A0A5K4F163_SCHMA Loading...

FAR-17a/AIG1-like protein

AlphaFold DB , UniProt , Accession A0A5K4F163, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 242 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
1M75.1Confident91.9Very high188 Ų18871.9 Ų71.993%0.92641%0.405SS*.  0-59.20-160.6175.5-73.300112.5I3 V4 L5M1-I3 VanDerWaalsContact C-N 3.34Å; M1-I3 PolarHBondContact O-N 2.71Å; M1-V4 PolarHBondContact O-N 3.08Å; M1-V4 VanDerWaalsContact O-N 3.16Å; M1-L5 HydrophobicContact CG-CD1 4.01Å; M1-L5 HydrophobicContact CG-CG 4.39Å; M1-L5 PolarHBondContact O-N 2.67Å
2A83.6Confident92.4Very high55 Ų5573.5 Ų73.546%0.45542%0.417SS..Hα-helixtrans-55.7-41.6-178.300000114.7L5 S6A2-L5 PolarHBondContact O-N 3.29Å; A2-S6 WeakPolarHBondContact O-CB 3.25Å; A2-S6 PolarHBondContact O-N 2.85Å
3I86.8Confident92.9Very high104 Ų10468.5 Ų68.553%0.53339%0.39SS..Hα-helixtrans-60.2-50.3176.3-55.7-175000111.1M1 L5 S6 V7 W134M1-I3 VanDerWaalsContact C-N 3.34Å; M1-I3 PolarHBondContact O-N 2.71Å; I3-L5 VanDerWaalsContact C-N 3.34Å; I3-L5 PolarHBondContact O-N 2.77Å; I3-S6 PolarHBondContact O-N 3.48Å; I3-V7 WeakPolarHBondContact O-CG2 3.42Å; I3-V7 PolarHBondContact O-N 3.26Å; I3-W134 HydrophobicContact CB-CZ3 4.31Å; I3-W134 HydrophobicContact CD1-CZ3 4.37Å; I3-W134 HydrophobicContact CG1-CZ3 3.81Å; I3-W134 HydrophobicContact CG2-CZ3 4.18Å
4V91.9Very high93.3Very high104 Ų10466.5 Ų66.563%0.6338%0.378SS*.Hα-helixtrans-60.6-44.5-179.9178.30000110.9M1 S6 V7 L8M1-V4 PolarHBondContact O-N 3.08Å; M1-V4 VanDerWaalsContact O-N 3.16Å; V4-S6 PolarHBondContact O-N 2.78Å; V4-V7 PolarHBondContact O-N 3Å; V4-L8 WeakPolarHBondContact O-CB 3.39Å; V4-L8 PolarHBondContact O-N 3.25Å
5L94.6Very high93.6Very high81 Ų8167.8 Ų67.842%0.42439%0.391SS..Hα-helixtrans-63.7-39.3176.5-68.9174.7000112.3M1 A2 I3 H9 L133M1-L5 HydrophobicContact CG-CD1 4.01Å; M1-L5 HydrophobicContact CG-CG 4.39Å; M1-L5 PolarHBondContact O-N 2.67Å; A2-L5 PolarHBondContact O-N 3.29Å; I3-L5 VanDerWaalsContact C-N 3.34Å; I3-L5 PolarHBondContact O-N 2.77Å; L5-H9 VanDerWaalsContact O-CB 3.26Å; L5-H9 WeakPolarHBondContact O-CB 3.46Å; L5-H9 PolarHBondContact O-N 2.96Å; L5-L133 HydrophobicContact CB-CD2 4.07Å
6S93.4Very high93.9Very high1 Ų167.5 Ų67.51%0.00738%0.384CS..Hα-helixtrans-64.8-46.2175.9179.60000111.4A2 I3 V4 L8 H9 R10A2-S6 WeakPolarHBondContact O-CB 3.25Å; A2-S6 PolarHBondContact O-N 2.85Å; I3-S6 PolarHBondContact O-N 3.48Å; V4-S6 PolarHBondContact O-N 2.78Å; S6-L8 PolarHBondContact O-N 3.04Å; S6-H9 PolarHBondContact O-N 2.96Å; S6-R10 WeakPolarHBondContact O-CB 3.45Å; S6-R10 WeakPolarHBondContact O-CD 3.47Å; S6-R10 WeakPolarHBondContact O-CG 3.47Å; S6-R10 PolarHBondContact O-N 3.37Å; S6-R10 PolarHBondContact OG-NE 3.45Å
7V95.6Very high94.2Very high55 Ų5563.6 Ų63.633%0.33336%0.362SS..Hα-helixtrans-61.1-46.3176.5174.10000110.8I3 V4 R10 S11 T62I3-V7 WeakPolarHBondContact O-CG2 3.42Å; I3-V7 PolarHBondContact O-N 3.26Å; V4-V7 PolarHBondContact O-N 3Å; V7-R10 PolarHBondContact O-N 3.32Å; V7-S11 PolarHBondContact O-N 3Å; V7-S11 PolarHBondContact O-OG 3.4Å; V7-S11 VanDerWaalsContact O-OG 3.12Å; V7-T62 HydrophobicContact CG2-CG2 3.97Å
8L96.8Very high94.4Very high104 Ų10464.9 Ų64.955%0.54537%0.366SS..Hα-helixtrans-60-48.9177.4-178.963.9000111.9V4 S6 R10 S11 V12V4-L8 WeakPolarHBondContact O-CB 3.39Å; V4-L8 PolarHBondContact O-N 3.25Å; S6-L8 PolarHBondContact O-N 3.04Å; L8-R10 VanDerWaalsContact C-N 3.29Å; L8-R10 PolarHBondContact O-N 3.02Å; L8-S11 PolarHBondContact O-N 3.22Å; L8-V12 HydrophobicContact CD1-CG2 4.43Å; L8-V12 WeakPolarHBondContact O-CG2 3.44Å; L8-V12 PolarHBondContact O-N 3.19Å
9H97.6Very high94.5Very high34 Ų3467.2 Ų67.216%0.15737%0.369CS..Hα-helixtrans-54.6-46.2176.4169.4-96.5000111.6L5 S6 V12 A13 Y58 A126 D130 L133L5-H9 VanDerWaalsContact O-CB 3.26Å; L5-H9 WeakPolarHBondContact O-CB 3.46Å; L5-H9 PolarHBondContact O-N 2.96Å; S6-H9 PolarHBondContact O-N 2.96Å; H9-V12 PolarHBondContact O-N 3.23Å; H9-A13 VanDerWaalsContact O-CB 3.31Å; H9-A13 WeakPolarHBondContact O-CB 3.39Å; H9-A13 PolarHBondContact O-N 3.37Å; H9-Y58 AromaticContact CE1-CE1 3.97Å; H9-A126 PolarHBondContact CE1-O 3.47Å; H9-A126 PolarHBondContact NE2-O 3.24Å; H9-D130 IonicContact ND1-OD1 2.79Å; H9-L133 HydrophobicContact CB-CD1 3.67Å
10R97.5Very high94.6Very high3 Ų363.8 Ų63.81%0.01135%0.351CS..Hα-helixtrans-67.8-40.4-178.7-67.8166.6175.1-170.1-9.2112.7S6 V7 L8 V12 A13 L14 Y58 A61 T62 H73 D130S6-R10 WeakPolarHBondContact O-CB 3.45Å; S6-R10 WeakPolarHBondContact O-CD 3.47Å; S6-R10 WeakPolarHBondContact O-CG 3.47Å; S6-R10 PolarHBondContact O-N 3.37Å; S6-R10 PolarHBondContact OG-NE 3.45Å; V7-R10 PolarHBondContact O-N 3.32Å; L8-R10 VanDerWaalsContact C-N 3.29Å; L8-R10 PolarHBondContact O-N 3.02Å; R10-V12 VanDerWaalsContact C-N 3.35Å; R10-A13 PolarHBondContact O-N 2.93Å; R10-L14 WeakPolarHBondContact O-CB 3.3Å; R10-L14 PolarHBondContact O-N 3.21Å; R10-Y58 HydrophobicContact CB-CD1 4.07Å; R10-Y58 HydrophobicContact CG-CD1 3.87Å; R10-Y58 HydrophobicContact CG-CE1 4.31Å; R10-A61 VanDerWaalsContact NH1-C 3.3Å; R10-A61 PolarHBondContact NH1-O 3.42Å; R10-T62 VanDerWaalsContact CD-OG1 3.28Å; R10-T62 WeakPolarHBondContact CD-OG1 3.39Å; R10-T62 PolarHBondContact NH1-OG1 2.95Å; R10-H73 PolarHBondContact NH2-NE2 3.25Å; R10-D130 WeakPolarHBondContact CG-OD1 3.36Å; R10-D130 IonicContact CZ-OD1 2.89Å; R10-D130 IonicContact CZ-OD2 3.59Å; R10-D130 IonicContact NE-OD1 3.01Å; R10-D130 PolarHBondContact NE-OD1 2.96Å; R10-D130 IonicContact NE-OD2 3.41Å; R10-D130 IonicContact NH2-OD1 3.17Å; R10-D130 PolarHBondContact NH2-OD1 2.92Å; R10-D130 IonicContact NH2-OD2 3.31Å; R10-D130 PolarHBondContact NH2-OD2 2.87Å
11S97.9Very high94.6Very high62 Ų6261.7 Ų61.743%0.43434%0.34SS..Hα-helixtrans-62.6-44.4175.4-61.60000111.1V7 L8 L14 C15V7-S11 PolarHBondContact O-N 3Å; V7-S11 PolarHBondContact O-OG 3.4Å; V7-S11 VanDerWaalsContact O-OG 3.12Å; L8-S11 PolarHBondContact O-N 3.22Å; S11-L14 PolarHBondContact O-N 2.94Å; S11-C15 PolarHBondContact O-N 2.89Å; S11-C15 PolarHBondContact O-SG 2.95Å
12V98.3Very high95.5Very high91 Ų9158 Ų5855%0.55232%0.319SS*.Hα-helixtrans-62.9-47.7176.1172.80000110.9L8 H9 R10 L14 C15 F16L8-V12 HydrophobicContact CD1-CG2 4.43Å; L8-V12 WeakPolarHBondContact O-CG2 3.44Å; L8-V12 PolarHBondContact O-N 3.19Å; H9-V12 PolarHBondContact O-N 3.23Å; R10-V12 VanDerWaalsContact C-N 3.35Å; V12-L14 PolarHBondContact O-N 3.37Å; V12-C15 PolarHBondContact O-N 3.08Å; V12-F16 VanDerWaalsContact O-CB 3.29Å; V12-F16 WeakPolarHBondContact O-CB 3.49Å; V12-F16 PolarHBondContact O-N 2.91Å
13A98.4Very high95.9Very high8 Ų857.5 Ų57.57%0.06631%0.306CS..Hα-helixtrans-61.4-43.2178.100000111.9H9 R10 F16 F17 Y58H9-A13 VanDerWaalsContact O-CB 3.31Å; H9-A13 WeakPolarHBondContact O-CB 3.39Å; H9-A13 PolarHBondContact O-N 3.37Å; R10-A13 PolarHBondContact O-N 2.93Å; A13-F16 PolarHBondContact O-N 3.3Å; A13-F17 HydrophobicContact CB-CD2 4.42Å; A13-F17 HydrophobicContact CB-CE2 4.22Å; A13-F17 WeakPolarHBondContact O-CD2 3.37Å; A13-F17 PolarHBondContact O-N 2.97Å; A13-Y58 HydrophobicContact CB-CD1 3.95Å; A13-Y58 HydrophobicContact CB-CD2 3.91Å; A13-Y58 HydrophobicContact CB-CE1 3.81Å; A13-Y58 HydrophobicContact CB-CE2 3.79Å; A13-Y58 HydrophobicContact CB-CG 4.01Å
