64 PolarHBondContact O-N 3.41Å; T62-V65 PolarHBondContact O-N 2.74Å; T62-I66 HydrophobicContact CG2-CD1 3.77Å; T62-I66 HydrophobicContact CG2-CG1 4.44Å; T62-I66 VanDerWaalsContact O-CG1 3.29Å; T62-I66 WeakPolarHBondContact O-CG1 3.42Å; T62-I66 PolarHBondContact O-N 3.04Å
63M91.9Very high93.6Very high17 Ų1760.2 Ų60.28%0.08433%0.332CS..Hα-helixtrans-62.3-43.1179.4-73.6-64.9-66.200112.2L13 Y59 N60 T61 V65 I66 Y67L13-M63 HydrophobicContact CB-CE 4.35Å; L13-M63 HydrophobicContact CD2-CE 4.08Å; L13-M63 HydrophobicContact CD2-SD 4.21Å; Y59-M63 HydrophobicContact CD1-CG 4.3Å; Y59-M63 HydrophobicContact CD2-CG 4.22Å; Y59-M63 HydrophobicContact CE1-CG 3.92Å; Y59-M63 HydrophobicContact CE2-CG 3.83Å; Y59-M63 HydrophobicContact CE2-SD 4.18Å; Y59-M63 HydrophobicContact CG-CG 4.44Å; Y59-M63 WeakPolarHBondContact O-CB 3.43Å; Y59-M63 VanDerWaalsContact O-CG 3.26Å; Y59-M63 WeakPolarHBondContact O-CG 3.4Å; Y59-M63 PolarHBondContact O-N 3.36Å; N60-M63 PolarHBondContact O-N 3.37Å; T61-M63 PolarHBondContact O-N 3.1Å; M63-V65 PolarHBondContact O-N 2.96Å; M63-I66 PolarHBondContact O-N 3.21Å; M63-Y67 HydrophobicContact CB-CE2 4.38Å; M63-Y67 HydrophobicContact CE-CE1 4.45Å; M63-Y67 HydrophobicContact CE-CE2 3.82Å; M63-Y67 WeakPolarHBondContact CE-OH 3.48Å; M63-Y67 WeakPolarHBondContact O-CD2 3.4Å; M63-Y67 PolarHBondContact O-N 3.43Å
64K94.9Very high94.1Very high11 Ų1156 Ų565%0.04831%0.306CS..Hα-helixtrans-61.4-44.5176.9-69.8178.8174.6178.50111.8Y48 D50 L51 N60 T61 T62 I66 Y67 I68Y48-K64 HydrophobicContact CD1-CB 4.42Å; Y48-K64 HydrophobicContact CD1-CD 3.72Å; Y48-K64 HydrophobicContact CD1-CG 3.64Å; Y48-K64 HydrophobicContact CD2-CB 3.96Å; Y48-K64 HydrophobicContact CD2-CG 4.02Å; Y48-K64 HydrophobicContact CE1-CD 4.34Å; Y48-K64 HydrophobicContact CE1-CG 3.87Å; Y48-K64 HydrophobicContact CE2-CB 4.36Å; Y48-K64 HydrophobicContact CE2-CG 4.23Å; Y48-K64 HydrophobicContact CG-CB 4Å; Y48-K64 HydrophobicContact CG-CD 3.91Å; Y48-K64 HydrophobicContact CG-CG 3.73Å; D50-K64 IonicContact OD1-NZ 2.65Å; D50-K64 PolarHBondContact OD1-NZ 3.09Å; D50-K64 IonicContact OD2-NZ 2.68Å; D50-K64 PolarHBondContact OD2-NZ 3.32Å; L51-K64 HydrophobicContact CD1-CB 3.85Å; L51-K64 HydrophobicContact CD1-CD 4.38Å; L51-K64 HydrophobicContact CD2-CB 3.98Å; L51-K64 HydrophobicContact CD2-CD 3.75Å; L51-K64 HydrophobicContact CG-CB 4.11Å; L51-K64 HydrophobicContact CG-CD 3.78Å; N60-K64 WeakPolarHBondContact O-CG 3.48Å; N60-K64 PolarHBondContact O-N 3.31Å; N60-K64 WeakPolarHBondContact OD1-CE 3.38Å; N60-K64 PolarHBondContact OD1-NZ 3.16Å; T61-K64 PolarHBondContact O-N 2.61Å; T62-K64 PolarHBondContact O-N 3.41Å; K64-I66 PolarHBondContact O-N 3.42Å; K64-Y67 PolarHBondContact O-N 3.27Å; K64-I68 WeakPolarHBondContact O-CG1 3.48Å; K64-I68 PolarHBondContact O-N 2.92Å
65V96Very high94.6Very high86 Ų8654.4 Ų54.452%0.52129%0.293SS..Hα-helixtrans-62.3-42.7176.6172.40000111.2L51 T61 T62 M63 G69L51-V65 HydrophobicContact CD1-CG2 4.45Å; T61-V65 WeakPolarHBondContact O-CG2 3.43Å; T61-V65 PolarHBondContact O-N 3.38Å; T62-V65 PolarHBondContact O-N 2.74Å; M63-V65 PolarHBondContact O-N 2.96Å; V65-G69 PolarHBondContact O-N 3.06Å
66I95.9Very high94.9Very high63 Ų6353.6 Ų53.632%0.32329%0.287SS..Hα-helixtrans-61.7-46.8176.3-70.2169.2000110.9L13 T62 M63 K64 G69 C70L13-I66 HydrophobicContact CD1-CG2 3.59Å; T62-I66 HydrophobicContact CG2-CD1 3.77Å; T62-I66 HydrophobicContact CG2-CG1 4.44Å; T62-I66 VanDerWaalsContact O-CG1 3.29Å; T62-I66 WeakPolarHBondContact O-CG1 3.42Å; T62-I66 PolarHBondContact O-N 3.04Å; M63-I66 PolarHBondContact O-N 3.21Å; K64-I66 PolarHBondContact O-N 3.42Å; I66-G69 PolarHBondContact O-N 3.4Å; I66-C70 WeakPolarHBondContact O-CB 3.41Å; I66-C70 PolarHBondContact O-N 2.98Å; I66-C70 PolarHBondContact O-SG 3.26Å; I66-C70 VanDerWaalsContact O-SG 3.38Å
67Y95.5Very high95.3Very high8 Ų848.8 Ų48.83%0.03126%0.262CS..Hα-helixtrans-60.8-47.5179.5-73.9-47.3000112.4D9 L13 I16 F44 Y48 M63 K64 A71D9-Y67 PolarHBondContact O-OH 3.37Å; L13-Y67 HydrophobicContact CB-CE1 4.15Å; L13-Y67 HydrophobicContact CD1-CE1 4.24Å; I16-Y67 HydrophobicContact CD1-CD1 3.45Å; I16-Y67 VanDerWaalsContact CD1-CD1 3.45Å; I16-Y67 HydrophobicContact CD1-CE1 3.76Å; F44-Y67 HydrophobicContact CE1-CG 4.32Å; F44-Y67 HydrophobicContact CZ-CD1 4.35Å; F44-Y67 HydrophobicContact CZ-CG 4.4Å; Y48-Y67 HydrophobicContact CE2-CD2 4.14Å; M63-Y67 HydrophobicContact CB-CE2 4.38Å; M63-Y67 HydrophobicContact CE-CE1 4.45Å; M63-Y67 HydrophobicContact CE-CE2 3.82Å; M63-Y67 WeakPolarHBondContact CE-OH 3.48Å; M63-Y67 WeakPolarHBondContact O-CD2 3.4Å; M63-Y67 PolarHBondContact O-N 3.43Å; K64-Y67 PolarHBondContact O-N 3.27Å; Y67-A71 VanDerWaalsContact O-CB 3.26Å; Y67-A71 WeakPolarHBondContact O-CB 3.22Å; Y67-A71 PolarHBondContact O-N 2.92Å
68I97Very high95.5Very high43 Ų4346.6 Ų46.622%0.22125%0.247CC..Hα-helixtrans-60.4-52.3176.3-65.5167.6000109.7F44 Y48 L51 K64 C70 A71 Y72F44-I68 HydrophobicContact CB-CG1 4.07Å; Y48-I68 HydrophobicContact CD2-CD1 4.1Å; Y48-I68 HydrophobicContact CD2-CG1 3.97Å; L51-I68 HydrophobicContact CD1-CD1 3.81Å; K64-I68 WeakPolarHBondContact O-CG1 3.48Å; K64-I68 PolarHBondContact O-N 2.92Å; I68-C70 PolarHBondContact O-N 3.23Å; I68-A71 PolarHBondContact O-N 3.21Å; I68-Y72 HydrophobicContact CG2-CD2 3.71Å; I68-Y72 HydrophobicContact CG2-CE2 3.87Å; I68-Y72 WeakPolarHBondContact O-CD2 3.44Å; I68-Y72 PolarHBondContact O-N 2.91Å
69G97.9Very high95.8Very high42 Ų4244 Ų4443%0.43323%0.229SC..Hα-helixtrans-57.2-47.2-177.800000112.6V65 I66 A73V65-G69 PolarHBondContact O-N 3.06Å; I66-G69 PolarHBondContact O-N 3.4Å; G69-A73 WeakPolarHBondContact O-CB 3.38Å; G69-A73 PolarHBondContact O-N 3.24Å
70C97.4Very high96.3Very high22 Ų2242.3 Ų42.315%0.14923%0.234CC..Hα-helixtrans-68.5-36.4178.4-69.80000113.1I16 I66 I68 A73 T74I16-C70 HydrophobicContact CG2-CB 3.34Å; I66-C70 WeakPolarHBondContact O-CB 3.41Å; I66-C70 PolarHBondContact O-N 2.98Å; I66-C70 PolarHBondContact O-SG 3.26Å; I66-C70 VanDerWaalsContact O-SG 3.38Å; I68-C70 PolarHBondContact O-N 3.23Å; C70-A73 PolarHBondContact O-N 3.23Å; C70-T74 WeakPolarHBondContact O-CB 3.29Å; C70-T74 PolarHBondContact O-N 3.41Å; C70-T74 PolarHBondContact O-OG1 2.72Å
71A97.4Very high96.6Very high5 Ų545.1 Ų45.14%0.04125%0.245CC..Hα-helixtrans-65-50177.200000111.4A41 F44 Y67 I68 A73 T74 V75A41-A71 HydrophobicContact CB-CB 4.09Å; F44-A71 HydrophobicContact CD2-CB 3.72Å; F44-A71 HydrophobicContact CE2-CB 4.12Å; Y67-A71 VanDerWaalsContact O-CB 3.26Å; Y67-A71 WeakPolarHBondContact O-CB 3.22Å; Y67-A71 PolarHBondContact O-N 2.92Å; I68-A71 PolarHBondContact O-N 3.21Å; A71-A73 VanDerWaalsContact C-N 3.35Å; A71-A73 PolarHBondContact O-N 3.36Å; A71-T74 PolarHBondContact O-N 2.88Å; A71-V75 WeakPolarHBondContact O-CG2 3.48Å; A71-V75 PolarHBondContact O-N 3.15Å
72Y98.3Very high96.8Very high118 Ų11844.4 Ų44.446%0.46324%0.238SC..Hα-helixtrans-65.1-37.2176-82-84.5000112.4T45 I68 T74 V75 Y76T45-Y72 VanDerWaalsContact OG1-CE2 3.3Å; T45-Y72 WeakPolarHBondContact OG1-CE2 3.46Å; T45-Y72 PolarHBondContact OG1-OH 3.38Å; I68-Y72 HydrophobicContact CG2-CD2 3.71Å; I68-Y72 HydrophobicContact CG2-CE2 3.87Å; I68-Y72 WeakPolarHBondContact O-CD2 3.44Å; I68-Y72 PolarHBondContact O-N 2.91Å; Y72-T74 VanDerWaalsContact C-N 3.34Å; Y72-T74 PolarHBondContact O-N 3.35Å; Y72-V75 PolarHBondContact O-N 3.47Å; Y72-Y76 WeakPolarHBondContact O-CB 3.24Å; Y72-Y76 PolarHBondContact O-N 3.43Å
73A98.1Very high96.8Very high36 Ų3647.9 Ų47.930%0.29825%0.248SC..Hα-helixtrans-60.3-44.217300000111.3L20 G69 C70 A71 Y76 L77L20-A73 HydrophobicContact CD1-CB 3.96Å; G69-A73 WeakPolarHBondContact O-CB 3.38Å; G69-A73 PolarHBondContact O-N 3.24Å; C70-A73 PolarHBondContact O-N 3.23Å; A71-A73 VanDerWaalsContact C-N 3.35Å; A71-A73 PolarHBondContact O-N 3.36Å; A73-Y76 WeakPolarHBondContact O-CB 3.35Å; A73-Y76 PolarHBondContact O-N 2.99Å; A73-L77 VanDerWaalsContact O-CG 3.29Å; A73-L77 WeakPolarHBondContact O-CG 3.3Å; A73-L77 PolarHBondContact O-N 3.47Å
74T97.6Very high97Very high2 Ų252.2 Ų52.21%0.01229%0.287CS..Hα-helixtrans-62-46.3177.5-56.70000111.2L19 L20 I23 Q37 C70 A71 Y72 Y76 L77 I78L19-T74 HydrophobicContact CD2-CG2 3.98Å; L19-T74 HydrophobicContact CG-CG2 4.32Å; L20-T74 WeakPolarHBondContact CD1-OG1 3.5Å; I23-T74 HydrophobicContact CD1-CG2 3.95Å; Q37-T74 HydrophobicContact CB-CG2 4.39Å; Q37-T74 HydrophobicContact CG-CG2 3.91Å; C70-T74 WeakPolarHBondContact O-CB 3.29Å; C70-T74 PolarHBondContact O-N 3.41Å; C70-T74 PolarHBondContact O-OG1 2.72Å; A71-T74 PolarHBondContact O-N 2.88Å; Y72-T74 VanDerWaalsContact C-N 3.34Å; Y72-T74 PolarHBondContact O-N 3.35Å; T74-Y76 VanDerWaalsContact C-N 3.34Å; T74-Y76 PolarHBondContact O-N 2.99Å; T74-L77 PolarHBondContact O-N 2.82Å; T74-I78 HydrophobicContact CG2-CD1 4.04Å; T74-I78 WeakPolarHBondContact O-CG1 3.38Å; T74-I78 PolarHBondContact O-N 3.33Å
75V98.3Very high97Very high27 Ų2754 Ų5416%0.16430%0.299CS..Hα-helixtrans-58.8-45.1175.1172.40000111.1Q37 I38 A41 A71 Y72 L77 I78 Y79Q37-V75 HydrophobicContact CB-CG2 4.04Å; I38-V75 HydrophobicContact CG1-CG1 4.2Å; I38-V75 HydrophobicContact CG1-CG2 4.3Å; A41-V75 HydrophobicContact CB-CG2 4.16Å; A71-V75 WeakPolarHBondContact O-CG2 3.48Å; A71-V75 PolarHBondContact O-N 3.15Å; Y72-V75 PolarHBondContact O-N 3.47Å; V75-L77 PolarHBondContact O-N 2.63Å; V75-I78 PolarHBondContact O-N 3.49Å; V75-Y79 HydrophobicContact CG1-CD2 3.95Å; V75-Y79 HydrophobicContact CG1-CE2 4.49Å; V75-Y79 PolarHBondContact O-N 3.15Å
76Y98.4Very high97Very high137 Ų13752.1 Ų52.154%0.53728%0.283SS..Hα-helixtrans-61-42.2175.8168.8-98.2000112.3Y72 A73 T74 I78 A80 K81Y72-Y76 WeakPolarHBondContact O-CB 3.24Å; Y72-Y76 PolarHBondContact O-N 3.43Å; A73-Y76 WeakPolarHBondContact O-CB 3.35Å; A73-Y76 PolarHBondContact O-N 2.99Å; T74-Y76 VanDerWaalsContact C-N 3.34Å; T74-Y76 PolarHBondContact O-N 2.99Å; Y76-I78 VanDerWaalsContact C-N 3.3Å; Y76-I78 PolarHBondContact O-N 3.17Å; Y76-A80 HydrophobicContact CD2-CB 3.73Å; Y76-A80 HydrophobicContact CE2-CB 3.7Å; Y76-A80 WeakPolarHBondContact O-CA 3.49Å; Y76-A80 WeakPolarHBondContact O-CB 3.48Å; Y76-A80 PolarHBondContact O-N 2.8Å; Y76-K81 HydrophobicContact CE1-CB 3.99Å; Y76-K81 HydrophobicContact CE1-CD 4.25Å; Y76-K81 PolarHBondContact O-N 3.38Å
77L97.9Very high96.7Very high9 Ų951.4 Ų51.45%0.04728%0.28CS..Iπ-helixtrans-62.6-38.4177.5-69.9-173.9000111.8L20 I23 W24 A73 T74 V75 K81 F82L20-L77 HydrophobicContact CD1-CD1 3.67Å; L20-L77 HydrophobicContact CG-CD1 4.47Å; I23-L77 HydrophobicContact CB-CD1 4.25Å; I23-L77 HydrophobicContact CG2-CB 3.81Å; I23-L77 HydrophobicContact CG2-CD1 3.9Å; I23-L77 HydrophobicContact CG2-CG 4.47Å; W24-L77 HydrophobicContact CE3-CD1 4.4Å; W24-L77 HydrophobicContact CE3-CD2 4.05Å; W24-L77 HydrophobicContact CZ3-CD2 4.22Å; A73-L77 VanDerWaalsContact O-CG 3.29Å; A73-L77 WeakPolarHBondContact O-CG 3.3Å; A73-L77 PolarHBondContact O-N 3.47Å; T74-L77 PolarHBondContact O-N 2.82Å; V75-L77 PolarHBondContact O-N 2.63Å; L77-K81 HydrophobicContact CD2-CB 4Å; L77-K81 HydrophobicContact CD2-CD 3.7Å; L77-K81 HydrophobicContact CD2-CG 4.33Å; L77-F82 HydrophobicContact CB-CD2 4.13Å; L77-F82 HydrophobicContact CD2-CD2 4.19Å; L77-F82 HydrophobicContact CD2-CE2 3.82Å; L77-F82 HydrophobicContact CG-CE2 4.5Å; L77-F82 WeakPolarHBondContact O-CA 3.16Å; L77-F82 WeakPolarHBondContact O-CB 3.09Å; L77-F82 PolarHBondContact O-N 3.04Å
78I97.3Very high96.5Very high0 Ų052.7 Ų52.70%030%0.295CS..Iπ-helixtrans-74.8-52-179.2-64.6169.7000111.5I23 C29 I32 Q37 T74 V75 Y76 K83 Y86I23-I78 HydrophobicContact CD1-CD1 4.36Å; I23-I78 HydrophobicContact CD1-CG1 4.18Å; C29-I78 HydrophobicContact CB-CG1 3.88Å; I32-I78 HydrophobicContact CG2-CD1 3.93Å; Q37-I78 HydrophobicContact CB-CD1 4.12Å; Q37-I78 HydrophobicContact CG-CD1 3.63Å; T74-I78 HydrophobicContact CG2-CD1 4.04Å; T74-I78 WeakPolarHBondContact O-CG1 3.38Å; T74-I78 PolarHBondContact O-N 3.33Å; V75-I78 PolarHBondContact O-N 3.49Å; Y76-I78 VanDerWaalsContact C-N 3.3Å; Y76-I78 PolarHBondContact O-N 3.17Å; I78-K83 VanDerWaalsContact O-CA 3.22Å; I78-K83 WeakPolarHBondContact O-CA 3.34Å; I78-K83 PolarHBondContact O-N 3.42Å; I78-Y86 HydrophobicContact CG2-CD2 3.62Å; I78-Y86 HydrophobicContact CG2-CE2 4.13Å; I78-Y86 HydrophobicContact CG2-CG 4Å
79Y97.6Very high96.2Very high72 Ų7257.3 Ų57.328%0.28232%0.321SS..Iπ-helixtrans-92-14.5-169.5-71.6-77.1000114.9G34 K35 I38 V75 K83 Y86G34-Y79 WeakPolarHBondContact CA-OH 3.37Å; G34-Y79 PolarHBondContact O-OH 3.04Å; K35-Y79 PolarHBondContact N-OH 3.13Å; I38-Y79 HydrophobicContact CD1-CD2 4.31Å; I38-Y79 HydrophobicContact CD1-CE2 3.45Å; I38-Y79 VanDerWaalsContact CD1-CE2 3.45Å; I38-Y79 WeakPolarHBondContact CD1-OH 3.4Å; I38-Y79 HydrophobicContact CG1-CE2 3.8Å; V75-Y79 HydrophobicContact CG1-CD2 3.95Å; V75-Y79 HydrophobicContact CG1-CE2 4.49Å; V75-Y79 PolarHBondContact O-N 3.15Å; Y79-K83 WeakPolarHBondContact O-CD 3.35Å; Y79-Y86 HydrophobicContact CD1-CE1 4.48Å; Y79-Y86 HydrophobicContact CE1-CD1 4.39Å; Y79-Y86 AromaticContact CE1-CE1 3.82Å; Y79-Y86 HydrophobicContact CE1-CE1 3.82Å