14L98.5Very high96.2Very high41 Ų4152.6 Ų52.622%0.21528%0.28CS..Hα-helixtrans-59.6-52177.318060000111.3R10 S11 V12 F16 F17 I18 I55 A59R10-L14 WeakPolarHBondContact O-CB 3.3Å; R10-L14 PolarHBondContact O-N 3.21Å; S11-L14 PolarHBondContact O-N 2.94Å; V12-L14 PolarHBondContact O-N 3.37Å; L14-F16 VanDerWaalsContact C-N 3.3Å; L14-F16 PolarHBondContact O-N 3.01Å; L14-F17 PolarHBondContact O-N 3.21Å; L14-I18 HydrophobicContact CD1-CD1 3.94Å; L14-I18 HydrophobicContact CD1-CG1 4.36Å; L14-I18 HydrophobicContact CG-CD1 3.95Å; L14-I18 VanDerWaalsContact O-CG1 3.29Å; L14-I18 WeakPolarHBondContact O-CG1 3.4Å; L14-I18 PolarHBondContact O-N 3.4Å; L14-I55 HydrophobicContact CD1-CB 4.32Å; L14-I55 HydrophobicContact CD1-CG2 3.79Å; L14-I55 WeakPolarHBondContact CD1-O 3.45Å; L14-A59 HydrophobicContact CD1-CB 4.27Å; L14-A59 HydrophobicContact CD2-CB 4.4Å
15C98.4Very high96.2Very high86 Ų8648.1 Ų48.158%0.58125%0.252SS*.Hα-helixtrans-59.7-42177-68.50000111.8S11 V12 I18 Y19S11-C15 PolarHBondContact O-N 2.89Å; S11-C15 PolarHBondContact O-SG 2.95Å; V12-C15 PolarHBondContact O-N 3.08Å; C15-I18 PolarHBondContact O-N 3.01Å; C15-Y19 WeakPolarHBondContact O-CB 3.5Å; C15-Y19 PolarHBondContact O-N 3.23Å
16F98.5Very high96Very high63 Ų6347.6 Ų47.628%0.27625%0.248SC..Hα-helixtrans-60.2-50.8177.4177.2-99.9000111.8V12 A13 L14 I18 Y19 I20 A118 I122V12-F16 VanDerWaalsContact O-CB 3.29Å; V12-F16 WeakPolarHBondContact O-CB 3.49Å; V12-F16 PolarHBondContact O-N 2.91Å; A13-F16 PolarHBondContact O-N 3.3Å; L14-F16 VanDerWaalsContact C-N 3.3Å; L14-F16 PolarHBondContact O-N 3.01Å; F16-I18 PolarHBondContact O-N 2.92Å; F16-Y19 WeakPolarHBondContact O-CB 3.36Å; F16-Y19 PolarHBondContact O-N 3.38Å; F16-Y19 VanDerWaalsContact O-N 3.16Å; F16-I20 HydrophobicContact CD1-CG1 4.27Å; F16-I20 HydrophobicContact CE1-CD1 4.39Å; F16-I20 HydrophobicContact CE1-CG1 3.85Å; F16-I20 HydrophobicContact CE2-CD1 4.15Å; F16-I20 HydrophobicContact CE2-CG1 4.34Å; F16-I20 HydrophobicContact CZ-CD1 3.91Å; F16-I20 HydrophobicContact CZ-CG1 3.9Å; F16-I20 WeakPolarHBondContact O-CG1 3.43Å; F16-I20 PolarHBondContact O-N 3.49Å; F16-A118 HydrophobicContact CE1-CB 4.37Å; F16-A118 HydrophobicContact CZ-CB 3.76Å; F16-I122 HydrophobicContact CE1-CB 4.47Å; F16-I122 HydrophobicContact CE1-CD1 4.36Å; F16-I122 HydrophobicContact CE1-CG2 3.87Å; F16-I122 HydrophobicContact CZ-CD1 3.9Å; F16-I122 HydrophobicContact CZ-CG2 4.4Å
17F98.3Very high95.8Very high2 Ų250.1 Ų50.11%0.00926%0.261CS..Hα-helixtrans-70.2-32.5-178.5-69.4-60000113.1A13 L14 Y19 I20 V21 I51 Q54 I55 Y58 I122 A126A13-F17 HydrophobicContact CB-CD2 4.42Å; A13-F17 HydrophobicContact CB-CE2 4.22Å; A13-F17 WeakPolarHBondContact O-CD2 3.37Å; A13-F17 PolarHBondContact O-N 2.97Å; L14-F17 PolarHBondContact O-N 3.21Å; F17-Y19 VanDerWaalsContact C-N 3.32Å; F17-I20 PolarHBondContact O-N 3.42Å; F17-V21 PolarHBondContact O-N 3.23Å; F17-I51 HydrophobicContact CB-CG2 4.06Å; F17-I51 HydrophobicContact CD1-CG2 4.11Å; F17-I51 HydrophobicContact CG-CG2 4.48Å; F17-Q54 HydrophobicContact CD1-CB 4.44Å; F17-Q54 HydrophobicContact CD2-CB 3.86Å; F17-Q54 HydrophobicContact CE2-CB 4.22Å; F17-Q54 HydrophobicContact CE2-CG 4.47Å; F17-Q54 HydrophobicContact CG-CB 4.02Å; F17-I55 HydrophobicContact CB-CD1 4.47Å; F17-I55 HydrophobicContact CB-CG1 3.78Å; F17-Y58 AromaticContact CD2-CD2 3.88Å; F17-Y58 HydrophobicContact CD2-CD2 3.88Å; F17-Y58 AromaticContact CD2-CE2 3.81Å; F17-Y58 HydrophobicContact CD2-CE2 3.81Å; F17-Y58 HydrophobicContact CE2-CD2 4.07Å; F17-Y58 AromaticContact CE2-CE2 3.51Å; F17-Y58 HydrophobicContact CE2-CE2 3.51Å; F17-I122 HydrophobicContact CZ-CG2 4.41Å; F17-A126 HydrophobicContact CZ-CB 4.49Å
18I97.5Very high95.5Very high86 Ų8652 Ų5244%0.44126%0.264SS..Hα-helixtrans-60.1-45.9169.1-70.7168.8000110.1L14 C15 F16 I20 V21 F22 I55L14-I18 HydrophobicContact CD1-CD1 3.94Å; L14-I18 HydrophobicContact CD1-CG1 4.36Å; L14-I18 HydrophobicContact CG-CD1 3.95Å; L14-I18 VanDerWaalsContact O-CG1 3.29Å; L14-I18 WeakPolarHBondContact O-CG1 3.4Å; L14-I18 PolarHBondContact O-N 3.4Å; C15-I18 PolarHBondContact O-N 3.01Å; F16-I18 PolarHBondContact O-N 2.92Å; I18-I20 VanDerWaalsContact C-N 3.33Å; I18-I20 PolarHBondContact O-N 3.37Å; I18-V21 PolarHBondContact O-N 2.76Å; I18-F22 PolarHBondContact O-N 3.4Å; I18-I55 HydrophobicContact CG1-CD1 3.97Å; I18-I55 HydrophobicContact CG1-CG1 4.11Å; I18-I55 HydrophobicContact CG1-CG2 4.15Å
19Y97Very high95.1Very high108 Ų10848.9 Ų48.942%0.42425%0.247SC..Hα-helixtrans-60.6-40.7176171.3-102.6000112.1C15 F16 F17 V21 F22 Y23 W114C15-Y19 WeakPolarHBondContact O-CB 3.5Å; C15-Y19 PolarHBondContact O-N 3.23Å; F16-Y19 WeakPolarHBondContact O-CB 3.36Å; F16-Y19 PolarHBondContact O-N 3.38Å; F16-Y19 VanDerWaalsContact O-N 3.16Å; F17-Y19 VanDerWaalsContact C-N 3.32Å; Y19-V21 PolarHBondContact O-N 3.26Å; Y19-F22 HydrophobicContact CD2-CD1 4.47Å; Y19-F22 WeakPolarHBondContact O-CB 3.49Å; Y19-F22 PolarHBondContact O-N 3.36Å; Y19-Y23 WeakPolarHBondContact O-CB 3.09Å; Y19-Y23 PolarHBondContact O-N 2.9Å; Y19-W114 HydrophobicContact CE1-CH2 4.49Å
20I96.9Very high94.6Very high0 Ų049 Ų490%026%0.258CS..Hα-helixtrans-63-40.2176.4-63-53.2000111.8F16 F17 I18 Y23 T24 I51 W114 Y115 A118 C119F16-I20 HydrophobicContact CD1-CG1 4.27Å; F16-I20 HydrophobicContact CE1-CD1 4.39Å; F16-I20 HydrophobicContact CE1-CG1 3.85Å; F16-I20 HydrophobicContact CE2-CD1 4.15Å; F16-I20 HydrophobicContact CE2-CG1 4.34Å; F16-I20 HydrophobicContact CZ-CD1 3.91Å; F16-I20 HydrophobicContact CZ-CG1 3.9Å; F16-I20 WeakPolarHBondContact O-CG1 3.43Å; F16-I20 PolarHBondContact O-N 3.49Å; F17-I20 PolarHBondContact O-N 3.42Å; I18-I20 VanDerWaalsContact C-N 3.33Å; I18-I20 PolarHBondContact O-N 3.37Å; I20-Y23 PolarHBondContact O-N 3.18Å; I20-T24 WeakPolarHBondContact O-CB 3.46Å; I20-T24 PolarHBondContact O-N 3.46Å; I20-T24 PolarHBondContact O-OG1 3.28Å; I20-I51 HydrophobicContact CG2-CD1 3.82Å; I20-W114 HydrophobicContact CD1-CZ3 4.12Å; I20-Y115 HydrophobicContact CG2-CE2 4.12Å; I20-A118 HydrophobicContact CD1-CB 3.61Å; I20-A118 HydrophobicContact CG1-CB 4.16Å; I20-C119 VanDerWaalsContact CG2-SG 3.55Å
21V94.5Very high94Very high20 Ų2056.4 Ų56.412%0.12130%0.297CS..Hα-helixtrans-63.1-44.1174.4172.90000111F17 I18 Y19 T24 Y25 L39 I51 I55F17-V21 PolarHBondContact O-N 3.23Å; I18-V21 PolarHBondContact O-N 2.76Å; Y19-V21 PolarHBondContact O-N 3.26Å; V21-T24 WeakPolarHBondContact O-CB 3.3Å; V21-T24 PolarHBondContact O-N 3.16Å; V21-Y25 PolarHBondContact O-N 3.23Å; V21-L39 HydrophobicContact CG1-CD1 3.72Å; V21-I51 HydrophobicContact CG2-CB 4.47Å; V21-I51 HydrophobicContact CG2-CG2 3.58Å; V21-I55 HydrophobicContact CB-CD1 4.48Å; V21-I55 HydrophobicContact CG2-CD1 3.67Å
22F92.9Very high93.5Very high109 Ų10958.3 Ų58.348%0.47830%0.303SS..Hα-helixtrans-61.1-46.6175.8173.6-99.5000112I18 Y19 T24 Y25 Q26I18-F22 PolarHBondContact O-N 3.4Å; Y19-F22 HydrophobicContact CD2-CD1 4.47Å; Y19-F22 WeakPolarHBondContact O-CB 3.49Å; Y19-F22 PolarHBondContact O-N 3.36Å; F22-T24 VanDerWaalsContact C-N 3.32Å; F22-T24 PolarHBondContact O-N 3.13Å; F22-Y25 WeakPolarHBondContact O-CB 3.43Å; F22-Y25 PolarHBondContact O-N 2.99Å; F22-Y25 VanDerWaalsContact O-N 3.16Å; F22-Q26 HydrophobicContact CE1-CG 4.09Å; F22-Q26 HydrophobicContact CE2-CG 4.41Å; F22-Q26 VanDerWaalsContact CZ-CD 3.43Å; F22-Q26 HydrophobicContact CZ-CG 4.03Å; F22-Q26 PolarHBondContact O-N 2.94Å
23Y93.4Very high93.1Very high46 Ų4658.3 Ų58.318%0.1831%0.305CS..Hα-helixtrans-63.7-38.6177.4-173.5-90.7000111.9Y19 I20 Y25 Q26 L27 W114 Y115Y19-Y23 WeakPolarHBondContact O-CB 3.09Å; Y19-Y23 PolarHBondContact O-N 2.9Å; I20-Y23 PolarHBondContact O-N 3.18Å; Y23-Y25 VanDerWaalsContact C-N 3.33Å; Y23-Y25 PolarHBondContact O-N 3.44Å; Y23-Q26 PolarHBondContact O-N 2.91Å; Y23-L27 WeakPolarHBondContact O-CB 3.3Å; Y23-L27 PolarHBondContact O-N 3.38Å; Y23-W114 AromaticContact CD1-CH2 3.9Å; Y23-W114 HydrophobicContact CD1-CH2 3.9Å; Y23-W114 HydrophobicContact CD1-CZ2 4.44Å; Y23-W114 HydrophobicContact CD2-CH2 4.1Å; Y23-W114 HydrophobicContact CD2-CZ2 4.47Å; Y23-W114 AromaticContact CE1-CH2 3.71Å; Y23-W114 HydrophobicContact CE1-CH2 3.71Å; Y23-W114 AromaticContact CE1-CZ2 3.8Å; Y23-W114 HydrophobicContact CE1-CZ2 3.8Å; Y23-W114 AromaticContact CE2-CH2 3.95Å; Y23-W114 HydrophobicContact CE2-CH2 3.95Å; Y23-W114 AromaticContact CE2-CZ2 3.86Å; Y23-W114 HydrophobicContact CE2-CZ2 3.86Å; Y23-W114 HydrophobicContact CG-CH2 4.07Å; Y23-W114 AromaticContact CZ-CH2 3.75Å; Y23-W114 AromaticContact CZ-CZ2 3.49Å; Y23-W114 VanDerWaalsContact CZ-CZ2 3.49Å; Y23-Y115 AromaticContact CD1-CD2 3.38Å; Y23-Y115 HydrophobicContact CD1-CD2 3.38Å; Y23-Y115 AromaticContact CD1-CE2 3.63Å; Y23-Y115 HydrophobicContact CD1-CE2 3.63Å; Y23-Y115 HydrophobicContact CD1-CG 4.28Å; Y23-Y115 AromaticContact CE1-CD2 3.65Å; Y23-Y115 HydrophobicContact CE1-CD2 3.65Å; Y23-Y115 HydrophobicContact CE1-CE2 4.21Å; Y23-Y115 HydrophobicContact CE1-CG 4.11Å
24T92.6Very high92.6Very high1 Ų163.9 Ų63.91%0.00633%0.328CS..Hα-helixtrans-57-50.3171.9-54.40000109.7I20 V21 F22 Q26 L27 F28 L42 I48 Y115I20-T24 WeakPolarHBondContact O-CB 3.46Å; I20-T24 PolarHBondContact O-N 3.46Å; I20-T24 PolarHBondContact O-OG1 3.28Å; V21-T24 WeakPolarHBondContact O-CB 3.3Å; V21-T24 PolarHBondContact O-N 3.16Å; F22-T24 VanDerWaalsContact C-N 3.32Å; F22-T24 PolarHBondContact O-N 3.13Å; T24-Q26 VanDerWaalsContact C-N 3.31Å; T24-Q26 PolarHBondContact O-N 2.91Å; T24-L27 WeakPolarHBondContact O-CB 3.45Å; T24-L27 PolarHBondContact O-N 3.15Å; T24-L27 VanDerWaalsContact O-N 3.09Å; T24-F28 HydrophobicContact CG2-CD2 3.84Å; T24-F28 HydrophobicContact CG2-CE2 3.93Å; T24-F28 WeakPolarHBondContact O-CD2 3.49Å; T24-F28 PolarHBondContact O-N 2.87Å; T24-F28 VanDerWaalsContact O-N 3.12Å; T24-L42 HydrophobicContact CG2-CD1 4.09Å; T24-I48 HydrophobicContact CG2-CD1 3.55Å; T24-I48 HydrophobicContact CG2-CG1 4.22Å; T24-Y115 WeakPolarHBondContact CG2-OH 3.47Å; T24-Y115 PolarHBondContact OG1-OH 3.46Å
25Y91.5Very high92.2Very high9 Ų965.9 Ų65.94%0.03534%0.336CS..Hα-helixtrans-55.6-47.8179-172.8-85.6000111.4V21 F22 Y23 L27 F28 H29 P33 F34 H35 D38V21-Y25 PolarHBondContact O-N 3.23Å; F22-Y25 WeakPolarHBondContact O-CB 3.43Å; F22-Y25 PolarHBondContact O-N 2.99Å; F22-Y25 VanDerWaalsContact O-N 3.16Å; Y23-Y25 VanDerWaalsContact C-N 3.33Å; Y23-Y25 PolarHBondContact O-N 3.44Å; Y25-L27 VanDerWaalsContact C-N 3.31Å; Y25-L27 PolarHBondContact O-N 3.07Å; Y25-F28 PolarHBondContact O-N 3.1Å; Y25-H29 HydrophobicContact CD1-CB 4.29Å; Y25-H29 HydrophobicContact CE1-CB 3.89Å; Y25-H29 AromaticContact CE2-CD2 3.95Å; Y25-H29 WeakPolarHBondContact O-CB 3.47Å; Y25-H29 PolarHBondContact O-N 3.15Å; Y25-P33 PolarHBondContact OH-O 3.38Å; Y25-F34 AromaticContact CD2-CD2 3.97Å; Y25-F34 HydrophobicContact CD2-CD2 3.97Å; Y25-F34 HydrophobicContact CD2-CE2 4.13Å; Y25-F34 HydrophobicContact CE1-CD2 4.39Å; Y25-F34 AromaticContact CE2-CD2 3.8Å; Y25-F34 HydrophobicContact CE2-CD2 3.8Å; Y25-F34 HydrophobicContact CE2-CE2 4.15Å; Y25-F34 HydrophobicContact CG-CD2 4.32Å; Y25-F34 WeakPolarHBondContact OH-CA 3.31Å; Y25-H35 PolarHBondContact OH-N 3.35Å; Y25-D38 HydrophobicContact CE2-CB 3.77Å
26Q91Very high91.7Very high70 Ų7069.1 Ų69.133%0.32734%0.34SS..Hα-helixtrans-63.1-34.8177.4-68.6-172.2-46.100113.3F22 Y23 T24 F28 G30F22-Q26 HydrophobicContact CE1-CG 4.09Å; F22-Q26 HydrophobicContact CE2-CG 4.41Å; F22-Q26 VanDerWaalsContact CZ-CD 3.43Å; F22-Q26 HydrophobicContact CZ-CG 4.03Å; F22-Q26 PolarHBondContact O-N 2.94Å; Y23-Q26 PolarHBondContact O-N 2.91Å; T24-Q26 VanDerWaalsContact C-N 3.31Å; T24-Q26 PolarHBondContact O-N 2.91Å; Q26-F28 VanDerWaalsContact C-N 3.33Å; Q26-F28 PolarHBondContact O-N 3.4Å; Q26-G30 WeakPolarHBondContact CA-O 3.45Å; Q26-G30 WeakPolarHBondContact O-CA 3.31Å; Q26-G30 PolarHBondContact O-N 2.94Å
27L89.8Confident91.3Very high55 Ų5573 Ų7329%0.28836%0.357SS..Hα-helixtrans-67-35.8178.5-170.567.7000111.9Y23 T24 Y25 V111 Y115Y23-L27 WeakPolarHBondContact O-CB 3.3Å; Y23-L27 PolarHBondContact O-N 3.38Å; T24-L27 WeakPolarHBondContact O-CB 3.45Å; T24-L27 PolarHBondContact O-N 3.15Å; T24-L27 VanDerWaalsContact O-N 3.09Å; Y25-L27 VanDerWaalsContact C-N 3.31Å; Y25-L27 PolarHBondContact O-N 3.07Å; L27-V111 HydrophobicContact CD2-CG1 4.49Å; L27-V111 HydrophobicContact CD2-CG2 4.18Å; L27-Y115 HydrophobicContact CD2-CE1 4.17Å
28F87.5Confident90.9Very high93 Ų9374.4 Ų74.441%0.40837%0.365SS..Hα-helixtrans-91.9-29.7-178.1-78.3-86.1000114.2T24 Y25 Q26 L42 F45T24-F28 HydrophobicContact CG2-CD2 3.84Å; T24-F28 HydrophobicContact CG2-CE2 3.93Å; T24-F28 WeakPolarHBondContact O-CD2 3.49Å; T24-F28 PolarHBondContact O-N 2.87Å; T24-F28 VanDerWaalsContact O-N 3.12Å; Y25-F28 PolarHBondContact O-N 3.1Å; Q26-F28 VanDerWaalsContact C-N 3.33Å; Q26-F28 PolarHBondContact O-N 3.4Å; F28-L42 HydrophobicContact CB-CD2 4.15Å; F28-L42 HydrophobicContact CD1-CD2 4.22Å; F28-L42 HydrophobicContact CD2-CD2 3.84Å; F28-L42 HydrophobicContact CE2-CD2 4.3Å; F28-L42 HydrophobicContact CG-CD2 3.8Å; F28-F45 HydrophobicContact CE1-CE2 4.28Å; F28-F45 HydrophobicContact CZ-CE2 4.13Å
29H88.7Confident90.5Very high40 Ų4071.9 Ų71.919%0.18535%0.352CS..Hα-helixtrans-119.84.4-173.8-61.1-80.6000113.4Y25 N31 D32Y25-H29 HydrophobicContact CD1-CB 4.29Å; Y25-H29 HydrophobicContact CE1-CB 3.89Å; Y25-H29 AromaticContact CE2-CD2 3.95Å; Y25-H29 WeakPolarHBondContact O-CB 3.47Å; Y25-H29 PolarHBondContact O-N 3.15Å; H29-N31 PolarHBondContact O-N 3.39Å; H29-D32 HydrophobicContact CB-CB 4.43Å; H29-D32 VanDerWaalsContact O-CB 3.28Å; H29-D32 WeakPolarHBondContact O-CB 3.43Å; H29-D32 VanDerWaalsContact O-CG 3.25Å; H29-D32 PolarHBondContact O-N 3.16Å; H29-D32 VanDerWaalsContact O-N 3.14Å
30G87.3Confident90.1Very high37 Ų3768.6 Ų68.638%0.38135%0.347SS..THydrogen-bonded Turntrans59.6-130.7-178.600000112.4Q26Q26-G30 WeakPolarHBondContact CA-O 3.45Å; Q26-G30 WeakPolarHBondContact O-CA 3.31Å; Q26-G30 PolarHBondContact O-N 2.94Å
31N85.9Confident89.7Confident157 Ų15773.4 Ų73.484%0.8437%0.368SS*.THydrogen-bonded Turntrans-96.914.8178.5-66.5-38.9000112.8H29H29-N31 PolarHBondContact O-N 3.39Å
32D87.6Confident89.6Confident102 Ų10272.5 Ų72.555%0.54536%0.363SS..PPolyproline II helixtrans-60.5145.8177.6-70.3-13.8000110.4H29H29-D32 HydrophobicContact CB-CB 4.43Å; H29-D32 VanDerWaalsContact O-CB 3.28Å; H29-D32 WeakPolarHBondContact O-CB 3.43Å; H29-D32 VanDerWaalsContact O-CG 3.25Å; H29-D32 PolarHBondContact O-N 3.16Å; H29-D32 VanDerWaalsContact O-N 3.14Å
33P89.2Confident89.6Confident91 Ų9170 Ų7059%0.59135%0.354SS*.PPolyproline II helixtrans-53.5145.6175.8-2534.2000111.6Y25 H35Y25-P33 PolarHBondContact OH-O 3.38Å; P33-H35 PolarHBondContact O-CD2 3.29Å; P33-H35 PolarHBondContact O-N 3.18Å