80A97Very high95.8Very high57 Ų5758.8 Ų58.847%0.47132%0.316SS..Iπ-helixtrans-118.9-67177.400000111.8Y76Y76-A80 HydrophobicContact CD2-CB 3.73Å; Y76-A80 HydrophobicContact CE2-CB 3.7Å; Y76-A80 WeakPolarHBondContact O-CA 3.49Å; Y76-A80 WeakPolarHBondContact O-CB 3.48Å; Y76-A80 PolarHBondContact O-N 2.8Å
81K96.8Very high95.7Very high92 Ų9257.8 Ų57.840%0.431%0.309SS..Iπ-helixtrans-69.5-43.6-166.5-170.1165.3-172.7159.80114.3W24 Y76 L77W24-K81 VanDerWaalsContact CH2-NZ 3.34Å; W24-K81 HydrophobicContact CZ3-CD 4.18Å; W24-K81 VanDerWaalsContact CZ3-NZ 3.3Å; Y76-K81 HydrophobicContact CE1-CB 3.99Å; Y76-K81 HydrophobicContact CE1-CD 4.25Å; Y76-K81 PolarHBondContact O-N 3.38Å; L77-K81 HydrophobicContact CD2-CB 4Å; L77-K81 HydrophobicContact CD2-CD 3.7Å; L77-K81 HydrophobicContact CD2-CG 4.33Å
82F96.9Very high95.6Very high22 Ų2260.3 Ų60.310%0.09632%0.324CS..THydrogen-bonded Turntrans-116.426.5-178.8-55.4-60.1000112.3I23 R27 C29 L77 A84 T85I23-F82 HydrophobicContact CG2-CD2 3.57Å; I23-F82 HydrophobicContact CG2-CE2 4.01Å; R27-F82 HydrophobicContact CB-CD1 4.3Å; R27-F82 HydrophobicContact CB-CE1 3.76Å; R27-F82 HydrophobicContact CB-CZ 4.23Å; R27-F82 VanDerWaalsContact CD-CZ 3.5Å; R27-F82 HydrophobicContact CG-CE1 4.31Å; R27-F82 HydrophobicContact CG-CZ 4.49Å; R27-F82 VanDerWaalsContact O-CD1 3.24Å; R27-F82 WeakPolarHBondContact O-CD1 3.44Å; C29-F82 PolarHBondContact SG-O 3.38Å; L77-F82 HydrophobicContact CB-CD2 4.13Å; L77-F82 HydrophobicContact CD2-CD2 4.19Å; L77-F82 HydrophobicContact CD2-CE2 3.82Å; L77-F82 HydrophobicContact CG-CE2 4.5Å; L77-F82 WeakPolarHBondContact O-CA 3.16Å; L77-F82 WeakPolarHBondContact O-CB 3.09Å; L77-F82 PolarHBondContact O-N 3.04Å; F82-A84 PolarHBondContact O-N 3.38Å; F82-T85 PolarHBondContact O-N 2.9Å; F82-T85 PolarHBondContact O-OG1 3.24Å
83K95.4Very high95.5Very high136 Ų13656.6 Ų56.659%0.59131%0.31SS*.G310 helixtrans-50.5-34.3-179.4-172.7-174.2-179.1177.80113.6I78 Y79 T85 Y86I78-K83 VanDerWaalsContact O-CA 3.22Å; I78-K83 WeakPolarHBondContact O-CA 3.34Å; I78-K83 PolarHBondContact O-N 3.42Å; Y79-K83 WeakPolarHBondContact O-CD 3.35Å; K83-T85 PolarHBondContact O-N 3.44Å; K83-T85 VanDerWaalsContact O-N 3.16Å; K83-Y86 WeakPolarHBondContact O-CB 3.31Å; K83-Y86 PolarHBondContact O-N 3.37Å; K83-Y86 VanDerWaalsContact O-N 3.09Å
84A96Very high95.4Very high109 Ų10961.9 Ų61.990%0.90132%0.323SS*.G310 helixtrans-60.8-23.2178.700000113.9F82F82-A84 PolarHBondContact O-N 3.38Å
85T94.6Very high95.3Very high49 Ų4963.3 Ų63.330%0.30133%0.331SS..G310 helixtrans-99.9-1.7179.263.10000113.3S28 C29 A30 F82 K83S28-T85 WeakPolarHBondContact CA-OG1 3.34Å; C29-T85 PolarHBondContact N-OG1 3.02Å; C29-T85 PolarHBondContact SG-OG1 2.98Å; A30-T85 PolarHBondContact N-O 3.48Å; F82-T85 PolarHBondContact O-N 2.9Å; F82-T85 PolarHBondContact O-OG1 3.24Å; K83-T85 PolarHBondContact O-N 3.44Å; K83-T85 VanDerWaalsContact O-N 3.16Å
86Y95.4Very high95.3Very high45 Ų4566.9 Ų66.918%0.17635%0.346CS..  trans-77.5123.8-180172-118.9000110.4I78 Y79 K83 G88 D91I78-Y86 HydrophobicContact CG2-CD2 3.62Å; I78-Y86 HydrophobicContact CG2-CE2 4.13Å; I78-Y86 HydrophobicContact CG2-CG 4Å; Y79-Y86 HydrophobicContact CD1-CE1 4.48Å; Y79-Y86 HydrophobicContact CE1-CD1 4.39Å; Y79-Y86 AromaticContact CE1-CE1 3.82Å; Y79-Y86 HydrophobicContact CE1-CE1 3.82Å; K83-Y86 WeakPolarHBondContact O-CB 3.31Å; K83-Y86 PolarHBondContact O-N 3.37Å; K83-Y86 VanDerWaalsContact O-N 3.09Å; Y86-G88 PolarHBondContact O-N 3.1Å; Y86-D91 HydrophobicContact CE2-CB 4.12Å; Y86-D91 WeakPolarHBondContact CE2-OD2 3.31Å; Y86-D91 WeakPolarHBondContact OH-CB 3.37Å; Y86-D91 PolarHBondContact OH-OD2 3.42Å
87D91Very high95.1Very high48 Ų4866.3 Ų66.326%0.25735%0.347SS..  trans-92.576.6-177.3-170.4-8.8000111.7N89 H90 D91 M137D87-N89 PolarHBondContact O-N 3.23Å; D87-N89 PolarHBondContact OD1-N 3.24Å; D87-H90 PolarHBondContact O-N 3.45Å; D87-H90 IonicContact OD1-CG 2.97Å; D87-H90 PolarHBondContact OD1-N 3.05Å; D87-H90 IonicContact OD1-ND1 3.62Å; D87-H90 PolarHBondContact OD1-ND1 3.39Å; D87-H90 IonicContact OD2-CE1 3.13Å; D87-H90 IonicContact OD2-CG 2.7Å; D87-H90 IonicContact OD2-ND1 3.86Å; D87-H90 PolarHBondContact OD2-ND1 2.94Å; D87-D91 PolarHBondContact O-N 3.32Å; D87-D91 VanDerWaalsContact O-N 3.1Å; D87-M137 HydrophobicContact CB-CE 3.8Å
88G90.2Very high95.1Very high35 Ų3566.7 Ų66.736%0.36135%0.349SS..THydrogen-bonded Turntrans-65.3-21.1177.900000114.2Y86Y86-G88 PolarHBondContact O-N 3.1Å
89N90.6Very high95.1Very high141 Ų14168.8 Ų68.875%0.75436%0.362SS*.THydrogen-bonded Turntrans-72.9-31.6179.4-69.5-25.9000111.8D87 T92D87-N89 PolarHBondContact O-N 3.23Å; D87-N89 PolarHBondContact OD1-N 3.24Å; N89-T92 WeakPolarHBondContact O-CG2 3.36Å
90H90.3Very high95.1Very high72 Ų7270.4 Ų70.433%0.33338%0.378SS..THydrogen-bonded Turntrans-92.2-27.2174.8-64.794.7000112.7D87 T92 M137 T141D87-H90 PolarHBondContact O-N 3.45Å; D87-H90 IonicContact OD1-CG 2.97Å; D87-H90 PolarHBondContact OD1-N 3.05Å; D87-H90 IonicContact OD1-ND1 3.62Å; D87-H90 PolarHBondContact OD1-ND1 3.39Å; D87-H90 IonicContact OD2-CE1 3.13Å; D87-H90 IonicContact OD2-CG 2.7Å; D87-H90 IonicContact OD2-ND1 3.86Å; D87-H90 PolarHBondContact OD2-ND1 2.94Å; H90-T92 PolarHBondContact O-N 2.86Å; H90-T92 PolarHBondContact O-OG1 2.84Å; H90-M137 HydrophobicContact CB-CE 4.24Å; H90-M137 HydrophobicContact CB-CG 4.21Å; H90-T141 HydrophobicContact CB-CG2 3.82Å
91D94.4Very high95.1Very high2 Ų271.3 Ų71.31%0.01138%0.38CS..  trans-7859175-163.614.8000112.8S33 G34 K35 Y86 D87 M137S33-D91 WeakPolarHBondContact CA-OD2 3.29Å; S33-D91 WeakPolarHBondContact CB-OD1 3.28Å; S33-D91 VanDerWaalsContact OG-CG 3.23Å; S33-D91 PolarHBondContact OG-OD1 2.91Å; S33-D91 PolarHBondContact OG-OD2 3.44Å; G34-D91 PolarHBondContact N-OD2 2.79Å; K35-D91 WeakPolarHBondContact CD-O 3.43Å; K35-D91 VanDerWaalsContact CE-O 3.26Å; K35-D91 WeakPolarHBondContact CE-O 3.17Å; K35-D91 PolarHBondContact N-OD2 2.84Å; K35-D91 VanDerWaalsContact N-OD2 3.1Å; K35-D91 PolarHBondContact NZ-O 3.46Å; Y86-D91 HydrophobicContact CE2-CB 4.12Å; Y86-D91 WeakPolarHBondContact CE2-OD2 3.31Å; Y86-D91 WeakPolarHBondContact OH-CB 3.37Å; Y86-D91 PolarHBondContact OH-OD2 3.42Å; D87-D91 PolarHBondContact O-N 3.32Å; D87-D91 VanDerWaalsContact O-N 3.1Å; D91-M137 HydrophobicContact CB-SD 4.25Å
92T95.4Very high95.1Very high57 Ų5767.6 Ų67.635%0.3537%0.365SS..  trans-96.44-169.543.50000114.8N89 H90 R94 K140N89-T92 WeakPolarHBondContact O-CG2 3.36Å; H90-T92 PolarHBondContact O-N 2.86Å; H90-T92 PolarHBondContact O-OG1 2.84Å; T92-R94 PolarHBondContact O-N 2.91Å; T92-K140 PolarHBondContact OG1-NZ 2.98Å
93F95.6Very high95.1Very high40 Ų4067.4 Ų67.418%0.17537%0.369CS..  trans-61.6134.4179.5-167.3-81.3000111.3K35 V95 L98 L132 P133 F136K35-F93 VanDerWaalsContact CD-O 3.23Å; K35-F93 WeakPolarHBondContact CD-O 3.45Å; K35-F93 WeakPolarHBondContact CE-O 3.49Å; K35-F93 PolarHBondContact NZ-O 3.24Å; F93-V95 HydrophobicContact CD1-CG1 4.4Å; F93-V95 PolarHBondContact O-N 2.62Å; F93-L98 HydrophobicContact CD1-CD1 4.37Å; F93-L98 HydrophobicContact CE1-CD1 3.53Å; F93-L98 HydrophobicContact CE1-CD2 4.22Å; F93-L98 HydrophobicContact CE1-CG 3.71Å; F93-L98 HydrophobicContact CZ-CD1 4.06Å; F93-L98 HydrophobicContact CZ-CD2 4.16Å; F93-L98 HydrophobicContact CZ-CG 4.16Å; F93-L132 HydrophobicContact CE2-CB 4.19Å; F93-L132 HydrophobicContact CZ-CB 4.13Å; F93-L132 HydrophobicContact CZ-CD1 4.46Å; F93-P133 HydrophobicContact CB-CB 3.92Å; F93-P133 HydrophobicContact CB-CG 4.25Å; F93-P133 HydrophobicContact CD1-CB 4.4Å; F93-P133 HydrophobicContact CD1-CG 3.8Å; F93-P133 HydrophobicContact CE1-CG 4.45Å; F93-P133 HydrophobicContact CG-CB 4.21Å; F93-P133 HydrophobicContact CG-CG 4.08Å; F93-F136 HydrophobicContact CB-CD1 4.01Å; F93-F136 HydrophobicContact CB-CG 4.47Å; F93-F136 HydrophobicContact CD2-CB 3.81Å; F93-F136 HydrophobicContact CD2-CD1 4.14Å; F93-F136 HydrophobicContact CD2-CD2 4.23Å; F93-F136 AromaticContact CD2-CG 3.81Å; F93-F136 HydrophobicContact CD2-CG 3.81Å
94R96.6Very high95.2Very high148 Ų14862.5 Ų62.556%0.55836%0.357SS*.  trans-88.997.4-179.7-74.3-174.163.7-170.23.7110.3T92 E96 F97T92-R94 PolarHBondContact O-N 2.91Å; R94-E96 WeakPolarHBondContact CA-OE2 3.36Å; R94-E96 WeakPolarHBondContact CB-OE2 3.2Å; R94-E96 IonicContact NE-OE2 2.71Å; R94-E96 PolarHBondContact O-N 3.44Å; R94-F97 HydrophobicContact CB-CD2 3.51Å; R94-F97 HydrophobicContact CB-CE2 3.72Å; R94-F97 HydrophobicContact CG-CE2 4.34Å; R94-F97 PolarHBondContact O-N 3.05Å
95V96.6Very high95.3Very high32 Ų3261.1 Ų61.119%0.19433%0.334CS..THydrogen-bonded Turntrans-67.6-17.7-173.7-66.70000113.5K35 L39 F93 F97 L98 V99 P133K35-V95 HydrophobicContact CB-CG1 3.85Å; K35-V95 HydrophobicContact CD-CG1 4.09Å; K35-V95 HydrophobicContact CG-CG1 4.14Å; L39-V95 HydrophobicContact CD1-CG1 4.15Å; L39-V95 HydrophobicContact CD2-CB 4.41Å; L39-V95 HydrophobicContact CD2-CG1 4.5Å; L39-V95 HydrophobicContact CG-CG1 4.44Å; F93-V95 HydrophobicContact CD1-CG1 4.4Å; F93-V95 PolarHBondContact O-N 2.62Å; V95-F97 PolarHBondContact O-N 3.04Å; V95-L98 PolarHBondContact O-N 2.9Å; V95-V99 PolarHBondContact O-N 3.18Å; V95-P133 HydrophobicContact CG1-CG 4.13Å
96E96.3Very high95.4Very high101 Ų10158.8 Ų58.847%0.47232%0.32SS..Hα-helixtrans-60.5-35.3176.7-53.180.8-177.700111R94 L98 V100R94-E96 WeakPolarHBondContact CA-OE2 3.36Å; R94-E96 WeakPolarHBondContact CB-OE2 3.2Å; R94-E96 IonicContact NE-OE2 2.71Å; R94-E96 PolarHBondContact O-N 3.44Å; E96-L98 PolarHBondContact O-N 3.45Å; E96-V100 WeakPolarHBondContact O-CB 3.15Å; E96-V100 WeakPolarHBondContact O-CG2 3.46Å; E96-V100 PolarHBondContact O-N 2.93Å
97F96.1Very high95.4Very high125 Ų12562.3 Ų62.355%0.54834%0.336SS..Hα-helixtrans-70.1-8.7175.3-63.6-57.4000114R94 V95 P101R94-F97 HydrophobicContact CB-CD2 3.51Å; R94-F97 HydrophobicContact CB-CE2 3.72Å; R94-F97 HydrophobicContact CG-CE2 4.34Å; R94-F97 PolarHBondContact O-N 3.05Å; V95-F97 PolarHBondContact O-N 3.04Å; F97-P101 WeakPolarHBondContact O-CD 3.38Å; F97-P101 VanDerWaalsContact O-CG 3.31Å; F97-P101 WeakPolarHBondContact O-CG 3.44Å
98L96.6Very high95.7Very high17 Ų1767 Ų679%0.08936%0.36CS..Hα-helixtrans-100.2-54170.2-56.9179.8000110L39 F93 V95 E96 V100 P101 V102 V129 L132L39-L98 HydrophobicContact CD1-CD1 3.95Å; F93-L98 HydrophobicContact CD1-CD1 4.37Å; F93-L98 HydrophobicContact CE1-CD1 3.53Å; F93-L98 HydrophobicContact CE1-CD2 4.22Å; F93-L98 HydrophobicContact CE1-CG 3.71Å; F93-L98 HydrophobicContact CZ-CD1 4.06Å; F93-L98 HydrophobicContact CZ-CD2 4.16Å; F93-L98 HydrophobicContact CZ-CG 4.16Å; V95-L98 PolarHBondContact O-N 2.9Å; E96-L98 PolarHBondContact O-N 3.45Å; L98-V100 PolarHBondContact O-N 3.47Å; L98-P101 WeakPolarHBondContact O-CD 3.45Å; L98-V102 WeakPolarHBondContact O-CB 3.33Å; L98-V102 WeakPolarHBondContact O-CG2 3.47Å; L98-V102 PolarHBondContact O-N 3.3Å; L98-V129 HydrophobicContact CB-CG2 4.19Å; L98-V129 HydrophobicContact CD1-CB 4.43Å; L98-V129 HydrophobicContact CD1-CG2 4.3Å; L98-V129 HydrophobicContact CD2-CB 4.15Å; L98-V129 HydrophobicContact CD2-CG2 4.15Å; L98-V129 HydrophobicContact CG-CG2 4.43Å; L98-L132 HydrophobicContact CD1-CB 4.31Å; L98-L132 HydrophobicContact CD1-CD1 4.31Å; L98-L132 HydrophobicContact CD2-CD1 3.78Å
99V97.3Very high96Very high45 Ų4568.7 Ų68.727%0.27336%0.364SS..Hα-helixtrans-64.2-41.6-171.6177.80000111.9L39 V95 G103 F122 L126L39-V99 HydrophobicContact CD2-CG2 3.77Å; V95-V99 PolarHBondContact O-N 3.18Å; V99-G103 PolarHBondContact O-N 3.2Å; V99-F122 HydrophobicContact CG1-CE2 4.45Å; V99-F122 HydrophobicContact CG1-CZ 4.35Å; V99-L126 HydrophobicContact CG2-CD1 4.25Å
100V97.4Very high96.3Very high105 Ų10563.6 Ų63.664%0.63634%0.336SS*.Hα-helixtrans-69.4-51.3-177.9176.20000111.8E96 L98 V102 G103 G104E96-V100 WeakPolarHBondContact O-CB 3.15Å; E96-V100 WeakPolarHBondContact O-CG2 3.46Å; E96-V100 PolarHBondContact O-N 2.93Å; L98-V100 PolarHBondContact O-N 3.47Å; V100-V102 PolarHBondContact O-N 3.24Å; V100-G103 PolarHBondContact O-N 2.89Å; V100-G104 PolarHBondContact O-N 3.01Å
101P97.6Very high96.4Very high76 Ų7664.4 Ų64.449%0.49434%0.34SS..Hα-helixtrans-63.9-39.1177-25.938.2000113.1F97 L98 G104 L105F97-P101 WeakPolarHBondContact O-CD 3.38Å; F97-P101 VanDerWaalsContact O-CG 3.31Å; F97-P101 WeakPolarHBondContact O-CG 3.44Å; L98-P101 WeakPolarHBondContact O-CD 3.45Å; P101-G104 PolarHBondContact O-N 2.95Å; P101-L105 VanDerWaalsContact O-CB 3.31Å; P101-L105 WeakPolarHBondContact O-CB 3.26Å; P101-L105 PolarHBondContact O-N 2.93Å
102V97.3Very high96.4Very high15 Ų1569.6 Ų69.69%0.09137%0.368CS..Hα-helixtrans-65.2-40.9176.6166.50000111.4L98 V100 L105 A106 F122 L126 V129L98-V102 WeakPolarHBondContact O-CB 3.33Å; L98-V102 WeakPolarHBondContact O-CG2 3.47Å; L98-V102 PolarHBondContact O-N 3.3Å; V100-V102 PolarHBondContact O-N 3.24Å; V102-L105 PolarHBondContact O-N 3.25Å; V102-A106 WeakPolarHBondContact O-CB 3.34Å; V102-A106 PolarHBondContact O-N 2.97Å; V102-F122 HydrophobicContact CG1-CD2 3.71Å; V102-F122 HydrophobicContact CG1-CE2 3.88Å; V102-L126 HydrophobicContact CG1-CB 3.93Å; V102-L126 HydrophobicContact CG1-CD1 4.47Å; V102-V129 HydrophobicContact CG2-CG2 4.1Å