34F88.3Confident89.6Confident126 Ų12669.3 Ų69.355%0.55335%0.351SS*.PPolyproline II helixtrans-63.8123.5178.4177.9-95.7000111.3Y25 L39Y25-F34 AromaticContact CD2-CD2 3.97Å; Y25-F34 HydrophobicContact CD2-CD2 3.97Å; Y25-F34 HydrophobicContact CD2-CE2 4.13Å; Y25-F34 HydrophobicContact CE1-CD2 4.39Å; Y25-F34 AromaticContact CE2-CD2 3.8Å; Y25-F34 HydrophobicContact CE2-CD2 3.8Å; Y25-F34 HydrophobicContact CE2-CE2 4.15Å; Y25-F34 HydrophobicContact CG-CD2 4.32Å; Y25-F34 WeakPolarHBondContact OH-CA 3.31Å; F34-L39 HydrophobicContact CE2-CB 4.09Å; F34-L39 HydrophobicContact CE2-CD2 4.16Å; F34-L39 HydrophobicContact CZ-CB 4.14Å; F34-L39 HydrophobicContact CZ-CD2 3.87Å
35H89.8Confident89.6Confident83 Ų8370.7 Ų70.738%0.38436%0.357SS..  trans-122.8130.4170.7-59.3-65.8000111.1Y25 P33 K37 D38 L39Y25-H35 PolarHBondContact OH-N 3.35Å; P33-H35 PolarHBondContact O-CD2 3.29Å; P33-H35 PolarHBondContact O-N 3.18Å; H35-K37 HydrophobicContact CB-CG 3.95Å; H35-K37 PolarHBondContact O-N 3.37Å; H35-D38 HydrophobicContact CB-CB 4.43Å; H35-D38 WeakPolarHBondContact CB-OD2 3.28Å; H35-D38 IonicContact CD2-OD2 3.57Å; H35-D38 IonicContact CG-OD2 3.87Å; H35-D38 WeakPolarHBondContact O-CB 3.14Å; H35-D38 PolarHBondContact O-N 3.16Å; H35-L39 PolarHBondContact O-N 3.45Å
36F88Confident89.9Confident154 Ų15471.5 Ų71.568%0.67536%0.362SS*.Hα-helixtrans-59.8-34.4-179.4-175.8-97.4000113.1D38 L39 A40F36-D38 PolarHBondContact O-N 3Å; F36-L39 PolarHBondContact O-N 3.02Å; F36-A40 WeakPolarHBondContact O-CB 3.47Å; F36-A40 PolarHBondContact O-N 3.31Å
37K90.3Very high90.1Very high143 Ų14369 Ų6962%0.62235%0.351SS*.Hα-helixtrans-59.4-34.9175.859.8170.6-169.8178.20112.6H35 A40 F41H35-K37 HydrophobicContact CB-CG 3.95Å; H35-K37 PolarHBondContact O-N 3.37Å; K37-A40 PolarHBondContact O-N 3.07Å; K37-F41 WeakPolarHBondContact O-CB 3.45Å; K37-F41 PolarHBondContact O-N 3.01Å
38D90.1Very high90.4Very high33 Ų3366.7 Ų66.718%0.17634%0.339CS..Hα-helixtrans-77.4-40.6-176.5-65.5-18.6000109.3Y25 H35 F36 A40 F41 L42Y25-D38 HydrophobicContact CE2-CB 3.77Å; H35-D38 HydrophobicContact CB-CB 4.43Å; H35-D38 WeakPolarHBondContact CB-OD2 3.28Å; H35-D38 IonicContact CD2-OD2 3.57Å; H35-D38 IonicContact CG-OD2 3.87Å; H35-D38 WeakPolarHBondContact O-CB 3.14Å; H35-D38 PolarHBondContact O-N 3.16Å; F36-D38 PolarHBondContact O-N 3Å; D38-A40 PolarHBondContact O-N 2.9Å; D38-F41 WeakPolarHBondContact O-CB 3.32Å; D38-F41 PolarHBondContact O-N 3.38Å; D38-L42 WeakPolarHBondContact O-CG 3.17Å; D38-L42 PolarHBondContact O-N 3.24Å; D38-L42 VanDerWaalsContact O-N 3.09Å
39L87.9Confident90.8Very high32 Ų3264.2 Ų64.217%0.16833%0.33CS..Hα-helixtrans-60.2-44.2168.4179.662.5000112.1V21 F34 H35 F36 F41 L42 L43V21-L39 HydrophobicContact CG1-CD1 3.72Å; F34-L39 HydrophobicContact CE2-CB 4.09Å; F34-L39 HydrophobicContact CE2-CD2 4.16Å; F34-L39 HydrophobicContact CZ-CB 4.14Å; F34-L39 HydrophobicContact CZ-CD2 3.87Å; H35-L39 PolarHBondContact O-N 3.45Å; F36-L39 PolarHBondContact O-N 3.02Å; L39-F41 VanDerWaalsContact C-N 3.26Å; L39-F41 PolarHBondContact O-N 3.3Å; L39-L42 WeakPolarHBondContact O-CB 3.45Å; L39-L42 PolarHBondContact O-N 3.05Å; L39-L42 VanDerWaalsContact O-N 3.1Å; L39-L43 PolarHBondContact O-N 2.93Å
40A89Confident91.3Very high40 Ų4062.4 Ų62.433%0.33132%0.322SS..Hα-helixtrans-61.6-36.8177.500000111.6F36 K37 D38 L42 L43F36-A40 WeakPolarHBondContact O-CB 3.47Å; F36-A40 PolarHBondContact O-N 3.31Å; K37-A40 PolarHBondContact O-N 3.07Å; D38-A40 PolarHBondContact O-N 2.9Å; A40-L42 VanDerWaalsContact C-N 3.33Å; A40-L42 PolarHBondContact O-N 3.44Å; A40-L43 WeakPolarHBondContact O-CB 3.47Å; A40-L43 PolarHBondContact O-N 2.72Å
41F88.7Confident91.8Very high100 Ų10060.8 Ų60.844%0.43931%0.305SS..Hα-helixtrans-63.7-37.4173.7-176-105.2000112.3K37 D38 L39 L43 R44 F168K37-F41 WeakPolarHBondContact O-CB 3.45Å; K37-F41 PolarHBondContact O-N 3.01Å; D38-F41 WeakPolarHBondContact O-CB 3.32Å; D38-F41 PolarHBondContact O-N 3.38Å; L39-F41 VanDerWaalsContact C-N 3.26Å; L39-F41 PolarHBondContact O-N 3.3Å; F41-L43 PolarHBondContact O-N 3.06Å; F41-R44 WeakPolarHBondContact O-CB 3.23Å; F41-R44 WeakPolarHBondContact O-CD 3.19Å; F41-R44 WeakPolarHBondContact O-CG 3.32Å; F41-R44 PolarHBondContact O-N 2.9Å; F41-F168 HydrophobicContact CE1-CZ 4.47Å; F41-F168 AromaticContact CE2-CE1 3.88Å; F41-F168 HydrophobicContact CE2-CE1 3.88Å; F41-F168 AromaticContact CE2-CZ 3.92Å; F41-F168 HydrophobicContact CE2-CZ 3.92Å; F41-F168 AromaticContact CZ-CE1 3.87Å; F41-F168 HydrophobicContact CZ-CE1 3.87Å; F41-F168 HydrophobicContact CZ-CE2 4.3Å; F41-F168 AromaticContact CZ-CZ 3.46Å; F41-F168 HydrophobicContact CZ-CZ 3.46Å; F41-F168 VanDerWaalsContact CZ-CZ 3.46Å
42L92.1Very high92.3Very high2 Ų255.2 Ų55.21%0.0128%0.278CS..Hα-helixtrans-66.4-22.8175.8-65.9173.1000113.4T24 F28 D38 L39 A40 R44 F45 I48T24-L42 HydrophobicContact CG2-CD1 4.09Å; F28-L42 HydrophobicContact CB-CD2 4.15Å; F28-L42 HydrophobicContact CD1-CD2 4.22Å; F28-L42 HydrophobicContact CD2-CD2 3.84Å; F28-L42 HydrophobicContact CE2-CD2 4.3Å; F28-L42 HydrophobicContact CG-CD2 3.8Å; D38-L42 WeakPolarHBondContact O-CG 3.17Å; D38-L42 PolarHBondContact O-N 3.24Å; D38-L42 VanDerWaalsContact O-N 3.09Å; L39-L42 WeakPolarHBondContact O-CB 3.45Å; L39-L42 PolarHBondContact O-N 3.05Å; L39-L42 VanDerWaalsContact O-N 3.1Å; A40-L42 VanDerWaalsContact C-N 3.33Å; A40-L42 PolarHBondContact O-N 3.44Å; L42-R44 PolarHBondContact O-N 2.95Å; L42-R44 VanDerWaalsContact O-N 3.12Å; L42-F45 HydrophobicContact CD2-CE2 4.35Å; L42-F45 WeakPolarHBondContact O-CD2 3.31Å; L42-F45 PolarHBondContact O-N 3.43Å; L42-I48 HydrophobicContact CB-CG2 4.26Å
43L92Very high92.8Very high55 Ų5551.2 Ų51.229%0.28826%0.256SS..THydrogen-bonded Turntrans-66.2-9.4175.3-63.7176.1000113.6L39 A40 F41 F45 I48 L49L39-L43 PolarHBondContact O-N 2.93Å; A40-L43 WeakPolarHBondContact O-CB 3.47Å; A40-L43 PolarHBondContact O-N 2.72Å; F41-L43 PolarHBondContact O-N 3.06Å; L43-F45 PolarHBondContact O-N 3.29Å; L43-I48 HydrophobicContact CD2-CG2 4.18Å; L43-L49 HydrophobicContact CD2-CD1 4.18Å
44R93.5Very high93.2Very high33 Ų3346.9 Ų46.913%0.12523%0.228CC..THydrogen-bonded Turntrans-56.9-27.8167.275-175.9174.5113.4-6.6112.5F41 L42 Y155 L162 F168 P170F41-R44 WeakPolarHBondContact O-CB 3.23Å; F41-R44 WeakPolarHBondContact O-CD 3.19Å; F41-R44 WeakPolarHBondContact O-CG 3.32Å; F41-R44 PolarHBondContact O-N 2.9Å; L42-R44 PolarHBondContact O-N 2.95Å; L42-R44 VanDerWaalsContact O-N 3.12Å; R44-Y155 VanDerWaalsContact O-CE2 3.28Å; R44-Y155 WeakPolarHBondContact O-CE2 3.07Å; R44-Y155 PolarHBondContact O-OH 3.31Å; R44-L162 HydrophobicContact CB-CD1 4.05Å; R44-F168 VanDerWaalsContact CD-CE1 3.5Å; R44-P170 HydrophobicContact CB-CB 4.5Å; R44-P170 PolarHBondContact NH1-O 2.89Å
45F94.3Very high93.7Very high29 Ų2942.8 Ų42.813%0.12721%0.212CC..SBendtrans-87.4122177.1-61.2-62.1000109.7F28 L42 L43 T47 I48 L49 P170 Y171F28-F45 HydrophobicContact CE1-CE2 4.28Å; F28-F45 HydrophobicContact CZ-CE2 4.13Å; L42-F45 HydrophobicContact CD2-CE2 4.35Å; L42-F45 WeakPolarHBondContact O-CD2 3.31Å; L42-F45 PolarHBondContact O-N 3.43Å; L43-F45 PolarHBondContact O-N 3.29Å; F45-T47 PolarHBondContact O-N 3.5Å; F45-T47 VanDerWaalsContact O-N 3.11Å; F45-I48 HydrophobicContact CB-CG1 4.07Å; F45-I48 HydrophobicContact CD2-CG1 4.48Å; F45-I48 PolarHBondContact O-N 2.87Å; F45-L49 PolarHBondContact O-N 3.35Å; F45-L49 VanDerWaalsContact O-N 3.09Å; F45-P170 WeakPolarHBondContact CE1-O 3.49Å; F45-Y171 WeakPolarHBondContact CA-OH 3.46Å; F45-Y171 HydrophobicContact CD1-CD1 4.38Å; F45-Y171 AromaticContact CD1-CE1 3.72Å; F45-Y171 HydrophobicContact CD1-CE1 3.72Å; F45-Y171 AromaticContact CD1-CZ 3.95Å; F45-Y171 HydrophobicContact CE1-CE1 4.3Å
46L96Very high94.1Very high27 Ų2740.9 Ų40.914%0.14121%0.211CC..Hα-helixtrans-55.9-32.3178.5-174.957.1000112.2L49 T50 V87 Y151 F152 Y155 Y171L46-L49 HydrophobicContact CD1-CD2 4.3Å; L46-T50 VanDerWaalsContact O-CB 3.27Å; L46-T50 WeakPolarHBondContact O-CB 3.28Å; L46-T50 PolarHBondContact O-N 3.39Å; L46-T50 PolarHBondContact O-OG1 2.78Å; L46-V87 HydrophobicContact CD2-CG2 4.06Å; L46-V87 HydrophobicContact CG-CG2 3.87Å; L46-Y151 HydrophobicContact CD1-CE1 4.08Å; L46-F152 HydrophobicContact CD1-CE1 4.41Å; L46-F152 HydrophobicContact CD2-CE1 4.4Å; L46-Y155 HydrophobicContact CB-CD1 4.45Å; L46-Y155 HydrophobicContact CB-CE1 3.78Å; L46-Y155 HydrophobicContact CB-CE2 4.17Å; L46-Y155 HydrophobicContact CD1-CD1 3.92Å; L46-Y155 HydrophobicContact CD1-CD2 4.25Å; L46-Y155 HydrophobicContact CD1-CE1 4.13Å; L46-Y155 HydrophobicContact CD1-CE2 4.46Å; L46-Y155 HydrophobicContact CD1-CG 3.99Å; L46-Y155 HydrophobicContact CD2-CD1 4.47Å; L46-Y155 HydrophobicContact CD2-CE1 4.26Å; L46-Y155 HydrophobicContact CG-CE1 4.27Å; L46-Y155 PolarHBondContact N-OH 2.9Å; L46-Y171 PolarHBondContact N-OH 3Å
47T96.1Very high94.6Very high17 Ų1733.7 Ų33.710%0.10418%0.179CC..Hα-helixtrans-60.4-49.1175.1-55.60000111.7F45 T50 I51 V87 C119 H120F45-T47 PolarHBondContact O-N 3.5Å; F45-T47 VanDerWaalsContact O-N 3.11Å; T47-T50 WeakPolarHBondContact O-CB 3.41Å; T47-T50 PolarHBondContact O-N 3.26Å; T47-T50 VanDerWaalsContact O-N 3.15Å; T47-I51 HydrophobicContact CG2-CD1 4.07Å; T47-I51 WeakPolarHBondContact O-CG1 3.34Å; T47-I51 PolarHBondContact O-N 2.88Å; T47-V87 HydrophobicContact CG2-CG1 4.36Å; T47-C119 HydrophobicContact CG2-CB 3.71Å; T47-H120 VanDerWaalsContact CG2-NE2 3.3Å; T47-H120 WeakPolarHBondContact CG2-NE2 3.3Å; T47-H120 PolarHBondContact OG1-CD2 3.42Å; T47-H120 PolarHBondContact OG1-NE2 3.37Å
48I95.2Very high95Very high6 Ų627.1 Ų27.13%0.03115%0.15CC..Hα-helixtrans-68-41-178.9-55.4-50.1000110.3T24 L42 L43 F45 T50 I51 S52T24-I48 HydrophobicContact CG2-CD1 3.55Å; T24-I48 HydrophobicContact CG2-CG1 4.22Å; L42-I48 HydrophobicContact CB-CG2 4.26Å; L43-I48 HydrophobicContact CD2-CG2 4.18Å; F45-I48 HydrophobicContact CB-CG1 4.07Å; F45-I48 HydrophobicContact CD2-CG1 4.48Å; F45-I48 PolarHBondContact O-N 2.87Å; I48-T50 PolarHBondContact O-N 3.28Å; I48-I51 HydrophobicContact CD1-CD1 4.19Å; I48-I51 PolarHBondContact O-N 3.32Å; I48-S52 PolarHBondContact O-N 2.91Å; I48-S52 PolarHBondContact O-OG 3.16Å; I48-S52 VanDerWaalsContact O-OG 3.14Å
49L96.7Very high95.3Very high41 Ų4127.8 Ų27.822%0.21516%0.16CC..Hα-helixtrans-57.5-39.9172.2-173.165.1000111.9L43 F45 L46 S52 L53 Y151 Y155L43-L49 HydrophobicContact CD2-CD1 4.18Å; F45-L49 PolarHBondContact O-N 3.35Å; F45-L49 VanDerWaalsContact O-N 3.09Å; L46-L49 HydrophobicContact CD1-CD2 4.3Å; L49-S52 WeakPolarHBondContact O-CB 3.48Å; L49-S52 PolarHBondContact O-N 2.82Å; L49-L53 PolarHBondContact O-N 3.39Å; L49-Y151 VanDerWaalsContact C-OH 3.26Å; L49-Y151 HydrophobicContact CD1-CE2 4.45Å; L49-Y151 HydrophobicContact CD2-CE2 3.93Å; L49-Y151 HydrophobicContact CG-CE2 3.74Å; L49-Y151 PolarHBondContact O-OH 3.1Å; L49-Y155 HydrophobicContact CD2-CD2 3.75Å; L49-Y155 HydrophobicContact CD2-CG 4.33Å
50T98.3Very high95.8Very high3 Ų330 Ų302%0.01817%0.172CC..Hα-helixtrans-70.4-36.7178.3-59.70000111.9L46 T47 I48 L53 Q54 A83 V87 Y151L46-T50 VanDerWaalsContact O-CB 3.27Å; L46-T50 WeakPolarHBondContact O-CB 3.28Å; L46-T50 PolarHBondContact O-N 3.39Å; L46-T50 PolarHBondContact O-OG1 2.78Å; T47-T50 WeakPolarHBondContact O-CB 3.41Å; T47-T50 PolarHBondContact O-N 3.26Å; T47-T50 VanDerWaalsContact O-N 3.15Å; I48-T50 PolarHBondContact O-N 3.28Å; T50-L53 WeakPolarHBondContact O-CB 3.32Å; T50-L53 PolarHBondContact O-N 3.34Å; T50-Q54 WeakPolarHBondContact O-CG 3.34Å; T50-Q54 PolarHBondContact O-N 3.43Å; T50-A83 HydrophobicContact CG2-CB 3.78Å; T50-V87 HydrophobicContact CG2-CG2 4.32Å; T50-V87 WeakPolarHBondContact OG1-CG2 3.37Å; T50-Y151 WeakPolarHBondContact CA-OH 3.31Å; T50-Y151 PolarHBondContact N-OH 3.38Å; T50-Y151 VanDerWaalsContact N-OH 3.1Å; T50-Y151 PolarHBondContact OG1-OH 3.48Å
51I98Very high96.2Very high3 Ų328.1 Ų28.12%0.01516%0.156CC..Hα-helixtrans-66.7-40.4172.6-64.5163000110.3F17 I20 V21 T47 I48 L53 Q54 I55 C119F17-I51 HydrophobicContact CB-CG2 4.06Å; F17-I51 HydrophobicContact CD1-CG2 4.11Å; F17-I51 HydrophobicContact CG-CG2 4.48Å; I20-I51 HydrophobicContact CG2-CD1 3.82Å; V21-I51 HydrophobicContact CG2-CB 4.47Å; V21-I51 HydrophobicContact CG2-CG2 3.58Å; T47-I51 HydrophobicContact CG2-CD1 4.07Å; T47-I51 WeakPolarHBondContact O-CG1 3.34Å; T47-I51 PolarHBondContact O-N 2.88Å; I48-I51 HydrophobicContact CD1-CD1 4.19Å; I48-I51 PolarHBondContact O-N 3.32Å; I51-L53 VanDerWaalsContact C-N 3.3Å; I51-L53 PolarHBondContact O-N 3Å; I51-Q54 WeakPolarHBondContact O-CB 3.46Å; I51-Q54 PolarHBondContact O-N 3.49Å; I51-Q54 VanDerWaalsContact O-N 3.09Å; I51-I55 WeakPolarHBondContact O-CG1 3.43Å; I51-I55 PolarHBondContact O-N 2.87Å; I51-C119 HydrophobicContact CD1-CB 4.08Å
52S96.6Very high96.5Very high39 Ų3925.5 Ų25.527%0.27315%0.149SC..Hα-helixtrans-61.1-39.1172.7-58.90000112I48 L49 Q54 I55 A56I48-S52 PolarHBondContact O-N 2.91Å; I48-S52 PolarHBondContact O-OG 3.16Å; I48-S52 VanDerWaalsContact O-OG 3.14Å; L49-S52 WeakPolarHBondContact O-CB 3.48Å; L49-S52 PolarHBondContact O-N 2.82Å; S52-Q54 VanDerWaalsContact C-N 3.34Å; S52-I55 WeakPolarHBondContact O-CB 3.48Å; S52-I55 PolarHBondContact O-N 3.19Å; S52-A56 PolarHBondContact O-N 3.44Å
53L98Very high96.7Very high19 Ų1928 Ų2810%0.09917%0.165CC..Hα-helixtrans-62.8-38.8171.8173.566.3000112L49 T50 I51 A56 Y57 L79 A80 A83 Y151L49-L53 PolarHBondContact O-N 3.39Å; T50-L53 WeakPolarHBondContact O-CB 3.32Å; T50-L53 PolarHBondContact O-N 3.34Å; I51-L53 VanDerWaalsContact C-N 3.3Å; I51-L53 PolarHBondContact O-N 3Å; L53-A56 PolarHBondContact O-N 3.49Å; L53-Y57 WeakPolarHBondContact O-CB 3.48Å; L53-Y57 PolarHBondContact O-N 2.98Å; L53-L79 HydrophobicContact CD1-CD2 3.75Å; L53-L79 HydrophobicContact CD1-CG 4.27Å; L53-L79 HydrophobicContact CD2-CD2 4.15Å; L53-L79 HydrophobicContact CD2-CG 3.86Å; L53-A80 HydrophobicContact CD2-CB 4.37Å; L53-A80 HydrophobicContact CG-CB 4.34Å; L53-A83 HydrophobicContact CD2-CB 3.74Å; L53-Y151 HydrophobicContact CB-CE2 4.14Å; L53-Y151 HydrophobicContact CD2-CD2 4.38Å; L53-Y151 HydrophobicContact CD2-CE1 4.42Å; L53-Y151 HydrophobicContact CD2-CE2 3.88Å; L53-Y151 HydrophobicContact CG-CE2 4.48Å