103G97.2Very high96.4Very high17 Ų1774.3 Ų74.318%0.17538%0.384CS..Hα-helixtrans-59.3-51.8172.900000111.6V99 V100 L105 A106 F107V99-G103 PolarHBondContact O-N 3.2Å; V100-G103 PolarHBondContact O-N 2.89Å; G103-L105 VanDerWaalsContact C-N 3.34Å; G103-L105 PolarHBondContact O-N 2.9Å; G103-A106 PolarHBondContact O-N 3.28Å; G103-F107 WeakPolarHBondContact O-CD2 3.37Å; G103-F107 PolarHBondContact O-N 3.48Å; G103-F107 VanDerWaalsContact O-N 3.13Å
104G97.4Very high96.3Very high34 Ų3474.6 Ų74.635%0.35139%0.391SS..Hα-helixtrans-57.2-46176.100000112.6V100 P101 A106 F107 L108V100-G104 PolarHBondContact O-N 3.01Å; P101-G104 PolarHBondContact O-N 2.95Å; G104-A106 PolarHBondContact O-N 3.29Å; G104-F107 PolarHBondContact O-N 3.41Å; G104-L108 VanDerWaalsContact O-CG 3.29Å; G104-L108 WeakPolarHBondContact O-CG 3.42Å; G104-L108 PolarHBondContact O-N 3.46Å
105L97Very high96.2Very high80 Ų8072.6 Ų72.642%0.41940%0.397SS..Hα-helixtrans-63.5-39.5178.8-173.364.7000112.3P101 V102 G103 F107 L108 V109 Y125P101-L105 VanDerWaalsContact O-CB 3.31Å; P101-L105 WeakPolarHBondContact O-CB 3.26Å; P101-L105 PolarHBondContact O-N 2.93Å; V102-L105 PolarHBondContact O-N 3.25Å; G103-L105 VanDerWaalsContact C-N 3.34Å; G103-L105 PolarHBondContact O-N 2.9Å; L105-F107 VanDerWaalsContact C-N 3.31Å; L105-F107 PolarHBondContact O-N 2.81Å; L105-L108 PolarHBondContact O-N 3.04Å; L105-V109 HydrophobicContact CD1-CB 4.16Å; L105-V109 HydrophobicContact CD1-CG2 3.81Å; L105-V109 PolarHBondContact O-N 3.06Å; L105-Y125 HydrophobicContact CB-CD2 4.25Å; L105-Y125 HydrophobicContact CB-CE2 4.28Å; L105-Y125 HydrophobicContact CD2-CD1 4.42Å; L105-Y125 HydrophobicContact CD2-CD2 3.95Å; L105-Y125 HydrophobicContact CD2-CE1 4.37Å; L105-Y125 HydrophobicContact CD2-CE2 3.9Å; L105-Y125 HydrophobicContact CD2-CG 4.24Å; L105-Y125 HydrophobicContact CG-CD2 3.98Å; L105-Y125 HydrophobicContact CG-CE2 3.66Å
106A96.9Very high96.1Very high0 Ų075.3 Ų75.30%041%0.41CS..Hα-helixtrans-64.8-33.9176.700000112.9V102 G103 G104 N110 T121 F122 Y125V102-A106 WeakPolarHBondContact O-CB 3.34Å; V102-A106 PolarHBondContact O-N 2.97Å; G103-A106 PolarHBondContact O-N 3.28Å; G104-A106 PolarHBondContact O-N 3.29Å; A106-N110 PolarHBondContact O-ND2 3.49Å; A106-T121 HydrophobicContact CB-CG2 4.15Å; A106-F122 HydrophobicContact CB-CB 3.71Å; A106-Y125 HydrophobicContact CB-CD2 4.15Å; A106-Y125 HydrophobicContact CB-CE2 4.44Å
107F96Very high96Very high119 Ų11972.7 Ų72.752%0.52240%0.398SS..Hα-helixtrans-72.1-34.7173.5-91.2-91.6000112.9G103 G104 L105 N110 F113 I118G103-F107 WeakPolarHBondContact O-CD2 3.37Å; G103-F107 PolarHBondContact O-N 3.48Å; G103-F107 VanDerWaalsContact O-N 3.13Å; G104-F107 PolarHBondContact O-N 3.41Å; L105-F107 VanDerWaalsContact C-N 3.31Å; L105-F107 PolarHBondContact O-N 2.81Å; F107-N110 PolarHBondContact O-ND2 3.42Å; F107-F113 HydrophobicContact CD1-CE2 4.24Å; F107-F113 HydrophobicContact CD1-CZ 4.25Å; F107-I118 HydrophobicContact CD1-CD1 4.16Å; F107-I118 HydrophobicContact CD1-CG2 4.45Å; F107-I118 HydrophobicContact CD2-CG2 3.9Å; F107-I118 HydrophobicContact CE1-CD1 4.14Å; F107-I118 HydrophobicContact CE1-CG2 4.43Å; F107-I118 HydrophobicContact CE2-CG2 3.88Å; F107-I118 HydrophobicContact CG-CG2 4.2Å; F107-I118 HydrophobicContact CZ-CG2 4.16Å
108L96.8Very high96.1Very high145 Ų14567.4 Ų67.476%0.75938%0.375SS*.Hα-helixtrans-86.6-33.9-176.5-65.9173.7000113.6G104 L105G104-L108 VanDerWaalsContact O-CG 3.29Å; G104-L108 WeakPolarHBondContact O-CG 3.42Å; G104-L108 PolarHBondContact O-N 3.46Å; L105-L108 PolarHBondContact O-N 3.04Å
109V96.8Very high96.1Very high71 Ų7169.7 Ų69.743%0.4339%0.387SS..SBendtrans-131.389.6-172.7-173.70000109.1L105 T121 Y125L105-V109 HydrophobicContact CD1-CB 4.16Å; L105-V109 HydrophobicContact CD1-CG2 3.81Å; L105-V109 PolarHBondContact O-N 3.06Å; V109-T121 WeakPolarHBondContact O-CG2 3.25Å; V109-Y125 PolarHBondContact O-OH 3.28Å
110N95.9Very high96.1Very high34 Ų3470.7 Ų70.718%0.18239%0.386CS..  trans-135.8168.9176.649.673.2000109.9A106 F107 D112 F113 T121A106-N110 PolarHBondContact O-ND2 3.49Å; F107-N110 PolarHBondContact O-ND2 3.42Å; N110-D112 PolarHBondContact OD1-O 2.95Å; N110-F113 PolarHBondContact OD1-N 2.91Å; N110-T121 HydrophobicContact CB-CG2 4.24Å
111H92.5Very high96.1Very high89 Ų8965.7 Ų65.741%0.41236%0.356SS..SBendtrans-75.1-43.9175.3-65.9-55.8000111.9E117 W120 D177H111-E117 HydrophobicContact CB-CG 4.34Å; H111-E117 IonicContact CD2-OE1 3.99Å; H111-E117 PolarHBondContact CD2-OE1 3.25Å; H111-E117 IonicContact CG-OE1 3.98Å; H111-W120 AromaticContact CD2-CZ3 3.9Å; H111-D177 IonicContact CE1-OD1 2.76Å; H111-D177 PolarHBondContact CE1-OD1 3.11Å; H111-D177 IonicContact NE2-OD1 3.75Å; H111-D177 PolarHBondContact NE2-OD1 3.38Å; H111-D177 IonicContact NE2-OD2 2.65Å
112D94.3Very high96.1Very high111 Ų11163.2 Ų63.259%0.59434%0.337SS*.SBendtrans-139.2142.4177.7-74-46.4000111.3N110 S114 E117N110-D112 PolarHBondContact OD1-O 2.95Å; D112-S114 PolarHBondContact O-N 3.4Å; D112-E117 HydrophobicContact CB-CB 4.4Å; D112-E117 HydrophobicContact CB-CG 4.11Å; D112-E117 WeakPolarHBondContact O-CB 3.25Å; D112-E117 WeakPolarHBondContact O-CG 3.35Å
113F95.6Very high96.2Very high156 Ų15662.5 Ų62.568%0.68433%0.333SS*.SBendtrans-81.360.8179.5-157.1-100.2000112F107 N110 I118F107-F113 HydrophobicContact CD1-CE2 4.24Å; F107-F113 HydrophobicContact CD1-CZ 4.25Å; N110-F113 PolarHBondContact OD1-N 2.91Å; F113-I118 HydrophobicContact CD2-CD1 3.95Å; F113-I118 HydrophobicContact CE2-CD1 3.93Å; F113-I118 HydrophobicContact CG-CD1 4.32Å; F113-I118 HydrophobicContact CZ-CD1 4.28Å
114S95.2Very high96.2Very high47 Ų4762.8 Ų62.833%0.32933%0.33SS..SBendtrans-118.4150.4174.479.10000111.1D112 L116 E117 I118D112-S114 PolarHBondContact O-N 3.4Å; S114-L116 VanDerWaalsContact C-N 3.3Å; S114-L116 PolarHBondContact O-N 3.06Å; S114-E117 PolarHBondContact O-N 3.46Å; S114-E117 VanDerWaalsContact OG-CB 3.24Å; S114-E117 WeakPolarHBondContact OG-CB 3.42Å; S114-E117 PolarHBondContact OG-N 3.39Å; S114-I118 VanDerWaalsContact O-CG1 3.31Å; S114-I118 WeakPolarHBondContact O-CG1 3.41Å; S114-I118 PolarHBondContact O-N 3.26Å
115P94.5Very high96.2Very high106 Ų10662.3 Ų62.369%0.68832%0.318SS*.Hα-helixtrans-56.6-40.5-177.6-27.635.3000114L119P115-L119 WeakPolarHBondContact O-CB 3.06Å; P115-L119 WeakPolarHBondContact O-CD1 3.32Å; P115-L119 VanDerWaalsContact O-CG 3.24Å; P115-L119 WeakPolarHBondContact O-CG 2.77Å; P115-L119 PolarHBondContact O-N 2.94Å; P115-L119 VanDerWaalsContact O-N 3.11Å
116L94Very high96.3Very high89 Ų8958.5 Ų58.547%0.46630%0.298SS..Hα-helixtrans-69.1-40.7179.3-70.5176.5000111.8L49 S114 L119 W120L49-L116 HydrophobicContact CB-CD2 4.05Å; S114-L116 VanDerWaalsContact C-N 3.3Å; S114-L116 PolarHBondContact O-N 3.06Å; L116-L119 PolarHBondContact O-N 3.35Å; L116-W120 WeakPolarHBondContact O-CB 3.4Å; L116-W120 PolarHBondContact O-N 3.01Å
117E94.6Very high96.3Very high46 Ų4658.6 Ų58.622%0.21530%0.298CS..Hα-helixtrans-71.3-37.4-179.5-17060.4-155.600112.1H111 D112 S114 W120 T121H111-E117 HydrophobicContact CB-CG 4.34Å; H111-E117 IonicContact CD2-OE1 3.99Å; H111-E117 PolarHBondContact CD2-OE1 3.25Å; H111-E117 IonicContact CG-OE1 3.98Å; D112-E117 HydrophobicContact CB-CB 4.4Å; D112-E117 HydrophobicContact CB-CG 4.11Å; D112-E117 WeakPolarHBondContact O-CB 3.25Å; D112-E117 WeakPolarHBondContact O-CG 3.35Å; S114-E117 PolarHBondContact O-N 3.46Å; S114-E117 VanDerWaalsContact OG-CB 3.24Å; S114-E117 WeakPolarHBondContact OG-CB 3.42Å; S114-E117 PolarHBondContact OG-N 3.39Å; E117-W120 PolarHBondContact O-N 3.19Å; E117-T121 VanDerWaalsContact O-CB 3.29Å; E117-T121 WeakPolarHBondContact O-CB 3.4Å; E117-T121 PolarHBondContact O-N 3.23Å; E117-T121 PolarHBondContact O-OG1 2.85Å
118I97.1Very high96.3Very high13 Ų1353.4 Ų53.47%0.06728%0.277CS..Hα-helixtrans-63.3-43.2173.1-67.3167.8000110.2F107 F113 S114 T121 F122F107-I118 HydrophobicContact CD1-CD1 4.16Å; F107-I118 HydrophobicContact CD1-CG2 4.45Å; F107-I118 HydrophobicContact CD2-CG2 3.9Å; F107-I118 HydrophobicContact CE1-CD1 4.14Å; F107-I118 HydrophobicContact CE1-CG2 4.43Å; F107-I118 HydrophobicContact CE2-CG2 3.88Å; F107-I118 HydrophobicContact CG-CG2 4.2Å; F107-I118 HydrophobicContact CZ-CG2 4.16Å; F113-I118 HydrophobicContact CD2-CD1 3.95Å; F113-I118 HydrophobicContact CE2-CD1 3.93Å; F113-I118 HydrophobicContact CG-CD1 4.32Å; F113-I118 HydrophobicContact CZ-CD1 4.28Å; S114-I118 VanDerWaalsContact O-CG1 3.31Å; S114-I118 WeakPolarHBondContact O-CG1 3.41Å; S114-I118 PolarHBondContact O-N 3.26Å; I118-T121 PolarHBondContact O-N 2.92Å; I118-F122 VanDerWaalsContact O-CB 3.23Å; I118-F122 WeakPolarHBondContact O-CB 3.35Å; I118-F122 PolarHBondContact O-N 3Å
119L97Very high96.2Very high65 Ų6547.6 Ų47.634%0.3425%0.247SC..Hα-helixtrans-68.6-37177.6-72.7168.9000112.4L49 P115 L116 S123L49-L119 HydrophobicContact CD1-CB 4.42Å; L49-L119 HydrophobicContact CD1-CD1 3.41Å; L49-L119 VanDerWaalsContact CD1-CD1 3.41Å; L49-L119 HydrophobicContact CD1-CG 4.45Å; P115-L119 WeakPolarHBondContact O-CB 3.06Å; P115-L119 WeakPolarHBondContact O-CD1 3.32Å; P115-L119 VanDerWaalsContact O-CG 3.24Å; P115-L119 WeakPolarHBondContact O-CG 2.77Å; P115-L119 PolarHBondContact O-N 2.94Å; P115-L119 VanDerWaalsContact O-N 3.11Å; L116-L119 PolarHBondContact O-N 3.35Å; L119-S123 PolarHBondContact O-N 2.93Å
120W97.1Very high96.2Very high66 Ų6644.2 Ų44.225%0.2523%0.227CC..Hα-helixtrans-62.2-50171.8179.489.8000110.9H111 L116 E117 F122 S123 I124 D177 I179H111-W120 AromaticContact CD2-CZ3 3.9Å; L116-W120 WeakPolarHBondContact O-CB 3.4Å; L116-W120 PolarHBondContact O-N 3.01Å; E117-W120 PolarHBondContact O-N 3.19Å; W120-F122 PolarHBondContact O-N 3.44Å; W120-S123 WeakPolarHBondContact O-CB 3.46Å; W120-S123 PolarHBondContact O-N 3.42Å; W120-S123 VanDerWaalsContact O-N 3.08Å; W120-S123 PolarHBondContact O-OG 3.08Å; W120-I124 HydrophobicContact CD2-CG1 4.15Å; W120-I124 HydrophobicContact CE3-CG1 4.24Å; W120-I124 HydrophobicContact CH2-CD1 4.29Å; W120-I124 HydrophobicContact CH2-CG1 3.9Å; W120-I124 HydrophobicContact CZ2-CD1 3.87Å; W120-I124 HydrophobicContact CZ2-CG1 3.82Å; W120-I124 HydrophobicContact CZ3-CG1 4.12Å; W120-I124 WeakPolarHBondContact O-CG1 3.4Å; W120-I124 PolarHBondContact O-N 3.31Å; W120-I124 VanDerWaalsContact O-N 3.11Å; W120-D177 WeakPolarHBondContact CH2-OD2 3.45Å; W120-I179 HydrophobicContact CZ3-CG2 4.49Å
121T97.4Very high96.2Very high0 Ų042.6 Ų42.60%022%0.218CC..Hα-helixtrans-59.6-45.2177.8-60.60000111.4A106 V109 N110 E117 I118 S123 I124 Y125 I179A106-T121 HydrophobicContact CB-CG2 4.15Å; V109-T121 WeakPolarHBondContact O-CG2 3.25Å; N110-T121 HydrophobicContact CB-CG2 4.24Å; E117-T121 VanDerWaalsContact O-CB 3.29Å; E117-T121 WeakPolarHBondContact O-CB 3.4Å; E117-T121 PolarHBondContact O-N 3.23Å; E117-T121 PolarHBondContact O-OG1 2.85Å; I118-T121 PolarHBondContact O-N 2.92Å; T121-S123 VanDerWaalsContact C-N 3.29Å; T121-S123 PolarHBondContact O-N 3.47Å; T121-I124 WeakPolarHBondContact O-CB 3.35Å; T121-I124 PolarHBondContact O-N 3.02Å; T121-I124 VanDerWaalsContact O-N 3.09Å; T121-Y125 HydrophobicContact CG2-CD2 3.9Å; T121-Y125 HydrophobicContact CG2-CE2 3.35Å; T121-Y125 PolarHBondContact O-N 3.1Å; T121-I179 HydrophobicContact CG2-CD1 4.3Å; T121-I179 HydrophobicContact CG2-CG2 4.23Å
122F98.3Very high96.3Very high25 Ų2540.3 Ų40.311%0.1121%0.209CC..Hα-helixtrans-54.7-45.6173.2170.1-100.4000111.6L42 V99 V102 A106 I118 W120 I124 Y125 L126L42-F122 HydrophobicContact CD2-CE1 4.1Å; L42-F122 HydrophobicContact CD2-CZ 3.98Å; L42-F122 HydrophobicContact CG-CE1 4.03Å; L42-F122 HydrophobicContact CG-CZ 4.42Å; V99-F122 HydrophobicContact CG1-CE2 4.45Å; V99-F122 HydrophobicContact CG1-CZ 4.35Å; V102-F122 HydrophobicContact CG1-CD2 3.71Å; V102-F122 HydrophobicContact CG1-CE2 3.88Å; A106-F122 HydrophobicContact CB-CB 3.71Å; I118-F122 VanDerWaalsContact O-CB 3.23Å; I118-F122 WeakPolarHBondContact O-CB 3.35Å; I118-F122 PolarHBondContact O-N 3Å; W120-F122 PolarHBondContact O-N 3.44Å; F122-I124 VanDerWaalsContact C-N 3.29Å; F122-I124 PolarHBondContact O-N 3Å; F122-Y125 PolarHBondContact O-N 2.98Å; F122-L126 HydrophobicContact CE1-CD2 3.79Å; F122-L126 HydrophobicContact CZ-CD2 3.7Å; F122-L126 WeakPolarHBondContact O-CB 2.77Å; F122-L126 PolarHBondContact O-N 3.42Å
123S98.1Very high96.3Very high0 Ų035 Ų350%018%0.18CC..Hα-helixtrans-61.9-37.1178.485.20000112.3S46 R47 L119 W120 T121 E127S46-S123 WeakPolarHBondContact OG-CB 3.29Å; R47-S123 WeakPolarHBondContact CB-OG 3.49Å; R47-S123 PolarHBondContact NE-OG 3.17Å; R47-S123 VanDerWaalsContact NH2-C 3.32Å; R47-S123 PolarHBondContact NH2-O 3.41Å; R47-S123 PolarHBondContact NH2-OG 3.48Å; L119-S123 PolarHBondContact O-N 2.93Å; W120-S123 WeakPolarHBondContact O-CB 3.46Å; W120-S123 PolarHBondContact O-N 3.42Å; W120-S123 VanDerWaalsContact O-N 3.08Å; W120-S123 PolarHBondContact O-OG 3.08Å; T121-S123 VanDerWaalsContact C-N 3.29Å; T121-S123 PolarHBondContact O-N 3.47Å; S123-E127 VanDerWaalsContact O-CB 3.28Å; S123-E127 WeakPolarHBondContact O-CB 3.49Å; S123-E127 PolarHBondContact O-N 3Å