54Q98.3Very high96.9Very high0 Ų026.3 Ų26.30%016%0.156CC..Hα-helixtrans-61.1-45.4173.6-68.2-76.679.100111.3F17 T50 I51 S52 A56 Y57 Y58 N84 G123F17-Q54 HydrophobicContact CD1-CB 4.44Å; F17-Q54 HydrophobicContact CD2-CB 3.86Å; F17-Q54 HydrophobicContact CE2-CB 4.22Å; F17-Q54 HydrophobicContact CE2-CG 4.47Å; F17-Q54 HydrophobicContact CG-CB 4.02Å; T50-Q54 WeakPolarHBondContact O-CG 3.34Å; T50-Q54 PolarHBondContact O-N 3.43Å; I51-Q54 WeakPolarHBondContact O-CB 3.46Å; I51-Q54 PolarHBondContact O-N 3.49Å; I51-Q54 VanDerWaalsContact O-N 3.09Å; S52-Q54 VanDerWaalsContact C-N 3.34Å; Q54-A56 VanDerWaalsContact C-N 3.33Å; Q54-A56 PolarHBondContact O-N 2.81Å; Q54-Y57 PolarHBondContact O-N 3.4Å; Q54-Y58 HydrophobicContact CB-CD2 4.29Å; Q54-Y58 HydrophobicContact CB-CE2 4.31Å; Q54-Y58 WeakPolarHBondContact O-CD2 3.5Å; Q54-Y58 PolarHBondContact O-N 3.43Å; Q54-N84 PolarHBondContact NE2-ND2 3.33Å; Q54-N84 VanDerWaalsContact NE2-ND2 3.15Å; Q54-N84 PolarHBondContact NE2-OD1 2.85Å; Q54-N84 PolarHBondContact OE1-ND2 3.2Å; Q54-G123 PolarHBondContact NE2-O 2.87Å
55I98.3Very high96.7Very high39 Ų3925.3 Ų25.320%0.215%0.153CC..Hα-helixtrans-57.6-49176-66.8169.7000109.8L14 F17 I18 V21 I51 S52 Y57 Y58 A59L14-I55 HydrophobicContact CD1-CB 4.32Å; L14-I55 HydrophobicContact CD1-CG2 3.79Å; L14-I55 WeakPolarHBondContact CD1-O 3.45Å; F17-I55 HydrophobicContact CB-CD1 4.47Å; F17-I55 HydrophobicContact CB-CG1 3.78Å; I18-I55 HydrophobicContact CG1-CD1 3.97Å; I18-I55 HydrophobicContact CG1-CG1 4.11Å; I18-I55 HydrophobicContact CG1-CG2 4.15Å; V21-I55 HydrophobicContact CB-CD1 4.48Å; V21-I55 HydrophobicContact CG2-CD1 3.67Å; I51-I55 WeakPolarHBondContact O-CG1 3.43Å; I51-I55 PolarHBondContact O-N 2.87Å; S52-I55 WeakPolarHBondContact O-CB 3.48Å; S52-I55 PolarHBondContact O-N 3.19Å; I55-Y57 PolarHBondContact O-N 3.01Å; I55-Y58 PolarHBondContact O-N 3.39Å; I55-A59 VanDerWaalsContact O-CB 3.23Å; I55-A59 WeakPolarHBondContact O-CB 3.35Å; I55-A59 PolarHBondContact O-N 3.39Å
56A98.1Very high96.7Very high44 Ų4432.5 Ų32.536%0.36418%0.181SC..Hα-helixtrans-60.8-44.5177.400000112.2S52 L53 Q54 L60S52-A56 PolarHBondContact O-N 3.44Å; L53-A56 PolarHBondContact O-N 3.49Å; Q54-A56 VanDerWaalsContact C-N 3.33Å; Q54-A56 PolarHBondContact O-N 2.81Å; A56-L60 WeakPolarHBondContact O-CB 3.37Å; A56-L60 VanDerWaalsContact O-CG 3.23Å; A56-L60 WeakPolarHBondContact O-CG 3.29Å; A56-L60 PolarHBondContact O-N 3.07Å
57Y98.5Very high96.7Very high2 Ų237.8 Ų37.81%0.00820%0.203CC..Hα-helixtrans-59-54.4176.6173.1-100.2000111.3L53 Q54 I55 A59 L60 A61 L76 Y77 A80 I127 D130L53-Y57 WeakPolarHBondContact O-CB 3.48Å; L53-Y57 PolarHBondContact O-N 2.98Å; Q54-Y57 PolarHBondContact O-N 3.4Å; I55-Y57 PolarHBondContact O-N 3.01Å; Y57-A59 VanDerWaalsContact C-N 3.33Å; Y57-A59 PolarHBondContact O-N 2.83Å; Y57-L60 PolarHBondContact O-N 3.06Å; Y57-L60 VanDerWaalsContact O-N 3.15Å; Y57-A61 HydrophobicContact CE1-CB 4.28Å; Y57-A61 HydrophobicContact CE2-CB 4.35Å; Y57-A61 VanDerWaalsContact O-CB 3.23Å; Y57-A61 WeakPolarHBondContact O-CB 3.15Å; Y57-A61 PolarHBondContact O-N 2.92Å; Y57-L76 HydrophobicContact CD2-CB 4.01Å; Y57-Y77 HydrophobicContact CE2-CD2 4.47Å; Y57-A80 HydrophobicContact CD2-CB 4.36Å; Y57-A80 HydrophobicContact CG-CB 4.2Å; Y57-I127 HydrophobicContact CD1-CD1 4.32Å; Y57-I127 HydrophobicContact CE1-CD1 4.18Å; Y57-I127 HydrophobicContact CE1-CG1 4.39Å; Y57-D130 PolarHBondContact OH-OD2 2.95Å
58Y98.3Very high96.5Very high5 Ų544.5 Ų44.52%0.0223%0.23CC..Hα-helixtrans-67.8-31.8-175.9-73.6-62.6000113H9 R10 A13 F17 Q54 I55 A126 I127 D130H9-Y58 AromaticContact CE1-CE1 3.97Å; R10-Y58 HydrophobicContact CB-CD1 4.07Å; R10-Y58 HydrophobicContact CG-CD1 3.87Å; R10-Y58 HydrophobicContact CG-CE1 4.31Å; A13-Y58 HydrophobicContact CB-CD1 3.95Å; A13-Y58 HydrophobicContact CB-CD2 3.91Å; A13-Y58 HydrophobicContact CB-CE1 3.81Å; A13-Y58 HydrophobicContact CB-CE2 3.79Å; A13-Y58 HydrophobicContact CB-CG 4.01Å; F17-Y58 AromaticContact CD2-CD2 3.88Å; F17-Y58 HydrophobicContact CD2-CD2 3.88Å; F17-Y58 AromaticContact CD2-CE2 3.81Å; F17-Y58 HydrophobicContact CD2-CE2 3.81Å; F17-Y58 HydrophobicContact CE2-CD2 4.07Å; F17-Y58 AromaticContact CE2-CE2 3.51Å; F17-Y58 HydrophobicContact CE2-CE2 3.51Å; Q54-Y58 HydrophobicContact CB-CD2 4.29Å; Q54-Y58 HydrophobicContact CB-CE2 4.31Å; Q54-Y58 WeakPolarHBondContact O-CD2 3.5Å; Q54-Y58 PolarHBondContact O-N 3.43Å; I55-Y58 PolarHBondContact O-N 3.39Å; Y58-A126 VanDerWaalsContact OH-C 3.28Å; Y58-A126 PolarHBondContact OH-O 3.31Å; Y58-I127 PolarHBondContact OH-N 3.36Å; Y58-D130 HydrophobicContact CE1-CB 4.43Å
59A98.1Very high96.5Very high47 Ų4748.3 Ų48.339%0.38825%0.25SC..Hα-helixtrans-66.7-38172.200000112.4L14 I55 Y57 P63L14-A59 HydrophobicContact CD1-CB 4.27Å; L14-A59 HydrophobicContact CD2-CB 4.4Å; I55-A59 VanDerWaalsContact O-CB 3.23Å; I55-A59 WeakPolarHBondContact O-CB 3.35Å; I55-A59 PolarHBondContact O-N 3.39Å; Y57-A59 VanDerWaalsContact C-N 3.33Å; Y57-A59 PolarHBondContact O-N 2.83Å; A59-P63 VanDerWaalsContact O-CD 3.3Å; A59-P63 WeakPolarHBondContact O-CD 3.38Å; A59-P63 WeakPolarHBondContact O-CG 3.42Å
60L97.8Very high96.4Very high78 Ų7850 Ų5041%0.40826%0.256SS..Hα-helixtrans-91.1-22.6-175.9-66.5173.4000114A56 Y57 T62 P63 L64 L76A56-L60 WeakPolarHBondContact O-CB 3.37Å; A56-L60 VanDerWaalsContact O-CG 3.23Å; A56-L60 WeakPolarHBondContact O-CG 3.29Å; A56-L60 PolarHBondContact O-N 3.07Å; Y57-L60 PolarHBondContact O-N 3.06Å; Y57-L60 VanDerWaalsContact O-N 3.15Å; L60-T62 PolarHBondContact O-N 2.87Å; L60-P63 WeakPolarHBondContact O-CD 3.19Å; L60-L64 HydrophobicContact CB-CD1 3.94Å; L60-L64 HydrophobicContact CB-CG 4.31Å; L60-L64 VanDerWaalsContact O-CB 3.31Å; L60-L64 WeakPolarHBondContact O-CB 3.28Å; L60-L64 WeakPolarHBondContact O-CG 3.09Å; L60-L64 PolarHBondContact O-N 3.37Å; L60-L76 HydrophobicContact CB-CD1 4.4Å; L60-L76 HydrophobicContact CD1-CD1 4.04Å
61A97Very high96.2Very high1 Ų157.2 Ų57.21%0.00829%0.287CS..Hα-helixtrans-60.5-45-169.700000112.5R10 Y57 Q65R10-A61 VanDerWaalsContact NH1-C 3.3Å; R10-A61 PolarHBondContact NH1-O 3.42Å; Y57-A61 HydrophobicContact CE1-CB 4.28Å; Y57-A61 HydrophobicContact CE2-CB 4.35Å; Y57-A61 VanDerWaalsContact O-CB 3.23Å; Y57-A61 WeakPolarHBondContact O-CB 3.15Å; Y57-A61 PolarHBondContact O-N 2.92Å; A61-Q65 WeakPolarHBondContact O-CG 3.4Å; A61-Q65 PolarHBondContact O-N 3.35Å
62T95.4Very high96.1Very high45 Ų4560.3 Ų60.328%0.27630%0.302SS..Hα-helixtrans-69.9-49.6178.9-61.90000112.3V7 R10 L60 L64 Q65 Y66V7-T62 HydrophobicContact CG2-CG2 3.97Å; R10-T62 VanDerWaalsContact CD-OG1 3.28Å; R10-T62 WeakPolarHBondContact CD-OG1 3.39Å; R10-T62 PolarHBondContact NH1-OG1 2.95Å; L60-T62 PolarHBondContact O-N 2.87Å; T62-L64 PolarHBondContact O-N 2.93Å; T62-Q65 PolarHBondContact O-N 3.15Å; T62-Y66 WeakPolarHBondContact O-CB 3.38Å; T62-Y66 PolarHBondContact O-N 2.92Å
63P96Very high96Very high54 Ų5458.6 Ų58.635%0.35129%0.289SS..Hα-helixtrans-55-49.6173.5-2834.1000113.7A59 L60 Q65 Y66 F67A59-P63 VanDerWaalsContact O-CD 3.3Å; A59-P63 WeakPolarHBondContact O-CD 3.38Å; A59-P63 WeakPolarHBondContact O-CG 3.42Å; L60-P63 WeakPolarHBondContact O-CD 3.19Å; P63-Q65 PolarHBondContact O-N 3.4Å; P63-Q65 VanDerWaalsContact O-N 3.16Å; P63-Y66 PolarHBondContact O-N 3.2Å; P63-Y66 VanDerWaalsContact O-N 3.13Å; P63-F67 HydrophobicContact CB-CD2 4.41Å; P63-F67 HydrophobicContact CB-CE2 4.41Å; P63-F67 WeakPolarHBondContact O-CD2 3.23Å; P63-F67 PolarHBondContact O-N 3.35Å