124I97.4Very high96.2Very high22 Ų2227.6 Ų27.611%0.11315%0.148CC..Hα-helixtrans-67.3-50.8-179.8-66.1-69.7000110.2W120 T121 F122 S128 I179 A183W120-I124 HydrophobicContact CD2-CG1 4.15Å; W120-I124 HydrophobicContact CE3-CG1 4.24Å; W120-I124 HydrophobicContact CH2-CD1 4.29Å; W120-I124 HydrophobicContact CH2-CG1 3.9Å; W120-I124 HydrophobicContact CZ2-CD1 3.87Å; W120-I124 HydrophobicContact CZ2-CG1 3.82Å; W120-I124 HydrophobicContact CZ3-CG1 4.12Å; W120-I124 WeakPolarHBondContact O-CG1 3.4Å; W120-I124 PolarHBondContact O-N 3.31Å; W120-I124 VanDerWaalsContact O-N 3.11Å; T121-I124 WeakPolarHBondContact O-CB 3.35Å; T121-I124 PolarHBondContact O-N 3.02Å; T121-I124 VanDerWaalsContact O-N 3.09Å; F122-I124 VanDerWaalsContact C-N 3.29Å; F122-I124 PolarHBondContact O-N 3Å; I124-S128 PolarHBondContact O-N 3.15Å; I124-I179 HydrophobicContact CG2-CG2 4.08Å; I124-A183 HydrophobicContact CG2-CB 3.52Å
125Y97.9Very high95.9Very high25 Ų2527.2 Ų27.210%0.09814%0.142CC..Hα-helixtrans-63-44176.5-66.5-28.8000111.8L105 A106 V109 T121 F122 E127 S128 I179 A183L105-Y125 HydrophobicContact CB-CD2 4.25Å; L105-Y125 HydrophobicContact CB-CE2 4.28Å; L105-Y125 HydrophobicContact CD2-CD1 4.42Å; L105-Y125 HydrophobicContact CD2-CD2 3.95Å; L105-Y125 HydrophobicContact CD2-CE1 4.37Å; L105-Y125 HydrophobicContact CD2-CE2 3.9Å; L105-Y125 HydrophobicContact CD2-CG 4.24Å; L105-Y125 HydrophobicContact CG-CD2 3.98Å; L105-Y125 HydrophobicContact CG-CE2 3.66Å; A106-Y125 HydrophobicContact CB-CD2 4.15Å; A106-Y125 HydrophobicContact CB-CE2 4.44Å; V109-Y125 PolarHBondContact O-OH 3.28Å; T121-Y125 HydrophobicContact CG2-CD2 3.9Å; T121-Y125 HydrophobicContact CG2-CE2 3.35Å; T121-Y125 PolarHBondContact O-N 3.1Å; F122-Y125 PolarHBondContact O-N 2.98Å; Y125-E127 PolarHBondContact O-N 3.46Å; Y125-S128 WeakPolarHBondContact O-CB 3.33Å; Y125-S128 PolarHBondContact O-N 3.26Å; Y125-S128 PolarHBondContact O-OG 3.39Å; Y125-I179 HydrophobicContact CD1-CG2 4.48Å; Y125-I179 HydrophobicContact CE1-CG2 3.67Å; Y125-A183 HydrophobicContact CD1-CB 4.2Å
126L98.1Very high95.7Very high0 Ų025.5 Ų25.50%012%0.124CC..Hα-helixtrans-65.1-41.4-177.3-174.664.7000111.7L39 L42 V43 V99 V102 F122 S128 V129 A130L39-L126 HydrophobicContact CD2-CD1 4.24Å; L42-L126 HydrophobicContact CB-CD2 4.18Å; L42-L126 HydrophobicContact CD2-CD2 3.77Å; L42-L126 HydrophobicContact CG-CD2 3.92Å; V43-L126 HydrophobicContact CG2-CB 3.92Å; V43-L126 HydrophobicContact CG2-CD2 3.86Å; V43-L126 HydrophobicContact CG2-CG 3.85Å; V99-L126 HydrophobicContact CG2-CD1 4.25Å; V102-L126 HydrophobicContact CG1-CB 3.93Å; V102-L126 HydrophobicContact CG1-CD1 4.47Å; F122-L126 HydrophobicContact CE1-CD2 3.79Å; F122-L126 HydrophobicContact CZ-CD2 3.7Å; F122-L126 WeakPolarHBondContact O-CB 2.77Å; F122-L126 PolarHBondContact O-N 3.42Å; L126-S128 PolarHBondContact O-N 3.14Å; L126-V129 WeakPolarHBondContact O-CG2 3.43Å; L126-V129 PolarHBondContact O-N 2.86Å; L126-A130 WeakPolarHBondContact O-CB 3.21Å; L126-A130 PolarHBondContact O-N 3.34Å
127E97.4Very high95.5Very high2 Ų221.3 Ų21.31%0.00910%0.102CC..Hα-helixtrans-60.9-34.4178.8-168-177.5-161.400112.3H12 F40 V43 R47 S123 Y125 V129 A130 Y158 R159 Q187H12-E127 IonicContact CE1-OE1 2.79Å; F40-E127 HydrophobicContact CE1-CG 4.45Å; V43-E127 HydrophobicContact CG1-CB 3.84Å; V43-E127 HydrophobicContact CG1-CG 4.09Å; V43-E127 HydrophobicContact CG2-CB 3.86Å; R47-E127 IonicContact CZ-OE2 3.87Å; R47-E127 VanDerWaalsContact NH1-CD 3.3Å; R47-E127 IonicContact NH1-OE1 3.74Å; R47-E127 PolarHBondContact NH1-OE1 3.35Å; R47-E127 IonicContact NH1-OE2 3.5Å; R47-E127 PolarHBondContact NH1-OE2 2.86Å; R47-E127 IonicContact NH2-OE2 3.94Å; R47-E127 PolarHBondContact NH2-OE2 3.42Å; S123-E127 VanDerWaalsContact O-CB 3.28Å; S123-E127 WeakPolarHBondContact O-CB 3.49Å; S123-E127 PolarHBondContact O-N 3Å; Y125-E127 PolarHBondContact O-N 3.46Å; E127-V129 PolarHBondContact O-N 3.08Å; E127-A130 PolarHBondContact O-N 3.35Å; E127-Y158 PolarHBondContact OE1-OH 2.76Å; E127-R159 IonicContact OE1-CZ 4Å; E127-R159 IonicContact OE1-NE 3.49Å; E127-R159 IonicContact OE1-NH2 2.74Å; E127-R159 PolarHBondContact OE1-NH2 3.45Å; E127-R159 IonicContact OE2-CZ 3.43Å; E127-R159 IonicContact OE2-NH2 3.76Å; E127-R159 PolarHBondContact OE2-NH2 3.29Å; E127-Q187 PolarHBondContact O-NE2 3.4Å
128S95.5Very high95.2Very high9 Ų919.7 Ų19.76%0.0639%0.094CC..Hα-helixtrans-60.7-31.4179.974.90000112.7I124 Y125 L126 A183 L190I124-S128 PolarHBondContact O-N 3.15Å; Y125-S128 WeakPolarHBondContact O-CB 3.33Å; Y125-S128 PolarHBondContact O-N 3.26Å; Y125-S128 PolarHBondContact O-OG 3.39Å; L126-S128 PolarHBondContact O-N 3.14Å; S128-A183 VanDerWaalsContact CB-O 3.25Å; S128-A183 WeakPolarHBondContact CB-O 3.36Å; S128-L190 WeakPolarHBondContact O-CD1 3.48Å
129V96.6Very high94.5Very high23 Ų2322 Ų2214%0.13911%0.112CC..Hα-helixtrans-111.2-4-177.2-64.20000114L98 V102 L126 E127 I131 L132 L190L98-V129 HydrophobicContact CB-CG2 4.19Å; L98-V129 HydrophobicContact CD1-CB 4.43Å; L98-V129 HydrophobicContact CD1-CG2 4.3Å; L98-V129 HydrophobicContact CD2-CB 4.15Å; L98-V129 HydrophobicContact CD2-CG2 4.15Å; L98-V129 HydrophobicContact CG-CG2 4.43Å; V102-V129 HydrophobicContact CG2-CG2 4.1Å; L126-V129 WeakPolarHBondContact O-CG2 3.43Å; L126-V129 PolarHBondContact O-N 2.86Å; E127-V129 PolarHBondContact O-N 3.08Å; V129-I131 PolarHBondContact O-N 3.45Å; V129-L132 HydrophobicContact CB-CD1 3.87Å; V129-L132 HydrophobicContact CB-CG 4.41Å; V129-L132 HydrophobicContact CG1-CD1 4.19Å; V129-L132 WeakPolarHBondContact O-CB 3.3Å; V129-L132 WeakPolarHBondContact O-CG 3.36Å; V129-L132 PolarHBondContact O-N 3.25Å; V129-L190 HydrophobicContact CG1-CD1 4.46Å
130A96.8Very high93.9Very high0 Ų024 Ų240%012%0.118CC..THydrogen-bonded Turntrans-61-22-17400000114.1S36 L39 F40 L126 E127 P133S36-A130 WeakPolarHBondContact CA-O 3.35Å; S36-A130 VanDerWaalsContact CB-O 3.29Å; S36-A130 WeakPolarHBondContact CB-O 3.15Å; S36-A130 PolarHBondContact OG-O 2.86Å; L39-A130 HydrophobicContact CB-CB 3.8Å; L39-A130 HydrophobicContact CD1-CB 4.49Å; F40-A130 HydrophobicContact CD1-CB 3.83Å; F40-A130 HydrophobicContact CE1-CB 3.6Å; F40-A130 HydrophobicContact CE2-CB 4.48Å; F40-A130 HydrophobicContact CG-CB 4.36Å; F40-A130 HydrophobicContact CZ-CB 3.95Å; L126-A130 WeakPolarHBondContact O-CB 3.21Å; L126-A130 PolarHBondContact O-N 3.34Å; E127-A130 PolarHBondContact O-N 3.35Å; A130-P133 WeakPolarHBondContact O-CD 3.38Å
131I94.7Very high93.3Very high0 Ų023.4 Ų23.40%012%0.121CC..THydrogen-bonded Turntrans-81.7-14.2178.8-16063.1000113.9F40 V129 Q134 L135 L152 L155 Y191F40-I131 HydrophobicContact CE2-CD1 3.99Å; F40-I131 HydrophobicContact CZ-CB 4.26Å; F40-I131 HydrophobicContact CZ-CD1 4.07Å; V129-I131 PolarHBondContact O-N 3.45Å; I131-Q134 HydrophobicContact CD1-CB 3.9Å; I131-Q134 HydrophobicContact CD1-CG 4.21Å; I131-Q134 HydrophobicContact CG1-CB 4.42Å; I131-Q134 WeakPolarHBondContact O-CB 3.23Å; I131-Q134 PolarHBondContact O-N 3.25Å; I131-L135 HydrophobicContact CG1-CD1 4.5Å; I131-L135 HydrophobicContact CG1-CG 4.21Å; I131-L135 HydrophobicContact CG2-CD1 3.88Å; I131-L135 HydrophobicContact CG2-CG 4.44Å; I131-L135 PolarHBondContact O-N 3.04Å; I131-L152 HydrophobicContact CD1-CD2 3.69Å; I131-L152 HydrophobicContact CG1-CD2 4.18Å; I131-L155 HydrophobicContact CD1-CD2 3.87Å; I131-Y191 WeakPolarHBondContact CB-OH 3.35Å; I131-Y191 HydrophobicContact CG1-CE1 3.88Å; I131-Y191 VanDerWaalsContact CG1-OH 3.3Å; I131-Y191 WeakPolarHBondContact CG1-OH 3.41Å; I131-Y191 HydrophobicContact CG2-CE1 4.43Å; I131-Y191 HydrophobicContact CG2-CE2 4.12Å
132L93.9Very high92.1Very high41 Ų4124.7 Ų24.722%0.21514%0.135CC..Hα-helixtrans-55.2-43.4-175.3-70.9177000114F93 L98 V129 Q134 L135 F136 L190F93-L132 HydrophobicContact CE2-CB 4.19Å; F93-L132 HydrophobicContact CZ-CB 4.13Å; F93-L132 HydrophobicContact CZ-CD1 4.46Å; L98-L132 HydrophobicContact CD1-CB 4.31Å; L98-L132 HydrophobicContact CD1-CD1 4.31Å; L98-L132 HydrophobicContact CD2-CD1 3.78Å; V129-L132 HydrophobicContact CB-CD1 3.87Å; V129-L132 HydrophobicContact CB-CG 4.41Å; V129-L132 HydrophobicContact CG1-CD1 4.19Å; V129-L132 WeakPolarHBondContact O-CB 3.3Å; V129-L132 WeakPolarHBondContact O-CG 3.36Å; V129-L132 PolarHBondContact O-N 3.25Å; L132-Q134 VanDerWaalsContact C-N 3.32Å; L132-Q134 PolarHBondContact O-N 2.95Å; L132-L135 PolarHBondContact O-N 3.13Å; L132-F136 VanDerWaalsContact O-CB 3.25Å; L132-F136 WeakPolarHBondContact O-CB 3.47Å; L132-F136 PolarHBondContact O-N 3.41Å; L132-L190 HydrophobicContact CD2-CD1 3.91Å; L132-L190 HydrophobicContact CD2-CD2 3.83Å; L132-L190 HydrophobicContact CD2-CG 4.43Å; L132-L190 HydrophobicContact CG-CD1 4.18Å
133P95Very high90.7Very high0 Ų028.6 Ų28.60%015%0.153CC..Hα-helixtrans-56.6-41.7174.5-25.433.3000113.8S33 K35 S36 L39 F93 V95 A130 F136 M137S33-P133 VanDerWaalsContact OG-CB 3.27Å; S33-P133 WeakPolarHBondContact OG-CB 3.27Å; K35-P133 HydrophobicContact CB-CB 3.83Å; K35-P133 HydrophobicContact CB-CG 4.17Å; S36-P133 WeakPolarHBondContact OG-CB 3.49Å; S36-P133 WeakPolarHBondContact OG-CD 3.31Å; L39-P133 HydrophobicContact CD1-CG 4.04Å; F93-P133 HydrophobicContact CB-CB 3.92Å; F93-P133 HydrophobicContact CB-CG 4.25Å; F93-P133 HydrophobicContact CD1-CB 4.4Å; F93-P133 HydrophobicContact CD1-CG 3.8Å; F93-P133 HydrophobicContact CE1-CG 4.45Å; F93-P133 HydrophobicContact CG-CB 4.21Å; F93-P133 HydrophobicContact CG-CG 4.08Å; V95-P133 HydrophobicContact CG1-CG 4.13Å; A130-P133 WeakPolarHBondContact O-CD 3.38Å; P133-F136 PolarHBondContact O-N 2.86Å; P133-M137 WeakPolarHBondContact O-CB 3.36Å; P133-M137 PolarHBondContact O-N 3.45Å
134Q93.3Very high89.4Confident0 Ų029.2 Ų29.20%016%0.159CC..Hα-helixtrans-66.2-44.2177.1-17864.57100112.6G31 S36 I131 L132 F136 M137 I138 L152G31-Q134 PolarHBondContact O-NE2 3.24Å; S36-Q134 PolarHBondContact OG-N 3.33Å; I131-Q134 HydrophobicContact CD1-CB 3.9Å; I131-Q134 HydrophobicContact CD1-CG 4.21Å; I131-Q134 HydrophobicContact CG1-CB 4.42Å; I131-Q134 WeakPolarHBondContact O-CB 3.23Å; I131-Q134 PolarHBondContact O-N 3.25Å; L132-Q134 VanDerWaalsContact C-N 3.32Å; L132-Q134 PolarHBondContact O-N 2.95Å; Q134-F136 VanDerWaalsContact C-N 3.34Å; Q134-M137 PolarHBondContact O-N 2.86Å; Q134-I138 HydrophobicContact CG-CD1 4.2Å; Q134-I138 WeakPolarHBondContact O-CG1 3.36Å; Q134-I138 PolarHBondContact O-N 3.36Å; Q134-L152 HydrophobicContact CG-CD2 4.23Å
135L89.4Confident88.3Confident39 Ų3932.8 Ų32.820%0.20418%0.175CC..Hα-helixtrans-64.6-41.7177.1-65.5173.2000111I131 L132 M137 I138 S139 F194I131-L135 HydrophobicContact CG1-CD1 4.5Å; I131-L135 HydrophobicContact CG1-CG 4.21Å; I131-L135 HydrophobicContact CG2-CD1 3.88Å; I131-L135 HydrophobicContact CG2-CG 4.44Å; I131-L135 PolarHBondContact O-N 3.04Å; L132-L135 PolarHBondContact O-N 3.13Å; L135-M137 PolarHBondContact O-N 3.09Å; L135-I138 PolarHBondContact O-N 3.25Å; L135-S139 PolarHBondContact O-N 3.37Å; L135-F194 HydrophobicContact CD2-CB 4.39Å
136F90.2Very high86.9Confident71 Ų7135.4 Ų35.431%0.31119%0.194SC..Hα-helixtrans-62.2-43175.9-174.7-101.1000111.9F93 L132 P133 Q134 S139 K140F93-F136 HydrophobicContact CB-CD1 4.01Å; F93-F136 HydrophobicContact CB-CG 4.47Å; F93-F136 HydrophobicContact CD2-CB 3.81Å; F93-F136 HydrophobicContact CD2-CD1 4.14Å; F93-F136 HydrophobicContact CD2-CD2 4.23Å; F93-F136 AromaticContact CD2-CG 3.81Å; F93-F136 HydrophobicContact CD2-CG 3.81Å; L132-F136 VanDerWaalsContact O-CB 3.25Å; L132-F136 WeakPolarHBondContact O-CB 3.47Å; L132-F136 PolarHBondContact O-N 3.41Å; P133-F136 PolarHBondContact O-N 2.86Å; Q134-F136 VanDerWaalsContact C-N 3.34Å; F136-S139 PolarHBondContact O-N 3.11Å; F136-S139 PolarHBondContact O-OG 3.44Å; F136-K140 HydrophobicContact CD1-CD 4.35Å; F136-K140 HydrophobicContact CE1-CD 3.78Å; F136-K140 HydrophobicContact CE1-CG 4.4Å; F136-K140 HydrophobicContact CZ-CD 4.2Å; F136-K140 VanDerWaalsContact CZ-CE 3.4Å; F136-K140 PolarHBondContact O-N 2.91Å; F136-K140 VanDerWaalsContact O-N 3.08Å
137M89.8Confident85.7Confident1 Ų139.1 Ų39.11%0.00521%0.213CC..Hα-helixtrans-60.5-47175.8-173.3-177.3-176.700111.5D87 H90 D91 P133 Q134 L135 S139 K140 T141D87-M137 HydrophobicContact CB-CE 3.8Å; H90-M137 HydrophobicContact CB-CE 4.24Å; H90-M137 HydrophobicContact CB-CG 4.21Å; D91-M137 HydrophobicContact CB-SD 4.25Å; P133-M137 WeakPolarHBondContact O-CB 3.36Å; P133-M137 PolarHBondContact O-N 3.45Å; Q134-M137 PolarHBondContact O-N 2.86Å; L135-M137 PolarHBondContact O-N 3.09Å; M137-S139 VanDerWaalsContact C-N 3.27Å; M137-S139 PolarHBondContact O-N 2.62Å; M137-K140 PolarHBondContact O-N 2.96Å; M137-K140 VanDerWaalsContact O-N 3.09Å; M137-T141 HydrophobicContact CG-CG2 4.46Å; M137-T141 PolarHBondContact O-N 3.43Å; M137-T141 PolarHBondContact O-OG1 3.08Å
138I87.6Confident84.8Confident11 Ų1139.2 Ų39.26%0.05621%0.213CC..Hα-helixtrans-60.5-39.6176.7-68.2165.7000110.9Q134 L135 K140 T141 G142 A144 L152 L208 L210Q134-I138 HydrophobicContact CG-CD1 4.2Å; Q134-I138 WeakPolarHBondContact O-CG1 3.36Å; Q134-I138 PolarHBondContact O-N 3.36Å; L135-I138 PolarHBondContact O-N 3.25Å; I138-K140 VanDerWaalsContact C-N 3.26Å; I138-K140 PolarHBondContact O-N 3.08Å; I138-T141 PolarHBondContact O-N 3.11Å; I138-T141 PolarHBondContact O-OG1 3.28Å; I138-G142 PolarHBondContact O-N 3.45Å; I138-A144 HydrophobicContact CD1-CB 4.21Å; I138-A144 HydrophobicContact CG1-CB 4.22Å; I138-A144 HydrophobicContact CG2-CB 4.04Å; I138-L152 HydrophobicContact CD1-CD1 3.64Å; I138-L208 HydrophobicContact CG2-CD2 4.04Å; I138-L210 HydrophobicContact CG2-CD1 4.41Å
139S84Confident84Confident63 Ų6338.8 Ų38.844%0.44121%0.21SC..Hα-helixtrans-62.3-32.8176.478.60000113.6L135 F136 M137 L210L135-S139 PolarHBondContact O-N 3.37Å; F136-S139 PolarHBondContact O-N 3.11Å; F136-S139 PolarHBondContact O-OG 3.44Å; M137-S139 VanDerWaalsContact C-N 3.27Å; M137-S139 PolarHBondContact O-N 2.62Å; S139-L210 VanDerWaalsContact CA-CD1 3.43Å
140K84.1Confident83.6Confident107 Ų10741 Ų4147%0.46522%0.219SC..Hα-helixtrans-80.4-39.3177-77.8-167.5164.5-170.20113.5T92 F136 M137 I138 G142T92-K140 PolarHBondContact OG1-NZ 2.98Å; F136-K140 HydrophobicContact CD1-CD 4.35Å; F136-K140 HydrophobicContact CE1-CD 3.78Å; F136-K140 HydrophobicContact CE1-CG 4.4Å; F136-K140 HydrophobicContact CZ-CD 4.2Å; F136-K140 VanDerWaalsContact CZ-CE 3.4Å; F136-K140 PolarHBondContact O-N 2.91Å; F136-K140 VanDerWaalsContact O-N 3.08Å; M137-K140 PolarHBondContact O-N 2.96Å; M137-K140 VanDerWaalsContact O-N 3.09Å; I138-K140 VanDerWaalsContact C-N 3.26Å; I138-K140 PolarHBondContact O-N 3.08Å; K140-G142 VanDerWaalsContact C-N 3.33Å
141T83.9Confident83.2Confident52 Ų5241.1 Ų41.132%0.31922%0.22SC..Hα-helixtrans-80.3-16.8-176.956.90000112.8H90 M137 I138 E143H90-T141 HydrophobicContact CB-CG2 3.82Å; M137-T141 HydrophobicContact CG-CG2 4.46Å; M137-T141 PolarHBondContact O-N 3.43Å; M137-T141 PolarHBondContact O-OG1 3.08Å; I138-T141 PolarHBondContact O-N 3.11Å; I138-T141 PolarHBondContact O-OG1 3.28Å; T141-E143 PolarHBondContact O-N 2.73Å; T141-E143 PolarHBondContact OG1-O 2.92Å
142G72.1Confident82.9Confident28 Ų2841.1 Ų41.129%0.28922%0.22SC..SBendtrans74-12174.800000115.1I138 K140 S209I138-G142 PolarHBondContact O-N 3.45Å; K140-G142 VanDerWaalsContact C-N 3.33Å; G142-S209 VanDerWaalsContact O-CA 3.31Å; G142-S209 WeakPolarHBondContact O-CA 3.29Å
143E69Low82.7Confident106 Ų10641.8 Ų41.850%0.49522%0.221SC..EExtended strand (participates in β ladder)trans-134.7146.4172.8-64.5-16417300111.7T141 K207 L208T141-E143 PolarHBondContact O-N 2.73Å; T141-E143 PolarHBondContact OG1-O 2.92Å; E143-K207 IonicContact OE1-NZ 2.78Å; E143-K207 IonicContact OE2-NZ 3.64Å; E143-K207 PolarHBondContact OE2-NZ 3.48Å; E143-K207 VanDerWaalsContact OE2-NZ 3.13Å; E143-L208 WeakPolarHBondContact CA-O 3.4Å
144A70.4Confident82.6Confident14 Ų1444.9 Ų44.912%0.11623%0.234CC..EExtended strand (participates in β ladder)trans-120.5135.216500000110.7I138 T149 L208I138-A144 HydrophobicContact CD1-CB 4.21Å; I138-A144 HydrophobicContact CG1-CB 4.22Å; I138-A144 HydrophobicContact CG2-CB 4.04Å; A144-T149 HydrophobicContact CB-CG2 3.99Å; A144-L208 HydrophobicContact CB-CB 4.48Å; A144-L208 HydrophobicContact CB-CD2 3.83Å; A144-L208 PolarHBondContact N-O 3.32Å
145E74.1Confident82.5Confident96 Ų9645 Ų4545%0.44924%0.235SC..  trans-62.9142.9174.1-67.4179.1170.700111.5K22 I147 T148 T149K22-E145 WeakPolarHBondContact CE-OE2 3.36Å; K22-E145 IonicContact NZ-OE2 3.42Å; K22-E145 PolarHBondContact NZ-OE2 2.97Å; E145-I147 VanDerWaalsContact C-N 3.26Å; E145-I147 PolarHBondContact O-N 2.94Å; E145-I147 VanDerWaalsContact O-N 3.16Å; E145-T148 WeakPolarHBondContact O-CA 3.28Å; E145-T148 WeakPolarHBondContact O-CB 3.32Å; E145-T148 PolarHBondContact O-N 3.45Å; E145-T149 PolarHBondContact O-N 2.86Å
146T68.8Low82.5Confident80 Ų8043.1 Ų43.149%0.49123%0.225SC..Hα-helixtrans-53.8-39.7-178.6-48.50000112.9T148 T149 H150 V202T146-T148 PolarHBondContact O-N 3.48Å; T146-T149 WeakPolarHBondContact CA-OG1 3.16Å; T146-T149 PolarHBondContact O-N 3.28Å; T146-T149 VanDerWaalsContact O-N 3.13Å; T146-T149 PolarHBondContact O-OG1 3.37Å; T146-H150 PolarHBondContact O-CD2 2.98Å; T146-H150 PolarHBondContact O-N 3.49Å; T146-H150 VanDerWaalsContact O-N 3.1Å; T146-V202 HydrophobicContact CG2-CG1 4.18Å
147I72.8Confident82.7Confident79 Ų7942.3 Ų42.341%0.40522%0.224SC..Hα-helixtrans-66.1-39.7178.6-57.7176.4000111.3I18 K22 E145 T149 H150 Y151I18-I147 HydrophobicContact CG2-CG2 4.07Å; K22-I147 HydrophobicContact CB-CG2 3.8Å; K22-I147 HydrophobicContact CG-CB 4.15Å; K22-I147 HydrophobicContact CG-CD1 4.44Å; K22-I147 HydrophobicContact CG-CG2 3.62Å; E145-I147 VanDerWaalsContact C-N 3.26Å; E145-I147 PolarHBondContact O-N 2.94Å; E145-I147 VanDerWaalsContact O-N 3.16Å; I147-T149 PolarHBondContact O-N 3.44Å; I147-H150 PolarHBondContact O-N 3.48Å; I147-Y151 PolarHBondContact O-N 2.86Å; I147-Y151 VanDerWaalsContact O-N 3.1Å
148T78.4Confident82.8Confident3 Ų342.3 Ų42.32%0.01822%0.224CC..Hα-helixtrans-61.7-36174-53.70000110.8I32 E145 T146 Y151 L152I32-T148 HydrophobicContact CD1-CG2 3.75Å; E145-T148 WeakPolarHBondContact O-CA 3.28Å; E145-T148 WeakPolarHBondContact O-CB 3.32Å; E145-T148 PolarHBondContact O-N 3.45Å; T146-T148 PolarHBondContact O-N 3.48Å; T148-Y151 HydrophobicContact CG2-CD1 4.33Å; T148-Y151 WeakPolarHBondContact O-CB 3.44Å; T148-Y151 PolarHBondContact O-N 3.2Å; T148-L152 HydrophobicContact CG2-CD1 4.35Å; T148-L152 WeakPolarHBondContact O-CG 3.36Å; T148-L152 PolarHBondContact O-N 3.42Å
149T79.6Confident83Confident0 Ų042.5 Ų42.50%022%0.224CC..Hα-helixtrans-68.6-35.2176.768.90000113.3A144 E145 T146 I147 L152 F153 F194 V202 L208A144-T149 HydrophobicContact CB-CG2 3.99Å; E145-T149 PolarHBondContact O-N 2.86Å; T146-T149 WeakPolarHBondContact CA-OG1 3.16Å; T146-T149 PolarHBondContact O-N 3.28Å; T146-T149 VanDerWaalsContact O-N 3.13Å; T146-T149 PolarHBondContact O-OG1 3.37Å; I147-T149 PolarHBondContact O-N 3.44Å; T149-L152 PolarHBondContact O-N 2.95Å; T149-F153 WeakPolarHBondContact O-CB 3.45Å; T149-F153 PolarHBondContact O-N 3.43Å; T149-F194 HydrophobicContact CG2-CE2 4.36Å; T149-F194 HydrophobicContact CG2-CZ 4.49Å; T149-F194 WeakPolarHBondContact O-CZ 3.29Å; T149-V202 HydrophobicContact CG2-CG2 4.08Å; T149-L208 HydrophobicContact CG2-CB 4.24Å; T149-L208 HydrophobicContact CG2-CD1 4.3Å
150H87.1Confident83.3Confident69 Ų6941 Ų4132%0.31922%0.215SC..Hα-helixtrans-65.9-42.2172.3-66.7-50.1000112.1T146 I147 L152 F153 F154 Y198T146-H150 PolarHBondContact O-CD2 2.98Å; T146-H150 PolarHBondContact O-N 3.49Å; T146-H150 VanDerWaalsContact O-N 3.1Å; I147-H150 PolarHBondContact O-N 3.48Å; H150-L152 PolarHBondContact O-N 3.42Å; H150-F153 PolarHBondContact O-N 2.65Å; H150-F154 WeakPolarHBondContact O-CD2 3.43Å; H150-F154 PolarHBondContact O-N 3.42Å; H150-Y198 PolarHBondContact CE1-OH 3.08Å; H150-Y198 AromaticContact ND1-CZ 3.86Å; H150-Y198 PolarHBondContact ND1-OH 3.26Å
151Y88.7Confident83.7Confident4 Ų437.2 Ų37.22%0.01620%0.2CC..Hα-helixtrans-53.7-53.2172.4148.8-110.8000111.1A15 L19 Q37 I147 T148 F153 F154 L155A15-Y151 HydrophobicContact CB-CD2 4.06Å; A15-Y151 HydrophobicContact CB-CE2 4.5Å; A15-Y151 WeakPolarHBondContact O-CD2 3.47Å; L19-Y151 HydrophobicContact CB-CD2 3.94Å; L19-Y151 HydrophobicContact CB-CE2 4.35Å; L19-Y151 HydrophobicContact CB-CG 4.23Å; L19-Y151 HydrophobicContact CD2-CD2 4.34Å; L19-Y151 HydrophobicContact CD2-CE1 4.39Å; L19-Y151 HydrophobicContact CD2-CE2 3.97Å; Q37-Y151 PolarHBondContact NE2-OH 3.46Å; I147-Y151 PolarHBondContact O-N 2.86Å; I147-Y151 VanDerWaalsContact O-N 3.1Å; T148-Y151 HydrophobicContact CG2-CD1 4.33Å; T148-Y151 WeakPolarHBondContact O-CB 3.44Å; T148-Y151 PolarHBondContact O-N 3.2Å; Y151-F153 VanDerWaalsContact C-N 3.29Å; Y151-F153 PolarHBondContact O-N 2.78Å; Y151-F154 PolarHBondContact O-N 2.98Å; Y151-L155 HydrophobicContact CE2-CB 4.43Å; Y151-L155 HydrophobicContact CE2-CD2 3.78Å; Y151-L155 VanDerWaalsContact O-CB 3.32Å; Y151-L155 WeakPolarHBondContact O-CB 3.2Å; Y151-L155 PolarHBondContact O-N 3.19Å; Y151-L155 WeakPolarHBondContact OH-CD2 3.42Å
152L87.7Confident84.1Confident0 Ų036.3 Ų36.30%019%0.191CC..Hα-helixtrans-63.4-34.6179.8-71173.5000112.4I131 Q134 I138 T148 T149 H150 L155 G156 F194I131-L152 HydrophobicContact CD1-CD2 3.69Å; I131-L152 HydrophobicContact CG1-CD2 4.18Å; Q134-L152 HydrophobicContact CG-CD2 4.23Å; I138-L152 HydrophobicContact CD1-CD1 3.64Å; T148-L152 HydrophobicContact CG2-CD1 4.35Å; T148-L152 WeakPolarHBondContact O-CG 3.36Å; T148-L152 PolarHBondContact O-N 3.42Å; T149-L152 PolarHBondContact O-N 2.95Å; H150-L152 PolarHBondContact O-N 3.42Å; L152-L155 CarbonylContact O-C 3.56Å; L152-L155 PolarHBondContact O-N 3.16Å; L152-G156 PolarHBondContact O-N 3.2Å; L152-F194 HydrophobicContact CB-CD1 4.02Å; L152-F194 HydrophobicContact CB-CD2 4.31Å; L152-F194 HydrophobicContact CB-CE1 3.39Å; L152-F194 HydrophobicContact CB-CE2 3.72Å; L152-F194 HydrophobicContact CB-CG 4.46Å; L152-F194 HydrophobicContact CB-CZ 3.24Å; L152-F194 HydrophobicContact CD1-CD2 3.83Å; L152-F194 HydrophobicContact CD1-CE2 3.38Å; L152-F194 HydrophobicContact CD1-CZ 3.84Å; L152-F194 HydrophobicContact CG-CE2 4.19Å; L152-F194 HydrophobicContact CG-CZ 4.17Å
153F90.1Very high85Confident54 Ų5437 Ų3724%0.23719%0.188CC..Hα-helixtrans-64.5-50.5176.4175.1-97.8000112T149 H150 Y151 L155 G156 L157 F194 F195 Y198T149-F153 WeakPolarHBondContact O-CB 3.45Å; T149-F153 PolarHBondContact O-N 3.43Å; H150-F153 PolarHBondContact O-N 2.65Å; Y151-F153 VanDerWaalsContact C-N 3.29Å; Y151-F153 PolarHBondContact O-N 2.78Å; F153-L155 PolarHBondContact O-N 2.71Å; F153-G156 PolarHBondContact O-N 3.46Å; F153-G156 VanDerWaalsContact O-N 3.13Å; F153-L157 HydrophobicContact CE1-CD2 4.07Å; F153-L157 HydrophobicContact CZ-CD2 4.41Å; F153-L157 VanDerWaalsContact O-CB 3.31Å; F153-L157 WeakPolarHBondContact O-CB 3.5Å; F153-L157 PolarHBondContact O-N 2.91Å; F153-F194 HydrophobicContact CB-CE1 4.42Å; F153-F195 HydrophobicContact CD2-CD1 4.1Å; F153-F195 AromaticContact CD2-CE1 3.99Å; F153-F195 HydrophobicContact CD2-CE1 3.99Å; F153-F195 HydrophobicContact CE2-CD1 4.5Å; F153-F195 HydrophobicContact CE2-CE1 4.34Å; F153-Y198 HydrophobicContact CB-CD1 4.46Å; F153-Y198 HydrophobicContact CB-CD2 4.41Å; F153-Y198 HydrophobicContact CB-CE1 4.11Å; F153-Y198 HydrophobicContact CB-CE2 4.05Å; F153-Y198 HydrophobicContact CD1-CE1 4.47Å; F153-Y198 AromaticContact CD2-CD1 3.62Å; F153-Y198 HydrophobicContact CD2-CD1 3.62Å; F153-Y198 AromaticContact CD2-CE1 3.47Å; F153-Y198 HydrophobicContact CD2-CE1 3.47Å; F153-Y198 VanDerWaalsContact CD2-CE1 3.47Å; F153-Y198 HydrophobicContact CD2-CG 4.36Å; F153-Y198 HydrophobicContact CE2-CD1 4.21Å; F153-Y198 AromaticContact CE2-CE1 3.99Å; F153-Y198 HydrophobicContact CE2-CE1 3.99Å; F153-Y198 HydrophobicContact CG-CD1 4.24Å; F153-Y198 AromaticContact CG-CE1 3.75Å; F153-Y198 HydrophobicContact CG-CE1 3.75Å; F153-Y198 AromaticContact CG-CZ 3.92Å
154F93.3Very high86.2Confident65 Ų6535.5 Ų35.529%0.28518%0.182SC..Hα-helixtrans-64.9-32.3176.9-74.4-67.6000112.2S11 A15 I18 H150 Y151 L157 Y158S11-F154 PolarHBondContact OG-O 2.99Å; A15-F154 HydrophobicContact CB-CB 3.75Å; I18-F154 HydrophobicContact CD1-CD2 3.41Å; I18-F154 VanDerWaalsContact CD1-CD2 3.41Å; I18-F154 HydrophobicContact CD1-CE2 3.53Å; I18-F154 HydrophobicContact CD1-CG 4.44Å; H150-F154 WeakPolarHBondContact O-CD2 3.43Å; H150-F154 PolarHBondContact O-N 3.42Å; Y151-F154 PolarHBondContact O-N 2.98Å; F154-L157 HydrophobicContact CD1-CD2 4.48Å; F154-L157 PolarHBondContact O-N 3.49Å; F154-Y158 PolarHBondContact O-N 2.9Å; F154-Y158 VanDerWaalsContact O-N 3.14Å
155L91Very high87.2Confident2 Ų235 Ų351%0.0118%0.178CC..Hα-helixtrans-71.3-29.9173.3-161.170.4000112.7A15 F40 I131 Y151 L152 F153 Y158 Y191A15-L155 HydrophobicContact CB-CB 4.08Å; A15-L155 HydrophobicContact CB-CD1 4.23Å; F40-L155 HydrophobicContact CE2-CD2 4.15Å; F40-L155 HydrophobicContact CZ-CD2 3.85Å; I131-L155 HydrophobicContact CD1-CD2 3.87Å; Y151-L155 HydrophobicContact CE2-CB 4.43Å; Y151-L155 HydrophobicContact CE2-CD2 3.78Å; Y151-L155 VanDerWaalsContact O-CB 3.32Å; Y151-L155 WeakPolarHBondContact O-CB 3.2Å; Y151-L155 PolarHBondContact O-N 3.19Å; Y151-L155 WeakPolarHBondContact OH-CD2 3.42Å; L152-L155 CarbonylContact O-C 3.56Å; L152-L155 PolarHBondContact O-N 3.16Å; F153-L155 PolarHBondContact O-N 2.71Å; L155-Y158 VanDerWaalsContact C-CD1 3.42Å; L155-Y158 HydrophobicContact CB-CE1 4.44Å; L155-Y158 HydrophobicContact CD1-CD1 4.07Å; L155-Y158 HydrophobicContact CD1-CE1 3.47Å; L155-Y158 VanDerWaalsContact CD1-CE1 3.47Å; L155-Y158 HydrophobicContact CG-CD1 4.39Å; L155-Y158 HydrophobicContact CG-CE1 3.8Å; L155-Y158 WeakPolarHBondContact O-CD1 3.29Å; L155-Y158 WeakPolarHBondContact O-CE1 3.18Å; L155-Y191 HydrophobicContact CD2-CE1 4.48Å; L155-Y191 WeakPolarHBondContact CD2-OH 3.36Å; L155-Y191 WeakPolarHBondContact CG-OH 3.4Å
156G90.8Very high88.1Confident0 Ų031.6 Ų31.60%016%0.161CC..Hα-helixtrans-74.9-44.7169.200000111.1L152 F153 Y158 R159 A160L152-G156 PolarHBondContact O-N 3.2Å; F153-G156 PolarHBondContact O-N 3.46Å; F153-G156 VanDerWaalsContact O-N 3.13Å; G156-Y158 VanDerWaalsContact C-N 3.3Å; G156-Y158 PolarHBondContact O-N 3.21Å; G156-R159 PolarHBondContact O-N 2.98Å; G156-A160 PolarHBondContact O-N 2.77Å; G156-A160 VanDerWaalsContact O-N 3.17Å