64L95.9Very high96Very high21 Ų2157.7 Ų57.711%0.1129%0.285CS..Hα-helixtrans-57.7-35.1-179.2-71.9172.8000111.8L60 T62 K68 I69 M72 H73 L76L60-L64 HydrophobicContact CB-CD1 3.94Å; L60-L64 HydrophobicContact CB-CG 4.31Å; L60-L64 VanDerWaalsContact O-CB 3.31Å; L60-L64 WeakPolarHBondContact O-CB 3.28Å; L60-L64 WeakPolarHBondContact O-CG 3.09Å; L60-L64 PolarHBondContact O-N 3.37Å; T62-L64 PolarHBondContact O-N 2.93Å; L64-K68 PolarHBondContact O-N 3.49Å; L64-I69 HydrophobicContact CD2-CB 3.97Å; L64-I69 HydrophobicContact CD2-CD1 4.17Å; L64-I69 HydrophobicContact CD2-CG2 4.14Å; L64-I69 WeakPolarHBondContact O-CA 3.23Å; L64-I69 PolarHBondContact O-N 3Å; L64-M72 HydrophobicContact CD1-CB 4.44Å; L64-M72 HydrophobicContact CD1-CG 3.96Å; L64-M72 HydrophobicContact CD2-CB 4.15Å; L64-M72 HydrophobicContact CD2-CG 3.92Å; L64-H73 HydrophobicContact CB-CB 4.12Å; L64-H73 HydrophobicContact CD1-CB 4.36Å; L64-L76 HydrophobicContact CD1-CD1 3.64Å
65Q90.6Very high95.9Very high12 Ų1257.7 Ų57.76%0.05629%0.285CS..Hα-helixtrans-76.1-43.1176.5-72.6173.8-3.100113.4A61 T62 P63 F67 K68 H73 W134A61-Q65 WeakPolarHBondContact O-CG 3.4Å; A61-Q65 PolarHBondContact O-N 3.35Å; T62-Q65 PolarHBondContact O-N 3.15Å; P63-Q65 PolarHBondContact O-N 3.4Å; P63-Q65 VanDerWaalsContact O-N 3.16Å; Q65-F67 PolarHBondContact O-N 3.13Å; Q65-K68 WeakPolarHBondContact O-CA 3.35Å; Q65-K68 PolarHBondContact O-N 2.86Å; Q65-H73 PolarHBondContact NE2-CD2 2.89Å; Q65-H73 PolarHBondContact NE2-CE1 3.46Å; Q65-H73 VanDerWaalsContact NE2-CE1 3.35Å; Q65-H73 PolarHBondContact NE2-NE2 3.04Å; Q65-W134 HydrophobicContact CB-CH2 4.18Å; Q65-W134 HydrophobicContact CB-CZ2 3.74Å; Q65-W134 VanDerWaalsContact CD-NE1 3.26Å; Q65-W134 HydrophobicContact CG-CD2 4.36Å; Q65-W134 HydrophobicContact CG-CZ2 3.81Å; Q65-W134 VanDerWaalsContact NE2-CD2 3.29Å; Q65-W134 VanDerWaalsContact NE2-CE2 3.3Å; Q65-W134 VanDerWaalsContact OE1-CE3 3.31Å
66Y92.7Very high95.8Very high180 Ų18056.7 Ų56.771%0.70628%0.28SS*.Hα-helixtrans-56.2-43.2176.5-179.8-97.8000110.7T62 P63 K68T62-Y66 WeakPolarHBondContact O-CB 3.38Å; T62-Y66 PolarHBondContact O-N 2.92Å; P63-Y66 PolarHBondContact O-N 3.2Å; P63-Y66 VanDerWaalsContact O-N 3.13Å; Y66-K68 VanDerWaalsContact C-N 3.28Å; Y66-K68 PolarHBondContact O-N 3.48Å
67F96Very high95.8Very high138 Ų13854.6 Ų54.661%0.60526%0.263SS*.THydrogen-bonded Turntrans-84.38.1175.7-61.2-63.6000114.4P63 Q65 I69P63-F67 HydrophobicContact CB-CD2 4.41Å; P63-F67 HydrophobicContact CB-CE2 4.41Å; P63-F67 WeakPolarHBondContact O-CD2 3.23Å; P63-F67 PolarHBondContact O-N 3.35Å; Q65-F67 PolarHBondContact O-N 3.13Å; F67-I69 HydrophobicContact CB-CD1 4.07Å; F67-I69 HydrophobicContact CB-CG1 3.96Å; F67-I69 PolarHBondContact O-N 2.92Å
68K93.6Very high95.8Very high158 Ų15854.5 Ų54.569%0.68726%0.262SS*.THydrogen-bonded Turntrans57.727.7176.8-55.6177.8-178.3173.60114.9L64 Q65 Y66 F70L64-K68 PolarHBondContact O-N 3.49Å; Q65-K68 WeakPolarHBondContact O-CA 3.35Å; Q65-K68 PolarHBondContact O-N 2.86Å; Y66-K68 VanDerWaalsContact C-N 3.28Å; Y66-K68 PolarHBondContact O-N 3.48Å; K68-F70 HydrophobicContact CB-CD2 4.39Å; K68-F70 HydrophobicContact CB-CE2 3.73Å; K68-F70 HydrophobicContact CB-CZ 3.92Å; K68-F70 HydrophobicContact CG-CE2 4.19Å; K68-F70 HydrophobicContact CG-CZ 4.03Å; K68-F70 WeakPolarHBondContact O-CD2 3.38Å; K68-F70 PolarHBondContact O-N 3.25Å
69I95.4Very high95.8Very high85 Ų8554.8 Ų54.844%0.43626%0.264SS..  trans-84.760177-45.6-179000109.7L64 F67 K71 M72 H73L64-I69 HydrophobicContact CD2-CB 3.97Å; L64-I69 HydrophobicContact CD2-CD1 4.17Å; L64-I69 HydrophobicContact CD2-CG2 4.14Å; L64-I69 WeakPolarHBondContact O-CA 3.23Å; L64-I69 PolarHBondContact O-N 3Å; F67-I69 HydrophobicContact CB-CD1 4.07Å; F67-I69 HydrophobicContact CB-CG1 3.96Å; F67-I69 PolarHBondContact O-N 2.92Å; I69-K71 PolarHBondContact O-N 2.97Å; I69-M72 HydrophobicContact CG2-CB 3.68Å; I69-M72 PolarHBondContact O-N 2.63Å; I69-H73 PolarHBondContact O-N 2.85Å
70F93.9Very high95.8Very high78 Ų7852.5 Ų52.534%0.34225%0.245SC..Hα-helixtrans-66.8-33.8-168.2-60-58.8000114.5K68 H73 S74 W134 T137K68-F70 HydrophobicContact CB-CD2 4.39Å; K68-F70 HydrophobicContact CB-CE2 3.73Å; K68-F70 HydrophobicContact CB-CZ 3.92Å; K68-F70 HydrophobicContact CG-CE2 4.19Å; K68-F70 HydrophobicContact CG-CZ 4.03Å; K68-F70 WeakPolarHBondContact O-CD2 3.38Å; K68-F70 PolarHBondContact O-N 3.25Å; F70-H73 PolarHBondContact O-N 2.74Å; F70-S74 WeakPolarHBondContact O-CB 3.13Å; F70-S74 PolarHBondContact O-N 2.94Å; F70-S74 PolarHBondContact O-OG 3.43Å; F70-W134 HydrophobicContact CE1-CZ2 4.49Å; F70-T137 HydrophobicContact CB-CG2 3.69Å; F70-T137 HydrophobicContact CD1-CG2 4.34Å; F70-T137 HydrophobicContact CG-CG2 3.97Å; F70-T137 PolarHBondContact O-OG1 2.94Å
71K94Very high95.9Very high153 Ų15349 Ų4967%0.66523%0.227SC*.Hα-helixtrans-60.4-49.5177.7-70.3-175.3180179.70110.9I69 H73 S74 S75 P140I69-K71 PolarHBondContact O-N 2.97Å; K71-H73 PolarHBondContact O-N 2.96Å; K71-S74 PolarHBondContact O-N 3.3Å; K71-S75 PolarHBondContact O-N 3.4Å; K71-S75 PolarHBondContact O-OG 3.39Å; K71-S75 VanDerWaalsContact O-OG 3.05Å; K71-P140 HydrophobicContact CB-CG 4.28Å; K71-P140 WeakPolarHBondContact O-CG 3.42Å
72M95.6Very high95.9Very high68 Ų6849 Ų4934%0.33523%0.227SC..Hα-helixtrans-61.6-45.5177.8-174.263.7178.300111.5L64 I69 S74 S75 L76 F147L64-M72 HydrophobicContact CD1-CB 4.44Å; L64-M72 HydrophobicContact CD1-CG 3.96Å; L64-M72 HydrophobicContact CD2-CB 4.15Å; L64-M72 HydrophobicContact CD2-CG 3.92Å; I69-M72 HydrophobicContact CG2-CB 3.68Å; I69-M72 PolarHBondContact O-N 2.63Å; M72-S74 PolarHBondContact O-N 2.92Å; M72-S75 PolarHBondContact O-N 2.86Å; M72-L76 HydrophobicContact CE-CD1 4.01Å; M72-L76 HydrophobicContact CE-CD2 4.11Å; M72-L76 HydrophobicContact CE-CG 4.03Å; M72-L76 HydrophobicContact CG-CD1 4.33Å; M72-L76 WeakPolarHBondContact O-CG 3.47Å; M72-L76 PolarHBondContact O-N 3.38Å; M72-F147 HydrophobicContact CE-CE2 3.79Å; M72-F147 HydrophobicContact CE-CZ 3.55Å; M72-F147 HydrophobicContact SD-CE2 3.63Å; M72-F147 HydrophobicContact SD-CZ 3.52Å; M72-F147 VanDerWaalsContact SD-CZ 3.52Å
73H95.5Very high96.1Very high3 Ų346.9 Ų46.91%0.01421%0.213CC..Hα-helixtrans-56-48.7175.5175.9-80000111.8R10 L64 Q65 I69 F70 K71 L76 Y77R10-H73 PolarHBondContact NH2-NE2 3.25Å; L64-H73 HydrophobicContact CB-CB 4.12Å; L64-H73 HydrophobicContact CD1-CB 4.36Å; Q65-H73 PolarHBondContact NE2-CD2 2.89Å; Q65-H73 PolarHBondContact NE2-CE1 3.46Å; Q65-H73 VanDerWaalsContact NE2-CE1 3.35Å; Q65-H73 PolarHBondContact NE2-NE2 3.04Å; I69-H73 PolarHBondContact O-N 2.85Å; F70-H73 PolarHBondContact O-N 2.74Å; K71-H73 PolarHBondContact O-N 2.96Å; H73-L76 PolarHBondContact O-N 3.23Å; H73-Y77 VanDerWaalsContact O-CB 3.32Å; H73-Y77 WeakPolarHBondContact O-CB 3.35Å; H73-Y77 PolarHBondContact O-N 3.43Å
74S96.3Very high96.2Very high0 Ų044.7 Ų44.70%020%0.199CC..Hα-helixtrans-64.9-37178.4-74.90000112.9F70 K71 M72 S78 T137F70-S74 WeakPolarHBondContact O-CB 3.13Å; F70-S74 PolarHBondContact O-N 2.94Å; F70-S74 PolarHBondContact O-OG 3.43Å; K71-S74 PolarHBondContact O-N 3.3Å; M72-S74 PolarHBondContact O-N 2.92Å; S74-S78 PolarHBondContact O-N 3.49Å; S74-S78 PolarHBondContact O-OG 2.89Å; S74-T137 PolarHBondContact OG-N 3.15Å; S74-T137 PolarHBondContact OG-O 2.97Å; S74-T137 PolarHBondContact OG-OG1 3.1Å