157L92.6Very high89.2Confident55 Ų5533.5 Ų33.529%0.28817%0.167SC..Hα-helixtrans-61.1-39.1-171.9178.761.9000111.8F153 F154 R159 A160 L161F153-L157 HydrophobicContact CE1-CD2 4.07Å; F153-L157 HydrophobicContact CZ-CD2 4.41Å; F153-L157 VanDerWaalsContact O-CB 3.31Å; F153-L157 WeakPolarHBondContact O-CB 3.5Å; F153-L157 PolarHBondContact O-N 2.91Å; F154-L157 HydrophobicContact CD1-CD2 4.48Å; F154-L157 PolarHBondContact O-N 3.49Å; L157-R159 PolarHBondContact O-N 3.41Å; L157-A160 PolarHBondContact O-N 3.39Å; L157-L161 HydrophobicContact CD1-CD1 4.38Å; L157-L161 HydrophobicContact CD1-CG 4.34Å; L157-L161 HydrophobicContact CG-CD1 4.04Å; L157-L161 HydrophobicContact CG-CG 4.45Å; L157-L161 WeakPolarHBondContact O-CG 3.2Å; L157-L161 PolarHBondContact O-N 3.29Å
158Y93.6Very high90.2Very high0 Ų034.9 Ų34.90%017%0.167CC..Hα-helixtrans-61.4-34.6177.790.8-88.3000112.1G8 H12 E127 F154 L155 G156 L161 Y162 Q187G8-Y158 WeakPolarHBondContact O-CB 3.26Å; H12-Y158 HydrophobicContact CB-CD1 4.13Å; H12-Y158 HydrophobicContact CB-CD2 3.86Å; H12-Y158 HydrophobicContact CB-CE2 4.35Å; H12-Y158 HydrophobicContact CB-CG 3.73Å; H12-Y158 AromaticContact CE1-CE2 3.95Å; H12-Y158 AromaticContact CE1-CZ 3.97Å; H12-Y158 AromaticContact CG-CD2 3.97Å; H12-Y158 AromaticContact CG-CE2 3.95Å; H12-Y158 AromaticContact ND1-CD2 3.98Å; H12-Y158 AromaticContact ND1-CE2 3.64Å; E127-Y158 PolarHBondContact OE1-OH 2.76Å; F154-Y158 PolarHBondContact O-N 2.9Å; F154-Y158 VanDerWaalsContact O-N 3.14Å; L155-Y158 VanDerWaalsContact C-CD1 3.42Å; L155-Y158 HydrophobicContact CB-CE1 4.44Å; L155-Y158 HydrophobicContact CD1-CD1 4.07Å; L155-Y158 HydrophobicContact CD1-CE1 3.47Å; L155-Y158 VanDerWaalsContact CD1-CE1 3.47Å; L155-Y158 HydrophobicContact CG-CD1 4.39Å; L155-Y158 HydrophobicContact CG-CE1 3.8Å; L155-Y158 WeakPolarHBondContact O-CD1 3.29Å; L155-Y158 WeakPolarHBondContact O-CE1 3.18Å; G156-Y158 VanDerWaalsContact C-N 3.3Å; G156-Y158 PolarHBondContact O-N 3.21Å; Y158-L161 PolarHBondContact O-N 3Å; Y158-Y162 HydrophobicContact CD2-CD2 4.33Å; Y158-Y162 WeakPolarHBondContact O-CD2 3.37Å; Y158-Y162 PolarHBondContact O-N 3.33Å; Y158-Q187 PolarHBondContact OH-NE2 2.79Å
159R90.3Very high90.9Very high15 Ų1536.9 Ų36.96%0.05717%0.174CC..Hα-helixtrans-72.3-40.5177.1-74.1-70.2154.7-152.90.8112.8E127 G156 L157 L161 Y162 L163 Q187E127-R159 IonicContact OE1-CZ 4Å; E127-R159 IonicContact OE1-NE 3.49Å; E127-R159 IonicContact OE1-NH2 2.74Å; E127-R159 PolarHBondContact OE1-NH2 3.45Å; E127-R159 IonicContact OE2-CZ 3.43Å; E127-R159 IonicContact OE2-NH2 3.76Å; E127-R159 PolarHBondContact OE2-NH2 3.29Å; G156-R159 PolarHBondContact O-N 2.98Å; L157-R159 PolarHBondContact O-N 3.41Å; R159-L161 VanDerWaalsContact C-N 3.28Å; R159-L161 PolarHBondContact O-N 2.87Å; R159-Y162 WeakPolarHBondContact O-CB 3.4Å; R159-Y162 PolarHBondContact O-N 3.47Å; R159-Y162 VanDerWaalsContact O-N 3.1Å; R159-L163 PolarHBondContact O-N 3.31Å; R159-Q187 HydrophobicContact CG-CG 4.01Å
160A90.6Very high91.5Very high31 Ų3142.8 Ų42.826%0.25620%0.2SC..Hα-helixtrans-57.9-42.6171.900000111.6G156 L157 Y162 L163 I164G156-A160 PolarHBondContact O-N 2.77Å; G156-A160 VanDerWaalsContact O-N 3.17Å; L157-A160 PolarHBondContact O-N 3.39Å; A160-Y162 VanDerWaalsContact C-N 3.33Å; A160-Y162 PolarHBondContact O-N 2.92Å; A160-L163 WeakPolarHBondContact O-CB 3.35Å; A160-L163 PolarHBondContact O-N 2.86Å; A160-I164 WeakPolarHBondContact O-CG1 3.29Å; A160-I164 PolarHBondContact O-N 3.46Å
161L93.4Very high91.8Very high29 Ų2948.1 Ų48.115%0.15222%0.219CC..Hα-helixtrans-65.1-35.3175.2-69.3168.3000112.4L157 Y158 R159 I164 N165L157-L161 HydrophobicContact CD1-CD1 4.38Å; L157-L161 HydrophobicContact CD1-CG 4.34Å; L157-L161 HydrophobicContact CG-CD1 4.04Å; L157-L161 HydrophobicContact CG-CG 4.45Å; L157-L161 WeakPolarHBondContact O-CG 3.2Å; L157-L161 PolarHBondContact O-N 3.29Å; Y158-L161 PolarHBondContact O-N 3Å; R159-L161 VanDerWaalsContact C-N 3.28Å; R159-L161 PolarHBondContact O-N 2.87Å; L161-I164 PolarHBondContact O-N 2.87Å; L161-N165 WeakPolarHBondContact O-CB 3.42Å; L161-N165 PolarHBondContact O-N 2.94Å
162Y92.1Very high92Very high33 Ų3353.7 Ų53.713%0.12924%0.243CC..Hα-helixtrans-66.9-36.3175-99.4-103.7000113.2D9 Y158 R159 A160 I164 N165 W166D9-Y162 VanDerWaalsContact OD1-CE2 3.29Å; D9-Y162 WeakPolarHBondContact OD1-CE2 3.42Å; D9-Y162 VanDerWaalsContact OD1-CZ 3.32Å; D9-Y162 PolarHBondContact OD1-OH 3.28Å; Y158-Y162 HydrophobicContact CD2-CD2 4.33Å; Y158-Y162 WeakPolarHBondContact O-CD2 3.37Å; Y158-Y162 PolarHBondContact O-N 3.33Å; R159-Y162 WeakPolarHBondContact O-CB 3.4Å; R159-Y162 PolarHBondContact O-N 3.47Å; R159-Y162 VanDerWaalsContact O-N 3.1Å; A160-Y162 VanDerWaalsContact C-N 3.33Å; A160-Y162 PolarHBondContact O-N 2.92Å; Y162-I164 VanDerWaalsContact C-N 3.35Å; Y162-N165 WeakPolarHBondContact O-CB 3.35Å; Y162-N165 PolarHBondContact O-N 3.41Å; Y162-W166 AromaticContact CD1-CZ2 3.99Å; Y162-W166 HydrophobicContact CD1-CZ2 3.99Å; Y162-W166 VanDerWaalsContact O-CD2 3.25Å; Y162-W166 PolarHBondContact O-N 2.96Å
163L91.7Very high92.2Very high41 Ų4158.3 Ų58.322%0.21527%0.265CS..Hα-helixtrans-59.7-46171.5-70.3171.8000111.1R159 A160 N165 W166 I167 V185 T188R159-L163 PolarHBondContact O-N 3.31Å; A160-L163 WeakPolarHBondContact O-CB 3.35Å; A160-L163 PolarHBondContact O-N 2.86Å; L163-N165 VanDerWaalsContact C-N 3.33Å; L163-N165 PolarHBondContact O-N 3.32Å; L163-W166 HydrophobicContact CD2-CE3 3.77Å; L163-W166 HydrophobicContact CD2-CZ3 3.63Å; L163-W166 HydrophobicContact CG-CE3 4.44Å; L163-W166 HydrophobicContact CG-CZ3 4.28Å; L163-W166 PolarHBondContact O-N 3.09Å; L163-W166 VanDerWaalsContact O-N 3.17Å; L163-I167 WeakPolarHBondContact O-CG1 3.41Å; L163-I167 PolarHBondContact O-N 2.88Å; L163-I167 VanDerWaalsContact O-N 3.08Å; L163-V185 HydrophobicContact CD2-CG2 3.65Å; L163-T188 HydrophobicContact CD1-CG2 3.81Å; L163-T188 WeakPolarHBondContact CD1-OG1 3.39Å
164I93.1Very high92.2Very high75 Ų7558.7 Ų58.739%0.38528%0.284SS..Hα-helixtrans-64.1-41176.9-58.9168.5000110.7F4 A160 L161 Y162 W166 I167 W168F4-I164 HydrophobicContact CD1-CB 4.21Å; F4-I164 HydrophobicContact CD1-CG2 3.56Å; F4-I164 HydrophobicContact CD2-CG2 4.02Å; F4-I164 HydrophobicContact CE1-CG2 3.59Å; F4-I164 HydrophobicContact CE2-CG2 4.06Å; F4-I164 HydrophobicContact CG-CB 4.36Å; F4-I164 HydrophobicContact CG-CG2 3.78Å; F4-I164 HydrophobicContact CZ-CG2 3.84Å; A160-I164 WeakPolarHBondContact O-CG1 3.29Å; A160-I164 PolarHBondContact O-N 3.46Å; L161-I164 PolarHBondContact O-N 2.87Å; Y162-I164 VanDerWaalsContact C-N 3.35Å; I164-W166 VanDerWaalsContact C-N 3.31Å; I164-W166 PolarHBondContact O-N 3.31Å; I164-I167 PolarHBondContact O-N 2.94Å; I164-W168 PolarHBondContact O-N 2.91Å
165N92.6Very high92Very high3 Ų359.2 Ų59.22%0.01629%0.286CS..Hα-helixtrans-57.5-42.1172.9160.877.8000111.9N2 F4 L161 Y162 L163 W168 R169N2-N165 PolarHBondContact ND2-OD1 3.38Å; N2-N165 PolarHBondContact OD1-OD1 2.88Å; F4-N165 HydrophobicContact CB-CB 3.85Å; L161-N165 WeakPolarHBondContact O-CB 3.42Å; L161-N165 PolarHBondContact O-N 2.94Å; Y162-N165 WeakPolarHBondContact O-CB 3.35Å; Y162-N165 PolarHBondContact O-N 3.41Å; L163-N165 VanDerWaalsContact C-N 3.33Å; L163-N165 PolarHBondContact O-N 3.32Å; N165-W168 WeakPolarHBondContact O-CB 3.46Å; N165-W168 PolarHBondContact O-N 2.89Å; N165-R169 WeakPolarHBondContact O-CB 3.29Å; N165-R169 VanDerWaalsContact O-CG 3.27Å; N165-R169 WeakPolarHBondContact O-CG 3.4Å; N165-R169 PolarHBondContact O-N 3.37Å
166W92.3Very high91.9Very high25 Ų2564.9 Ų64.910%0.09531%0.311CS..Hα-helixtrans-68-38.8178.4-63.8-42.3000112.5Y162 L163 I164 W168 R169 F170 A180 I181Y162-W166 AromaticContact CD1-CZ2 3.99Å; Y162-W166 HydrophobicContact CD1-CZ2 3.99Å; Y162-W166 VanDerWaalsContact O-CD2 3.25Å; Y162-W166 PolarHBondContact O-N 2.96Å; L163-W166 HydrophobicContact CD2-CE3 3.77Å; L163-W166 HydrophobicContact CD2-CZ3 3.63Å; L163-W166 HydrophobicContact CG-CE3 4.44Å; L163-W166 HydrophobicContact CG-CZ3 4.28Å; L163-W166 PolarHBondContact O-N 3.09Å; L163-W166 VanDerWaalsContact O-N 3.17Å; I164-W166 VanDerWaalsContact C-N 3.31Å; I164-W166 PolarHBondContact O-N 3.31Å; W166-W168 VanDerWaalsContact C-N 3.32Å; W166-W168 PolarHBondContact O-N 3.08Å; W166-R169 PolarHBondContact O-N 3.35Å; W166-F170 WeakPolarHBondContact O-CB 3.39Å; W166-F170 PolarHBondContact O-N 2.89Å; W166-A180 WeakPolarHBondContact CH2-O 3.24Å; W166-A180 HydrophobicContact CZ2-CB 4.07Å; W166-I181 HydrophobicContact CB-CD1 4.37Å; W166-I181 HydrophobicContact CB-CG1 4.04Å; W166-I181 HydrophobicContact CD2-CG1 3.92Å; W166-I181 HydrophobicContact CE3-CB 4.37Å; W166-I181 HydrophobicContact CE3-CG1 3.93Å; W166-I181 HydrophobicContact CG-CG1 3.97Å
167I92.4Very high91.9Very high121 Ų12165.7 Ų65.762%0.62132%0.315SS*.Hα-helixtrans-59.7-45.7172.7-64.5167.2000110.4L163 I164 F170 Y171L163-I167 WeakPolarHBondContact O-CG1 3.41Å; L163-I167 PolarHBondContact O-N 2.88Å; L163-I167 VanDerWaalsContact O-N 3.08Å; I164-I167 PolarHBondContact O-N 2.94Å; I167-F170 PolarHBondContact O-N 3.33Å; I167-Y171 PolarHBondContact O-N 3.01Å; I167-Y171 VanDerWaalsContact O-N 3.08Å
168W93.4Very high91.9Very high107 Ų10769 Ų6941%0.40533%0.331SS..Hα-helixtrans-59.5-49.1176.7-178-77.5000111.9F4 I164 N165 W166 F170 Y171 F172F4-W168 HydrophobicContact CD2-CB 4.34Å; F4-W168 HydrophobicContact CD2-CD2 4.46Å; F4-W168 HydrophobicContact CD2-CE3 4.38Å; F4-W168 HydrophobicContact CD2-CG 4.47Å; F4-W168 HydrophobicContact CE2-CD2 4.07Å; F4-W168 AromaticContact CE2-CE3 3.57Å; F4-W168 HydrophobicContact CE2-CE3 3.57Å; F4-W168 HydrophobicContact CE2-CG 4.48Å; F4-W168 HydrophobicContact CE2-CZ3 4.13Å; F4-W168 HydrophobicContact CZ-CE3 4.48Å; I164-W168 PolarHBondContact O-N 2.91Å; N165-W168 WeakPolarHBondContact O-CB 3.46Å; N165-W168 PolarHBondContact O-N 2.89Å; W166-W168 VanDerWaalsContact C-N 3.32Å; W166-W168 PolarHBondContact O-N 3.08Å; W168-F170 VanDerWaalsContact C-N 3.32Å; W168-F170 PolarHBondContact O-N 3.18Å; W168-Y171 PolarHBondContact O-N 3.47Å; W168-F172 AromaticContact CD1-CD2 3.89Å; W168-F172 AromaticContact CD2-CD2 3.51Å; W168-F172 HydrophobicContact CD2-CD2 3.51Å; W168-F172 AromaticContact CD2-CE2 3.64Å; W168-F172 HydrophobicContact CD2-CE2 3.64Å; W168-F172 AromaticContact CE2-CD2 3.4Å; W168-F172 VanDerWaalsContact CE2-CD2 3.4Å; W168-F172 AromaticContact CE2-CE2 3.68Å; W168-F172 AromaticContact CE3-CD2 3.96Å; W168-F172 HydrophobicContact CE3-CD2 3.96Å; W168-F172 AromaticContact CE3-CE2 3.58Å; W168-F172 HydrophobicContact CE3-CE2 3.58Å; W168-F172 AromaticContact CG-CD2 3.85Å; W168-F172 HydrophobicContact CG-CD2 3.85Å; W168-F172 HydrophobicContact CG-CE2 4.39Å; W168-F172 HydrophobicContact CH2-CD2 4.27Å; W168-F172 AromaticContact CH2-CE2 3.7Å; W168-F172 HydrophobicContact CH2-CE2 3.7Å; W168-F172 HydrophobicContact CH2-CZ 4.09Å; W168-F172 AromaticContact CZ2-CD2 3.82Å; W168-F172 HydrophobicContact CZ2-CD2 3.82Å; W168-F172 AromaticContact CZ2-CE2 3.72Å; W168-F172 HydrophobicContact CZ2-CE2 3.72Å; W168-F172 HydrophobicContact CZ2-CG 4.44Å; W168-F172 HydrophobicContact CZ2-CZ 4.26Å; W168-F172 HydrophobicContact CZ3-CD2 4.33Å; W168-F172 AromaticContact CZ3-CE2 3.62Å; W168-F172 HydrophobicContact CZ3-CE2 3.62Å; W168-F172 HydrophobicContact CZ3-CZ 4.28Å; W168-F172 AromaticContact NE1-CD2 3.62Å; W168-F172 WeakPolarHBondContact O-CB 3.46Å; W168-F172 WeakPolarHBondContact O-CD2 3.35Å; W168-F172 PolarHBondContact O-N 3.3Å
169R91.7Very high91.9Very high46 Ų4669.7 Ų69.717%0.17433%0.334CS..Hα-helixtrans-66.7-34.1-178.9-68.8-173.772.6-148.7-6.8112.4N165 W166 E173 G174 F175N165-R169 WeakPolarHBondContact O-CB 3.29Å; N165-R169 VanDerWaalsContact O-CG 3.27Å; N165-R169 WeakPolarHBondContact O-CG 3.4Å; N165-R169 PolarHBondContact O-N 3.37Å; W166-R169 PolarHBondContact O-N 3.35Å; R169-E173 IonicContact CZ-OE2 2.95Å; R169-E173 IonicContact NE-OE1 3.11Å; R169-E173 IonicContact NE-OE2 3.42Å; R169-E173 PolarHBondContact NE-OE2 2.72Å; R169-E173 IonicContact NH2-OE2 3.32Å; R169-E173 PolarHBondContact NH2-OE2 2.88Å; R169-E173 CarbonylContact O-C 3.41Å; R169-E173 VanDerWaalsContact O-CA 3.28Å; R169-E173 WeakPolarHBondContact O-CA 3.49Å; R169-E173 VanDerWaalsContact O-CB 3.24Å; R169-E173 WeakPolarHBondContact O-CB 3.47Å; R169-E173 PolarHBondContact O-N 3.19Å; R169-G174 PolarHBondContact O-N 3.48Å; R169-G174 VanDerWaalsContact O-N 3.1Å; R169-F175 HydrophobicContact CB-CB 4.33Å; R169-F175 HydrophobicContact CB-CD1 4.44Å; R169-F175 VanDerWaalsContact CZ-CG 3.49Å; R169-F175 PolarHBondContact O-N 2.87Å
170F92.6Very high91.9Very high124 Ų12469.3 Ų69.354%0.54433%0.334SS..Hα-helixtrans-62.5-49.1173.4179.4-103.7000111.2W166 I167 W168 G174 F175 F176W166-F170 WeakPolarHBondContact O-CB 3.39Å; W166-F170 PolarHBondContact O-N 2.89Å; I167-F170 PolarHBondContact O-N 3.33Å; W168-F170 VanDerWaalsContact C-N 3.32Å; W168-F170 PolarHBondContact O-N 3.18Å; F170-G174 WeakPolarHBondContact O-CA 3.31Å; F170-G174 PolarHBondContact O-N 3.16Å; F170-F175 WeakPolarHBondContact CA-O 3.38Å; F170-F176 HydrophobicContact CD2-CB 4.15Å; F170-F176 AromaticContact CD2-CD2 3.93Å; F170-F176 HydrophobicContact CD2-CD2 3.93Å; F170-F176 HydrophobicContact CD2-CG 4.43Å; F170-F176 HydrophobicContact CE2-CD2 4.26Å
171Y93.3Very high92.1Very high180 Ų18069.8 Ų69.871%0.70633%0.332SS*.Hα-helixtrans-71-43.8-177-173.3-95.5000113.5I167 W168I167-Y171 PolarHBondContact O-N 3.01Å; I167-Y171 VanDerWaalsContact O-N 3.08Å; W168-Y171 PolarHBondContact O-N 3.47Å
172F93.8Very high92.1Very high122 Ų12272.1 Ų72.154%0.53535%0.347SS..Hα-helixtrans-96.9-27.7-172.7-70.6-75.5000114.7W168W168-F172 AromaticContact CD1-CD2 3.89Å; W168-F172 AromaticContact CD2-CD2 3.51Å; W168-F172 HydrophobicContact CD2-CD2 3.51Å; W168-F172 AromaticContact CD2-CE2 3.64Å; W168-F172 HydrophobicContact CD2-CE2 3.64Å; W168-F172 AromaticContact CE2-CD2 3.4Å; W168-F172 VanDerWaalsContact CE2-CD2 3.4Å; W168-F172 AromaticContact CE2-CE2 3.68Å; W168-F172 AromaticContact CE3-CD2 3.96Å; W168-F172 HydrophobicContact CE3-CD2 3.96Å; W168-F172 AromaticContact CE3-CE2 3.58Å; W168-F172 HydrophobicContact CE3-CE2 3.58Å; W168-F172 AromaticContact CG-CD2 3.85Å; W168-F172 HydrophobicContact CG-CD2 3.85Å; W168-F172 HydrophobicContact CG-CE2 4.39Å; W168-F172 HydrophobicContact CH2-CD2 4.27Å; W168-F172 AromaticContact CH2-CE2 3.7Å; W168-F172 HydrophobicContact CH2-CE2 3.7Å; W168-F172 HydrophobicContact CH2-CZ 4.09Å; W168-F172 AromaticContact CZ2-CD2 3.82Å; W168-F172 HydrophobicContact CZ2-CD2 3.82Å; W168-F172 AromaticContact CZ2-CE2 3.72Å; W168-F172 HydrophobicContact CZ2-CE2 3.72Å; W168-F172 HydrophobicContact CZ2-CG 4.44Å; W168-F172 HydrophobicContact CZ2-CZ 4.26Å; W168-F172 HydrophobicContact CZ3-CD2 4.33Å; W168-F172 AromaticContact CZ3-CE2 3.62Å; W168-F172 HydrophobicContact CZ3-CE2 3.62Å; W168-F172 HydrophobicContact CZ3-CZ 4.28Å; W168-F172 AromaticContact NE1-CD2 3.62Å; W168-F172 WeakPolarHBondContact O-CB 3.46Å; W168-F172 WeakPolarHBondContact O-CD2 3.35Å; W168-F172 PolarHBondContact O-N 3.3Å
173E91.7Very high92.2Very high97 Ų9770.9 Ų70.945%0.45334%0.344SS..Hα-helixtrans-112.4-8.1-175.8-53.7172.4-165.200112.4R169 F175R169-E173 IonicContact CZ-OE2 2.95Å; R169-E173 IonicContact NE-OE1 3.11Å; R169-E173 IonicContact NE-OE2 3.42Å; R169-E173 PolarHBondContact NE-OE2 2.72Å; R169-E173 IonicContact NH2-OE2 3.32Å; R169-E173 PolarHBondContact NH2-OE2 2.88Å; R169-E173 CarbonylContact O-C 3.41Å; R169-E173 VanDerWaalsContact O-CA 3.28Å; R169-E173 WeakPolarHBondContact O-CA 3.49Å; R169-E173 VanDerWaalsContact O-CB 3.24Å; R169-E173 WeakPolarHBondContact O-CB 3.47Å; R169-E173 PolarHBondContact O-N 3.19Å; E173-F175 HydrophobicContact CB-CB 4.29Å; E173-F175 PolarHBondContact O-N 2.93Å; E173-F175 VanDerWaalsContact O-N 3.17Å
174G89.8Confident92.2Very high61 Ų6169.1 Ų69.163%0.62934%0.335SS*.  trans63.912.8-172.400000113.8R169 F170R169-G174 PolarHBondContact O-N 3.48Å; R169-G174 VanDerWaalsContact O-N 3.1Å; F170-G174 WeakPolarHBondContact O-CA 3.31Å; F170-G174 PolarHBondContact O-N 3.16Å
175F89.1Confident92.2Very high76 Ų7668.4 Ų68.433%0.33333%0.334SS..  trans-84.1128.8-175.9176.5-86.6000110.8R169 F170 E173 D177R169-F175 HydrophobicContact CB-CB 4.33Å; R169-F175 HydrophobicContact CB-CD1 4.44Å; R169-F175 VanDerWaalsContact CZ-CG 3.49Å; R169-F175 PolarHBondContact O-N 2.87Å; F170-F175 WeakPolarHBondContact CA-O 3.38Å; E173-F175 HydrophobicContact CB-CB 4.29Å; E173-F175 PolarHBondContact O-N 2.93Å; E173-F175 VanDerWaalsContact O-N 3.17Å; F175-D177 HydrophobicContact CE1-CB 3.78Å; F175-D177 HydrophobicContact CZ-CB 3.86Å
176F88.9Confident92.3Very high121 Ų12171.2 Ų71.253%0.53135%0.352SS..  trans-139.3122.1178.3-174.5-102.8000110.7F170 M178 I181F170-F176 HydrophobicContact CD2-CB 4.15Å; F170-F176 AromaticContact CD2-CD2 3.93Å; F170-F176 HydrophobicContact CD2-CD2 3.93Å; F170-F176 HydrophobicContact CD2-CG 4.43Å; F170-F176 HydrophobicContact CE2-CD2 4.26Å; F176-M178 HydrophobicContact CE1-CB 3.79Å; F176-M178 HydrophobicContact CE1-CG 4.24Å; F176-M178 HydrophobicContact CZ-CB 4.32Å; F176-M178 HydrophobicContact CZ-CG 4.45Å; F176-I181 HydrophobicContact CD2-CD1 3.5Å; F176-I181 HydrophobicContact CE2-CD1 3.41Å; F176-I181 VanDerWaalsContact CE2-CD1 3.41Å; F176-I181 HydrophobicContact CG-CD1 4.36Å; F176-I181 HydrophobicContact CZ-CD1 4.21Å
177D91.6Very high92.3Very high18 Ų1870.1 Ų70.110%0.09635%0.348CS..  trans-124.5101.2175.4-179.7-14.4000108.7H111 W120 F175 I179 A180 I181H111-D177 IonicContact CE1-OD1 2.76Å; H111-D177 PolarHBondContact CE1-OD1 3.11Å; H111-D177 IonicContact NE2-OD1 3.75Å; H111-D177 PolarHBondContact NE2-OD1 3.38Å; H111-D177 IonicContact NE2-OD2 2.65Å; W120-D177 WeakPolarHBondContact CH2-OD2 3.45Å; F175-D177 HydrophobicContact CE1-CB 3.78Å; F175-D177 HydrophobicContact CZ-CB 3.86Å; D177-I179 VanDerWaalsContact C-N 3.32Å; D177-I179 PolarHBondContact O-N 2.83Å; D177-I179 PolarHBondContact OD1-N 3.43Å; D177-A180 HydrophobicContact CB-CB 4.08Å; D177-A180 PolarHBondContact O-N 2.86Å; D177-A180 PolarHBondContact OD1-N 2.81Å; D177-A180 VanDerWaalsContact OD1-N 3.16Å; D177-I181 WeakPolarHBondContact O-CB 3.43Å; D177-I181 WeakPolarHBondContact O-CD1 3.31Å; D177-I181 WeakPolarHBondContact O-CG1 3.38Å; D177-I181 PolarHBondContact O-N 3.05Å
178M92.3Very high92.2Very high124 Ų12465.3 Ų65.361%0.61132%0.324SS*.Hα-helixtrans-63.9-38-173.6-168.2172.3179.400112.3F176 I181 V182F176-M178 HydrophobicContact CE1-CB 3.79Å; F176-M178 HydrophobicContact CE1-CG 4.24Å; F176-M178 HydrophobicContact CZ-CB 4.32Å; F176-M178 HydrophobicContact CZ-CG 4.45Å; M178-I181 PolarHBondContact O-N 3.41Å; M178-V182 HydrophobicContact CG-CG2 4.19Å; M178-V182 WeakPolarHBondContact O-CB 3.3Å; M178-V182 VanDerWaalsContact O-CG2 3.26Å; M178-V182 WeakPolarHBondContact O-CG2 3.3Å; M178-V182 PolarHBondContact O-N 2.82Å
179I92.6Very high92.1Very high15 Ų1565.3 Ų65.38%0.07733%0.331CS..Hα-helixtrans-63.5-51.5180-68-177.9000109.3W120 T121 I124 Y125 D177 I181 A183W120-I179 HydrophobicContact CZ3-CG2 4.49Å; T121-I179 HydrophobicContact CG2-CD1 4.3Å; T121-I179 HydrophobicContact CG2-CG2 4.23Å; I124-I179 HydrophobicContact CG2-CG2 4.08Å; Y125-I179 HydrophobicContact CD1-CG2 4.48Å; Y125-I179 HydrophobicContact CE1-CG2 3.67Å; D177-I179 VanDerWaalsContact C-N 3.32Å; D177-I179 PolarHBondContact O-N 2.83Å; D177-I179 PolarHBondContact OD1-N 3.43Å; I179-I181 PolarHBondContact O-N 3.39Å; I179-A183 VanDerWaalsContact O-CB 3.25Å; I179-A183 WeakPolarHBondContact O-CB 3.35Å; I179-A183 PolarHBondContact O-N 2.87Å
180A91.8Very high91.9Very high7 Ų765.6 Ų65.66%0.05834%0.336CS..Hα-helixtrans-62.4-43.1179.700000112.3W166 D177 G184W166-A180 WeakPolarHBondContact CH2-O 3.24Å; W166-A180 HydrophobicContact CZ2-CB 4.07Å; D177-A180 HydrophobicContact CB-CB 4.08Å; D177-A180 PolarHBondContact O-N 2.86Å; D177-A180 PolarHBondContact OD1-N 2.81Å; D177-A180 VanDerWaalsContact OD1-N 3.16Å; A180-G184 PolarHBondContact O-N 2.91Å
181I93.1Very high91.7Very high40 Ų4059.7 Ų59.721%0.20531%0.31CS..Hα-helixtrans-66-50.9-178.4-69.3165.9000111W166 F176 D177 M178 I179 G184 V185W166-I181 HydrophobicContact CB-CD1 4.37Å; W166-I181 HydrophobicContact CB-CG1 4.04Å; W166-I181 HydrophobicContact CD2-CG1 3.92Å; W166-I181 HydrophobicContact CE3-CB 4.37Å; W166-I181 HydrophobicContact CE3-CG1 3.93Å; W166-I181 HydrophobicContact CG-CG1 3.97Å; F176-I181 HydrophobicContact CD2-CD1 3.5Å; F176-I181 HydrophobicContact CE2-CD1 3.41Å; F176-I181 VanDerWaalsContact CE2-CD1 3.41Å; F176-I181 HydrophobicContact CG-CD1 4.36Å; F176-I181 HydrophobicContact CZ-CD1 4.21Å; D177-I181 WeakPolarHBondContact O-CB 3.43Å; D177-I181 WeakPolarHBondContact O-CD1 3.31Å; D177-I181 WeakPolarHBondContact O-CG1 3.38Å; D177-I181 PolarHBondContact O-N 3.05Å; M178-I181 PolarHBondContact O-N 3.41Å; I179-I181 PolarHBondContact O-N 3.39Å; I181-G184 PolarHBondContact O-N 3.49Å; I181-V185 WeakPolarHBondContact O-CG2 3.37Å; I181-V185 PolarHBondContact O-N 3.22Å
182V94.1Very high91.3Very high78 Ų7854.2 Ų54.247%0.47330%0.297SS..Hα-helixtrans-63.6-46.5-178.1172.70000110.7M178 G184 V185 V186M178-V182 HydrophobicContact CG-CG2 4.19Å; M178-V182 WeakPolarHBondContact O-CB 3.3Å; M178-V182 VanDerWaalsContact O-CG2 3.26Å; M178-V182 WeakPolarHBondContact O-CG2 3.3Å; M178-V182 PolarHBondContact O-N 2.82Å; V182-G184 VanDerWaalsContact C-N 3.3Å; V182-G184 PolarHBondContact O-N 2.86Å; V182-V185 PolarHBondContact O-N 3.03Å; V182-V186 WeakPolarHBondContact O-CG2 3.27Å; V182-V186 PolarHBondContact O-N 3.38Å
183A93.6Very high90.6Very high7 Ų753.4 Ų53.46%0.05830%0.298CS..Hα-helixtrans-61.4-39.9176.600000111.9I124 Y125 S128 I179 V186 Q187I124-A183 HydrophobicContact CG2-CB 3.52Å; Y125-A183 HydrophobicContact CD1-CB 4.2Å; S128-A183 VanDerWaalsContact CB-O 3.25Å; S128-A183 WeakPolarHBondContact CB-O 3.36Å; I179-A183 VanDerWaalsContact O-CB 3.25Å; I179-A183 WeakPolarHBondContact O-CB 3.35Å; I179-A183 PolarHBondContact O-N 2.87Å; A183-V186 PolarHBondContact O-N 2.87Å; A183-Q187 WeakPolarHBondContact O-CB 3.33Å; A183-Q187 PolarHBondContact O-N 3.37Å
184G92.1Very high90.1Very high4 Ų449.2 Ų49.24%0.04128%0.279CS..Hα-helixtrans-66.3-37.4175.900000113.6A180 I181 V182 Q187 T188A180-G184 PolarHBondContact O-N 2.91Å; I181-G184 PolarHBondContact O-N 3.49Å; V182-G184 VanDerWaalsContact C-N 3.3Å; V182-G184 PolarHBondContact O-N 2.86Å; G184-Q187 WeakPolarHBondContact O-CB 3.16Å; G184-Q187 PolarHBondContact O-N 3.3Å; G184-T188 PolarHBondContact O-N 3.38Å; G184-T188 PolarHBondContact O-OG1 3.17Å
185V93.6Very high89.8Confident60 Ų6048.2 Ų48.236%0.36426%0.257SS..Hα-helixtrans-63.2-47.9173.1168.70000110.6L163 I181 V182 Q187 T188 I189L163-V185 HydrophobicContact CD2-CG2 3.65Å; I181-V185 WeakPolarHBondContact O-CG2 3.37Å; I181-V185 PolarHBondContact O-N 3.22Å; V182-V185 PolarHBondContact O-N 3.03Å; V185-Q187 VanDerWaalsContact C-N 3.27Å; V185-Q187 PolarHBondContact O-N 3.26Å; V185-T188 PolarHBondContact O-N 3.1Å; V185-I189 HydrophobicContact CG1-CD1 3.74Å; V185-I189 HydrophobicContact CG1-CG1 4.4Å; V185-I189 WeakPolarHBondContact O-CG1 3.5Å; V185-I189 PolarHBondContact O-N 2.54Å
186V93.8Very high89.5Confident62 Ų6251.8 Ų51.838%0.37627%0.269SS..Hα-helixtrans-54.8-47.5174.61700000110.3V182 A183 T188 I189 L190V182-V186 WeakPolarHBondContact O-CG2 3.27Å; V182-V186 PolarHBondContact O-N 3.38Å; A183-V186 PolarHBondContact O-N 2.87Å; V186-T188 PolarHBondContact O-N 2.9Å; V186-I189 PolarHBondContact O-N 2.91Å; V186-L190 HydrophobicContact CG1-CD1 4.46Å; V186-L190 WeakPolarHBondContact O-CG 3.33Å; V186-L190 PolarHBondContact O-N 3.07Å; V186-L190 VanDerWaalsContact O-N 3.15Å
187Q92.3Very high88.8Confident2 Ų246.6 Ų46.61%0.00925%0.247CC..Hα-helixtrans-59.2-48.8178.7-164.9168.74.100111.8E127 Y158 R159 A183 G184 V185 I189 L190 Y191E127-Q187 PolarHBondContact O-NE2 3.4Å; Y158-Q187 PolarHBondContact OH-NE2 2.79Å; R159-Q187 HydrophobicContact CG-CG 4.01Å; A183-Q187 WeakPolarHBondContact O-CB 3.33Å; A183-Q187 PolarHBondContact O-N 3.37Å; G184-Q187 WeakPolarHBondContact O-CB 3.16Å; G184-Q187 PolarHBondContact O-N 3.3Å; V185-Q187 VanDerWaalsContact C-N 3.27Å; V185-Q187 PolarHBondContact O-N 3.26Å; Q187-I189 VanDerWaalsContact C-N 3.34Å; Q187-I189 PolarHBondContact O-N 2.94Å; Q187-L190 PolarHBondContact O-N 3.33Å; Q187-Y191 HydrophobicContact CG-CD2 4.35Å; Q187-Y191 HydrophobicContact CG-CE2 3.93Å; Q187-Y191 WeakPolarHBondContact O-CD2 3.24Å; Q187-Y191 PolarHBondContact O-N 3.32Å
188T90.4Very high88.2Confident20 Ų2046.3 Ų46.312%0.12324%0.244CC..Hα-helixtrans-63-39.6180-63.60000112.2L163 G184 V185 V186 L190 Y191 C192L163-T188 HydrophobicContact CD1-CG2 3.81Å; L163-T188 WeakPolarHBondContact CD1-OG1 3.39Å; G184-T188 PolarHBondContact O-N 3.38Å; G184-T188 PolarHBondContact O-OG1 3.17Å; V185-T188 PolarHBondContact O-N 3.1Å; V186-T188 PolarHBondContact O-N 2.9Å; T188-L190 VanDerWaalsContact C-N 3.3Å; T188-L190 PolarHBondContact O-N 2.92Å; T188-Y191 PolarHBondContact O-N 3.19Å; T188-C192 PolarHBondContact O-N 3.17Å; T188-C192 PolarHBondContact O-SG 2.74Å; T188-C192 VanDerWaalsContact O-SG 3.39Å
189I91.3Very high87.7Confident107 Ų10744.1 Ų44.155%0.54924%0.238SC..Hα-helixtrans-59.9-41.6176.8-70.9168.5000111V185 V186 Q187 Y191 C192V185-I189 HydrophobicContact CG1-CD1 3.74Å; V185-I189 HydrophobicContact CG1-CG1 4.4Å; V185-I189 WeakPolarHBondContact O-CG1 3.5Å; V185-I189 PolarHBondContact O-N 2.54Å; V186-I189 PolarHBondContact O-N 2.91Å; Q187-I189 VanDerWaalsContact C-N 3.34Å; Q187-I189 PolarHBondContact O-N 2.94Å; I189-Y191 PolarHBondContact O-N 3.26Å; I189-C192 VanDerWaalsContact O-CB 3.32Å; I189-C192 WeakPolarHBondContact O-CB 3.28Å; I189-C192 PolarHBondContact O-N 3.46Å
190L89.1Confident87.1Confident53 Ų5345.5 Ų45.528%0.27725%0.247SC..Hα-helixtrans-63.1-24.4176.7-68.6176.2000113.2S128 V129 L132 V186 Q187 T188S128-L190 WeakPolarHBondContact O-CD1 3.48Å; V129-L190 HydrophobicContact CG1-CD1 4.46Å; L132-L190 HydrophobicContact CD2-CD1 3.91Å; L132-L190 HydrophobicContact CD2-CD2 3.83Å; L132-L190 HydrophobicContact CD2-CG 4.43Å; L132-L190 HydrophobicContact CG-CD1 4.18Å; V186-L190 HydrophobicContact CG1-CD1 4.46Å; V186-L190 WeakPolarHBondContact O-CG 3.33Å; V186-L190 PolarHBondContact O-N 3.07Å; V186-L190 VanDerWaalsContact O-N 3.15Å; Q187-L190 PolarHBondContact O-N 3.33Å; T188-L190 VanDerWaalsContact C-N 3.3Å; T188-L190 PolarHBondContact O-N 2.92Å
191Y86.5Confident86.4Confident0 Ų047.4 Ų47.40%025%0.254CS..Hα-helixtrans-87.6-12.2173.3-74-78.5000114I131 L155 Q187 T188 I189 D193 F194 F195I131-Y191 WeakPolarHBondContact CB-OH 3.35Å; I131-Y191 HydrophobicContact CG1-CE1 3.88Å; I131-Y191 VanDerWaalsContact CG1-OH 3.3Å; I131-Y191 WeakPolarHBondContact CG1-OH 3.41Å; I131-Y191 HydrophobicContact CG2-CE1 4.43Å; I131-Y191 HydrophobicContact CG2-CE2 4.12Å; L155-Y191 HydrophobicContact CD2-CE1 4.48Å; L155-Y191 WeakPolarHBondContact CD2-OH 3.36Å; L155-Y191 WeakPolarHBondContact CG-OH 3.4Å; Q187-Y191 HydrophobicContact CG-CD2 4.35Å; Q187-Y191 HydrophobicContact CG-CE2 3.93Å; Q187-Y191 WeakPolarHBondContact O-CD2 3.24Å; Q187-Y191 PolarHBondContact O-N 3.32Å; T188-Y191 PolarHBondContact O-N 3.19Å; I189-Y191 PolarHBondContact O-N 3.26Å; Y191-D193 PolarHBondContact O-N 2.65Å; Y191-F194 WeakPolarHBondContact O-CB 3.24Å; Y191-F194 PolarHBondContact O-N 3.3Å; Y191-F195 WeakPolarHBondContact O-CD2 3.11Å; Y191-F195 WeakPolarHBondContact O-CG 3.34Å; Y191-F195 PolarHBondContact O-N 3.5Å
192C86.1Confident85.7Confident65 Ų6546.3 Ų46.344%0.43925%0.249SC..Hα-helixtrans-59.5-46.2-174.1-75.90000113T188 I189 F194 F195 Y196T188-C192 PolarHBondContact O-N 3.17Å; T188-C192 PolarHBondContact O-SG 2.74Å; T188-C192 VanDerWaalsContact O-SG 3.39Å; I189-C192 VanDerWaalsContact O-CB 3.32Å; I189-C192 WeakPolarHBondContact O-CB 3.28Å; I189-C192 PolarHBondContact O-N 3.46Å; C192-F194 VanDerWaalsContact C-N 3.34Å; C192-F195 PolarHBondContact O-N 3.23Å; C192-Y196 PolarHBondContact O-N 3.03Å
193D78.7Confident84.9Confident104 Ų10447.9 Ų47.956%0.55625%0.254SS*.Hα-helixtrans-64.6-41.6178.5-17342.2000111.3Y191 F195 Y196 L197Y191-D193 PolarHBondContact O-N 2.65Å; D193-F195 PolarHBondContact O-N 2.68Å; D193-Y196 PolarHBondContact O-N 3.4Å; D193-L197 WeakPolarHBondContact O-CG 3.31Å; D193-L197 PolarHBondContact O-N 3.37Å
194F80.6Confident84.2Confident10 Ų1054.8 Ų54.84%0.04428%0.283CS..Hα-helixtrans-59.1-45.2173.6175.3-94.2000112L135 T149 L152 F153 Y191 C192 Y196 L197 Y198 L208L135-F194 HydrophobicContact CD2-CB 4.39Å; T149-F194 HydrophobicContact CG2-CE2 4.36Å; T149-F194 HydrophobicContact CG2-CZ 4.49Å; T149-F194 WeakPolarHBondContact O-CZ 3.29Å; L152-F194 HydrophobicContact CB-CD1 4.02Å; L152-F194 HydrophobicContact CB-CD2 4.31Å; L152-F194 HydrophobicContact CB-CE1 3.39Å; L152-F194 HydrophobicContact CB-CE2 3.72Å; L152-F194 HydrophobicContact CB-CG 4.46Å; L152-F194 HydrophobicContact CB-CZ 3.24Å; L152-F194 HydrophobicContact CD1-CD2 3.83Å; L152-F194 HydrophobicContact CD1-CE2 3.38Å; L152-F194 HydrophobicContact CD1-CZ 3.84Å; L152-F194 HydrophobicContact CG-CE2 4.19Å; L152-F194 HydrophobicContact CG-CZ 4.17Å; F153-F194 HydrophobicContact CB-CE1 4.42Å; Y191-F194 WeakPolarHBondContact O-CB 3.24Å; Y191-F194 PolarHBondContact O-N 3.3Å; C192-F194 VanDerWaalsContact C-N 3.34Å; F194-Y196 PolarHBondContact O-N 3.32Å; F194-L197 PolarHBondContact O-N 3.48Å; F194-Y198 HydrophobicContact CE1-CD2 4.39Å; F194-Y198 HydrophobicContact CE1-CG 4.46Å; F194-Y198 HydrophobicContact CZ-CD2 4.06Å; F194-Y198 HydrophobicContact CZ-CG 4.49Å; F194-Y198 VanDerWaalsContact O-CB 3.29Å; F194-Y198 WeakPolarHBondContact O-CB 3.41Å; F194-Y198 PolarHBondContact O-N 3.33Å; F194-L208 HydrophobicContact CE2-CD1 4.29Å
195F83.4Confident83.4Confident40 Ų4058.1 Ų58.118%0.17532%0.317CS..Hα-helixtrans-62.4-42.6177.8-73.3-47.5000112.5F153 Y191 C192 D193 L197 Y198 V199F153-F195 HydrophobicContact CD2-CD1 4.1Å; F153-F195 AromaticContact CD2-CE1 3.99Å; F153-F195 HydrophobicContact CD2-CE1 3.99Å; F153-F195 HydrophobicContact CE2-CD1 4.5Å; F153-F195 HydrophobicContact CE2-CE1 4.34Å; Y191-F195 WeakPolarHBondContact O-CD2 3.11Å; Y191-F195 WeakPolarHBondContact O-CG 3.34Å; Y191-F195 PolarHBondContact O-N 3.5Å; C192-F195 PolarHBondContact O-N 3.23Å; D193-F195 PolarHBondContact O-N 2.68Å; F195-L197 VanDerWaalsContact C-N 3.35Å; F195-L197 PolarHBondContact O-N 2.94Å; F195-Y198 PolarHBondContact O-N 3.47Å; F195-V199 WeakPolarHBondContact O-CG2 3.23Å; F195-V199 PolarHBondContact O-N 3.06Å
196Y82.9Confident82.3Confident150 Ų15061.9 Ų61.959%0.58833%0.329SS*.Hα-helixtrans-58-48.9176.5174.7-99.2000111C192 D193 F194 V199 T200C192-Y196 PolarHBondContact O-N 3.03Å; D193-Y196 PolarHBondContact O-N 3.4Å; F194-Y196 PolarHBondContact O-N 3.32Å; Y196-V199 PolarHBondContact O-N 3.06Å; Y196-T200 HydrophobicContact CD2-CG2 4.23Å; Y196-T200 HydrophobicContact CE1-CG2 4.49Å; Y196-T200 HydrophobicContact CE2-CG2 3.9Å; Y196-T200 WeakPolarHBondContact O-CB 3.35Å; Y196-T200 VanDerWaalsContact O-CG2 3.31Å; Y196-T200 WeakPolarHBondContact O-CG2 3.29Å; Y196-T200 PolarHBondContact O-N 3.47Å; Y196-T200 PolarHBondContact O-OG1 3.11Å
197L75.4Confident80.9Confident13 Ų1365.4 Ų65.47%0.06834%0.339CS..Hα-helixtrans-66-38.5178.2-67.5171.6000112.5D193 F194 F195 T200 K201 L208 L210D193-L197 WeakPolarHBondContact O-CG 3.31Å; D193-L197 PolarHBondContact O-N 3.37Å; F194-L197 PolarHBondContact O-N 3.48Å; F195-L197 VanDerWaalsContact C-N 3.35Å; F195-L197 PolarHBondContact O-N 2.94Å; L197-T200 PolarHBondContact O-OG1 3.19Å; L197-K201 VanDerWaalsContact O-CB 3.3Å; L197-K201 WeakPolarHBondContact O-CB 3.26Å; L197-K201 PolarHBondContact O-N 3.12Å; L197-L208 HydrophobicContact CB-CD1 3.7Å; L197-L208 HydrophobicContact CB-CG 4.41Å; L197-L210 HydrophobicContact CD1-CD2 3.39Å
198Y78.7Confident79.6Confident11 Ų1165.5 Ų65.54%0.04334%0.34CS..Hα-helixtrans-61.4-49.1177.3-178-95.8000111.9H150 F153 F194 F195 V202 L203H150-Y198 PolarHBondContact CE1-OH 3.08Å; H150-Y198 AromaticContact ND1-CZ 3.86Å; H150-Y198 PolarHBondContact ND1-OH 3.26Å; F153-Y198 HydrophobicContact CB-CD1 4.46Å; F153-Y198 HydrophobicContact CB-CD2 4.41Å; F153-Y198 HydrophobicContact CB-CE1 4.11Å; F153-Y198 HydrophobicContact CB-CE2 4.05Å; F153-Y198 HydrophobicContact CD1-CE1 4.47Å; F153-Y198 AromaticContact CD2-CD1 3.62Å; F153-Y198 HydrophobicContact CD2-CD1 3.62Å; F153-Y198 AromaticContact CD2-CE1 3.47Å; F153-Y198 HydrophobicContact CD2-CE1 3.47Å; F153-Y198 VanDerWaalsContact CD2-CE1 3.47Å; F153-Y198 HydrophobicContact CD2-CG 4.36Å; F153-Y198 HydrophobicContact CE2-CD1 4.21Å; F153-Y198 AromaticContact CE2-CE1 3.99Å; F153-Y198 HydrophobicContact CE2-CE1 3.99Å; F153-Y198 HydrophobicContact CG-CD1 4.24Å; F153-Y198 AromaticContact CG-CE1 3.75Å; F153-Y198 HydrophobicContact CG-CE1 3.75Å; F153-Y198 AromaticContact CG-CZ 3.92Å; F194-Y198 HydrophobicContact CE1-CD2 4.39Å; F194-Y198 HydrophobicContact CE1-CG 4.46Å; F194-Y198 HydrophobicContact CZ-CD2 4.06Å; F194-Y198 HydrophobicContact CZ-CG 4.49Å; F194-Y198 VanDerWaalsContact O-CB 3.29Å; F194-Y198 WeakPolarHBondContact O-CB 3.41Å; F194-Y198 PolarHBondContact O-N 3.33Å; F195-Y198 PolarHBondContact O-N 3.47Å; Y198-V202 HydrophobicContact CD2-CB 3.79Å; Y198-V202 HydrophobicContact CD2-CG1 3.98Å; Y198-V202 HydrophobicContact CD2-CG2 3.96Å; Y198-V202 HydrophobicContact CE2-CB 4.05Å; Y198-V202 HydrophobicContact CE2-CG1 3.73Å; Y198-V202 HydrophobicContact CG-CB 4.34Å; Y198-V202 WeakPolarHBondContact O-CA 3.36Å; Y198-V202 WeakPolarHBondContact O-CB 3.36Å; Y198-V202 PolarHBondContact O-N 2.94Å; Y198-L203 HydrophobicContact CD1-CG 4.22Å; Y198-L203 HydrophobicContact CE1-CD1 4.34Å; Y198-L203 HydrophobicContact CE1-CD2 3.76Å; Y198-L203 HydrophobicContact CE1-CG 3.9Å; Y198-L203 PolarHBondContact O-N 3.32Å; Y198-L203 VanDerWaalsContact O-N 3.08Å
199V82Confident78.3Confident78 Ų7867 Ų6747%0.47335%0.351SS..Hα-helixtrans-68.5-41.5-178.6172.40000111.4F195 Y196 L203F195-V199 WeakPolarHBondContact O-CG2 3.23Å; F195-V199 PolarHBondContact O-N 3.06Å; Y196-V199 PolarHBondContact O-N 3.06Å; V199-L203 HydrophobicContact CB-CD1 4.46Å; V199-L203 HydrophobicContact CG1-CD1 4.47Å; V199-L203 HydrophobicContact CG2-CD1 4.26Å
200T79.1Confident76.7Confident44 Ų4464.3 Ų64.327%0.2734%0.338SS..Hα-helixtrans-79.3-30.7-174.956.30000113.4Y196 L197 K204Y196-T200 HydrophobicContact CD2-CG2 4.23Å; Y196-T200 HydrophobicContact CE1-CG2 4.49Å; Y196-T200 HydrophobicContact CE2-CG2 3.9Å; Y196-T200 WeakPolarHBondContact O-CB 3.35Å; Y196-T200 VanDerWaalsContact O-CG2 3.31Å; Y196-T200 WeakPolarHBondContact O-CG2 3.29Å; Y196-T200 PolarHBondContact O-N 3.47Å; Y196-T200 PolarHBondContact O-OG1 3.11Å; L197-T200 PolarHBondContact O-OG1 3.19Å; T200-K204 WeakPolarHBondContact O-CD 3.41Å
201K76.9Confident75.1Confident48 Ų4866.8 Ų66.821%0.20936%0.357CS..THydrogen-bonded Turntrans-108.7-60.3-177.4-57.8-167.9176.3-172.50112.8L197 K204 G205 K206 S209L197-K201 VanDerWaalsContact O-CB 3.3Å; L197-K201 WeakPolarHBondContact O-CB 3.26Å; L197-K201 PolarHBondContact O-N 3.12Å; K201-K204 CarbonylContact O-C 3.58Å; K201-K204 PolarHBondContact O-N 2.83Å; K201-K204 VanDerWaalsContact O-N 3.14Å; K201-G205 PolarHBondContact O-N 3.19Å; K201-K206 CarbonylContact C-O 3.34Å; K201-K206 HydrophobicContact CB-CB 4.21Å; K201-K206 WeakPolarHBondContact O-CA 3.39Å; K201-K206 WeakPolarHBondContact O-CB 3.42Å; K201-K206 PolarHBondContact O-N 3Å; K201-S209 PolarHBondContact NZ-O 3.15Å
202V79.6Confident73.2Confident16 Ų1675.2 Ų75.210%0.09743%0.426CS..G310 helixtrans-66.3-46.6-169.1-178.20000112.1T146 T149 Y198 K204 G205 K206 L208T146-V202 HydrophobicContact CG2-CG1 4.18Å; T149-V202 HydrophobicContact CG2-CG2 4.08Å; Y198-V202 HydrophobicContact CD2-CB 3.79Å; Y198-V202 HydrophobicContact CD2-CG1 3.98Å; Y198-V202 HydrophobicContact CD2-CG2 3.96Å; Y198-V202 HydrophobicContact CE2-CB 4.05Å; Y198-V202 HydrophobicContact CE2-CG1 3.73Å; Y198-V202 HydrophobicContact CG-CB 4.34Å; Y198-V202 WeakPolarHBondContact O-CA 3.36Å; Y198-V202 WeakPolarHBondContact O-CB 3.36Å; Y198-V202 PolarHBondContact O-N 2.94Å; V202-K204 PolarHBondContact O-N 3.16Å; V202-K204 VanDerWaalsContact O-N 3.15Å; V202-G205 PolarHBondContact O-N 3.31Å; V202-K206 WeakPolarHBondContact CA-O 3.21Å; V202-L208 HydrophobicContact CG2-CB 3.99Å; V202-L208 HydrophobicContact CG2-CD1 3.93Å
203L76.1Confident72.6Confident111 Ų11175.8 Ų75.858%0.58143%0.426SS*.G310 helixtrans-63.7-21177.9-67.9-175.8000113.3Y198 V199 G205Y198-L203 HydrophobicContact CD1-CG 4.22Å; Y198-L203 HydrophobicContact CE1-CD1 4.34Å; Y198-L203 HydrophobicContact CE1-CD2 3.76Å; Y198-L203 HydrophobicContact CE1-CG 3.9Å; Y198-L203 PolarHBondContact O-N 3.32Å; Y198-L203 VanDerWaalsContact O-N 3.08Å; V199-L203 HydrophobicContact CB-CD1 4.46Å; V199-L203 HydrophobicContact CG1-CD1 4.47Å; V199-L203 HydrophobicContact CG2-CD1 4.26Å; L203-G205 VanDerWaalsContact C-N 3.3Å
204K80.1Confident72.2Confident152 Ų15274.3 Ų74.366%0.66142%0.419SS*.G310 helixtrans-91.811.6175-59.8-171.4-173.7176.70112.9T200 K201 V202 K206T200-K204 WeakPolarHBondContact O-CD 3.41Å; K201-K204 CarbonylContact O-C 3.58Å; K201-K204 PolarHBondContact O-N 2.83Å; K201-K204 VanDerWaalsContact O-N 3.14Å; V202-K204 PolarHBondContact O-N 3.16Å; V202-K204 VanDerWaalsContact O-N 3.15Å; K204-K206 PolarHBondContact O-N 2.92Å
205G74.4Confident71.8Confident74 Ų7477.8 Ų77.876%0.76344%0.44SS*.THydrogen-bonded Turntrans72.210.9-178.700000114.5K201 V202 L203K201-G205 PolarHBondContact O-N 3.19Å; V202-G205 PolarHBondContact O-N 3.31Å; L203-G205 VanDerWaalsContact C-N 3.3Å
206K71.1Confident71.1Confident140 Ų14080.1 Ų80.161%0.60946%0.455SS*.  trans-89.8142.4176-59.4-175.7178.4-174.50109.6K201 V202 K204K201-K206 CarbonylContact C-O 3.34Å; K201-K206 HydrophobicContact CB-CB 4.21Å; K201-K206 WeakPolarHBondContact O-CA 3.39Å; K201-K206 WeakPolarHBondContact O-CB 3.42Å; K201-K206 PolarHBondContact O-N 3Å; V202-K206 WeakPolarHBondContact CA-O 3.21Å; K204-K206 PolarHBondContact O-N 2.92Å
207K64.8Low70.4Confident136 Ų13675.7 Ų75.759%0.59145%0.447SS*.  trans-60.6144.9172.9-71.1-172.8170.8-167.10110.8E143 S209E143-K207 IonicContact OE1-NZ 2.78Å; E143-K207 IonicContact OE2-NZ 3.64Å; E143-K207 PolarHBondContact OE2-NZ 3.48Å; E143-K207 VanDerWaalsContact OE2-NZ 3.13Å; K207-S209 PolarHBondContact O-N 3.42Å
208L63.8Low70Confident4 Ų479.9 Ų79.92%0.02147%0.472CS..EExtended strand (participates in β ladder)trans-76.891.1171.5-168.3126.3000108.3I138 E143 A144 T149 F194 L197 V202I138-L208 HydrophobicContact CG2-CD2 4.04Å; E143-L208 WeakPolarHBondContact CA-O 3.4Å; A144-L208 HydrophobicContact CB-CB 4.48Å; A144-L208 HydrophobicContact CB-CD2 3.83Å; A144-L208 PolarHBondContact N-O 3.32Å; T149-L208 HydrophobicContact CG2-CB 4.24Å; T149-L208 HydrophobicContact CG2-CD1 4.3Å; F194-L208 HydrophobicContact CE2-CD1 4.29Å; L197-L208 HydrophobicContact CB-CD1 3.7Å; L197-L208 HydrophobicContact CB-CG 4.41Å; V202-L208 HydrophobicContact CG2-CB 3.99Å; V202-L208 HydrophobicContact CG2-CD1 3.93Å
209S63.3Low69.4Low50 Ų5084.8 Ų84.835%0.3550%0.503SS..EExtended strand (participates in β ladder)trans-102.2139.2164.760.20000109.9G142 K201 K207G142-S209 VanDerWaalsContact O-CA 3.31Å; G142-S209 WeakPolarHBondContact O-CA 3.29Å; K201-S209 PolarHBondContact NZ-O 3.15Å; K207-S209 PolarHBondContact O-N 3.42Å
210L59Low68.4Low52 Ų5285.3 Ų85.327%0.27251%0.505SS..PPolyproline II helixtrans-79.8142.2170.4-73.1160.3000109.2I138 S139 L197 A212I138-L210 HydrophobicContact CG2-CD1 4.41Å; S139-L210 VanDerWaalsContact CA-CD1 3.43Å; L197-L210 HydrophobicContact CD1-CD2 3.39Å; L210-A212 PolarHBondContact O-N 2.7Å
211P54Low67.5Low105 Ų10588.8 Ų88.868%0.68253%0.525SS*.PPolyproline II helixtrans-59.5132.9171.125.7-30000108.8
212A47.5Very low66.7Low177 Ų17792.5 Ų92.5100%1.46355%0.554SS**  trans-63.1017900000112.2L210L210-A212 PolarHBondContact O-N 2.7Å

Retrieved 212 of 212 residues in 88.1 ms (Link to these results)

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