75S97Very high96.4Very high0 Ų045.1 Ų45.10%020%0.201CC..Hα-helixtrans-63.5-48.5174.2-56.30000112K71 M72 Y77 S78 L79 P140 N143K71-S75 PolarHBondContact O-N 3.4Å; K71-S75 PolarHBondContact O-OG 3.39Å; K71-S75 VanDerWaalsContact O-OG 3.05Å; M72-S75 PolarHBondContact O-N 2.86Å; S75-Y77 VanDerWaalsContact C-N 3.34Å; S75-S78 PolarHBondContact O-N 3.39Å; S75-L79 PolarHBondContact O-N 3.12Å; S75-P140 WeakPolarHBondContact OG-CG 3.29Å; S75-N143 WeakPolarHBondContact OG-CB 3.44Å
76L97.2Very high96.7Very high19 Ų1944.7 Ų44.710%0.09920%0.199CC..Hα-helixtrans-64.6-40.5178.9-70.9178.7000111.5Y57 L60 L64 M72 H73 S78 L79 A80 F147Y57-L76 HydrophobicContact CD2-CB 4.01Å; L60-L76 HydrophobicContact CB-CD1 4.4Å; L60-L76 HydrophobicContact CD1-CD1 4.04Å; L64-L76 HydrophobicContact CD1-CD1 3.64Å; M72-L76 HydrophobicContact CE-CD1 4.01Å; M72-L76 HydrophobicContact CE-CD2 4.11Å; M72-L76 HydrophobicContact CE-CG 4.03Å; M72-L76 HydrophobicContact CG-CD1 4.33Å; M72-L76 WeakPolarHBondContact O-CG 3.47Å; M72-L76 PolarHBondContact O-N 3.38Å; H73-L76 PolarHBondContact O-N 3.23Å; L76-S78 VanDerWaalsContact C-N 3.34Å; L76-S78 PolarHBondContact O-N 3.49Å; L76-L79 PolarHBondContact O-N 2.96Å; L76-A80 VanDerWaalsContact O-CB 3.28Å; L76-A80 WeakPolarHBondContact O-CB 3.47Å; L76-A80 PolarHBondContact O-N 2.98Å; L76-F147 HydrophobicContact CD2-CD2 4.23Å; L76-F147 HydrophobicContact CD2-CE2 3.98Å; L76-F147 HydrophobicContact CG-CE2 4.33Å
77Y97.6Very high97Very high0 Ų036.5 Ų36.50%017%0.168CC..Hα-helixtrans-56.1-49.8172.5169.8-93.5000111.1Y57 H73 S75 L79 A80 F81 I127 A131 P136 M203 V204Y57-Y77 HydrophobicContact CE2-CD2 4.47Å; H73-Y77 VanDerWaalsContact O-CB 3.32Å; H73-Y77 WeakPolarHBondContact O-CB 3.35Å; H73-Y77 PolarHBondContact O-N 3.43Å; S75-Y77 VanDerWaalsContact C-N 3.34Å; Y77-L79 PolarHBondContact O-N 3.31Å; Y77-A80 PolarHBondContact O-N 3.08Å; Y77-F81 HydrophobicContact CE1-CB 4.46Å; Y77-F81 VanDerWaalsContact O-CB 3.24Å; Y77-F81 WeakPolarHBondContact O-CB 3.41Å; Y77-F81 PolarHBondContact O-N 3.3Å; Y77-I127 HydrophobicContact CD2-CD1 4.08Å; Y77-I127 HydrophobicContact CD2-CG1 3.73Å; Y77-I127 HydrophobicContact CE2-CD1 4.26Å; Y77-I127 HydrophobicContact CE2-CG1 3.51Å; Y77-I127 WeakPolarHBondContact CE2-O 3.26Å; Y77-A131 HydrophobicContact CE2-CB 3.55Å; Y77-A131 WeakPolarHBondContact OH-CB 3.38Å; Y77-P136 HydrophobicContact CD1-CB 4.08Å; Y77-P136 HydrophobicContact CD1-CG 3.58Å; Y77-P136 HydrophobicContact CD2-CG 3.81Å; Y77-P136 HydrophobicContact CE1-CG 3.82Å; Y77-P136 HydrophobicContact CE2-CG 4.03Å; Y77-P136 HydrophobicContact CG-CB 4.24Å; Y77-P136 HydrophobicContact CG-CG 3.58Å; Y77-M203 PolarHBondContact OH-SD 3.08Å; Y77-M203 VanDerWaalsContact OH-SD 3.41Å; Y77-V204 HydrophobicContact CD1-CG2 3.92Å; Y77-V204 HydrophobicContact CE1-CG2 3.52Å
78S97.8Very high97.1Very high0 Ų031.1 Ų31.10%015%0.147CC..Hα-helixtrans-65.3-39.6-179.6-75.90000112.7S74 S75 L76 T82 V139 S200S74-S78 PolarHBondContact O-N 3.49Å; S74-S78 PolarHBondContact O-OG 2.89Å; S75-S78 PolarHBondContact O-N 3.39Å; L76-S78 VanDerWaalsContact C-N 3.34Å; L76-S78 PolarHBondContact O-N 3.49Å; S78-T82 VanDerWaalsContact O-CB 3.26Å; S78-T82 WeakPolarHBondContact O-CB 3.42Å; S78-T82 PolarHBondContact O-N 2.9Å; S78-T82 PolarHBondContact O-OG1 3.47Å; S78-V139 WeakPolarHBondContact OG-CG1 3.4Å; S78-V139 WeakPolarHBondContact OG-CG2 3.37Å; S78-S200 WeakPolarHBondContact CA-OG 3.4Å; S78-S200 PolarHBondContact OG-OG 2.93Å
79L98.5Very high97.3Very high10 Ų1027.8 Ų27.85%0.05214%0.136CC..Hα-helixtrans-61.2-54.6174.3173.663.2000110.8L53 S75 L76 Y77 F81 T82 A83 F147 L148 Y151L53-L79 HydrophobicContact CD1-CD2 3.75Å; L53-L79 HydrophobicContact CD1-CG 4.27Å; L53-L79 HydrophobicContact CD2-CD2 4.15Å; L53-L79 HydrophobicContact CD2-CG 3.86Å; S75-L79 PolarHBondContact O-N 3.12Å; L76-L79 PolarHBondContact O-N 2.96Å; Y77-L79 PolarHBondContact O-N 3.31Å; L79-F81 PolarHBondContact O-N 3.39Å; L79-T82 PolarHBondContact O-N 3.31Å; L79-A83 WeakPolarHBondContact O-CB 3.31Å; L79-A83 PolarHBondContact O-N 2.9Å; L79-F147 HydrophobicContact CD2-CB 4.13Å; L79-L148 HydrophobicContact CD1-CD2 3.74Å; L79-L148 HydrophobicContact CD1-CG 4.32Å; L79-Y151 HydrophobicContact CD1-CD1 4.11Å; L79-Y151 HydrophobicContact CD1-CG 3.97Å
80A98.5Very high97.4Very high0 Ų026 Ų260%013%0.126CC..Hα-helixtrans-60-45.9-179.400000111.4L53 Y57 L76 Y77 T82 A83 N84 I127L53-A80 HydrophobicContact CD2-CB 4.37Å; L53-A80 HydrophobicContact CG-CB 4.34Å; Y57-A80 HydrophobicContact CD2-CB 4.36Å; Y57-A80 HydrophobicContact CG-CB 4.2Å; L76-A80 VanDerWaalsContact O-CB 3.28Å; L76-A80 WeakPolarHBondContact O-CB 3.47Å; L76-A80 PolarHBondContact O-N 2.98Å; Y77-A80 PolarHBondContact O-N 3.08Å; A80-T82 VanDerWaalsContact C-N 3.34Å; A80-T82 PolarHBondContact O-N 2.94Å; A80-A83 PolarHBondContact O-N 2.97Å; A80-N84 PolarHBondContact O-N 3.09Å; A80-N84 PolarHBondContact O-ND2 3.39Å; A80-I127 HydrophobicContact CB-CD1 3.38Å
81F98.5Very high97.5Very high5 Ų523.2 Ų23.22%0.02211%0.114CC..Hα-helixtrans-58.2-48.5176.6179.8-80.9000111.3Y77 L79 A83 N84 L85 I127 I128 V199 M203Y77-F81 HydrophobicContact CE1-CB 4.46Å; Y77-F81 VanDerWaalsContact O-CB 3.24Å; Y77-F81 WeakPolarHBondContact O-CB 3.41Å; Y77-F81 PolarHBondContact O-N 3.3Å; L79-F81 PolarHBondContact O-N 3.39Å; F81-A83 VanDerWaalsContact C-N 3.35Å; F81-A83 PolarHBondContact O-N 3.02Å; F81-N84 PolarHBondContact O-N 3.27Å; F81-L85 HydrophobicContact CE1-CB 4.4Å; F81-L85 HydrophobicContact CE1-CD2 3.7Å; F81-L85 HydrophobicContact CZ-CD2 4.19Å; F81-L85 WeakPolarHBondContact O-CB 3.34Å; F81-L85 PolarHBondContact O-N 2.86Å; F81-I127 HydrophobicContact CB-CD1 4.22Å; F81-I127 HydrophobicContact CB-CG1 4.49Å; F81-I127 HydrophobicContact CB-CG2 4.3Å; F81-I127 HydrophobicContact CD2-CG2 3.76Å; F81-I127 HydrophobicContact CG-CG2 4.43Å; F81-I128 HydrophobicContact CD2-CG1 4.38Å; F81-I128 HydrophobicContact CE2-CD1 4.17Å; F81-I128 HydrophobicContact CE2-CG1 3.68Å; F81-V199 HydrophobicContact CE1-CB 4.42Å; F81-V199 HydrophobicContact CE1-CG1 4Å; F81-V199 HydrophobicContact CZ-CG1 4.07Å; F81-M203 HydrophobicContact CD2-SD 4.26Å; F81-M203 HydrophobicContact CE2-SD 3.59Å; F81-M203 VanDerWaalsContact CE2-SD 3.59Å; F81-M203 HydrophobicContact CZ-SD 4.09Å
82T98.6Very high97.7Very high0 Ų017.8 Ų17.80%09%0.089CC..Hα-helixtrans-61-45.1-179.6-56.20000110.9S78 L79 A80 L85 I86 L148 F152 T193 C196 F197S78-T82 VanDerWaalsContact O-CB 3.26Å; S78-T82 WeakPolarHBondContact O-CB 3.42Å; S78-T82 PolarHBondContact O-N 2.9Å; S78-T82 PolarHBondContact O-OG1 3.47Å; L79-T82 PolarHBondContact O-N 3.31Å; A80-T82 VanDerWaalsContact C-N 3.34Å; A80-T82 PolarHBondContact O-N 2.94Å; T82-L85 PolarHBondContact O-N 3.42Å; T82-I86 WeakPolarHBondContact O-CG2 3.26Å; T82-I86 PolarHBondContact O-N 3.24Å; T82-L148 HydrophobicContact CG2-CD2 3.81Å; T82-F152 HydrophobicContact CG2-CE2 4.32Å; T82-T193 HydrophobicContact CG2-CG2 3.83Å; T82-C196 HydrophobicContact CG2-CB 3.96Å; T82-F197 HydrophobicContact CG2-CB 4.01Å; T82-F197 WeakPolarHBondContact OG1-CA 3.27Å
83A98.7Very high97.8Very high0 Ų016.4 Ų16.40%09%0.092CC..Hα-helixtrans-61.6-48.5178.200000112.8T50 L53 L79 A80 F81 L85 I86 V87 Y151 F152T50-A83 HydrophobicContact CG2-CB 3.78Å; L53-A83 HydrophobicContact CD2-CB 3.74Å; L79-A83 WeakPolarHBondContact O-CB 3.31Å; L79-A83 PolarHBondContact O-N 2.9Å; A80-A83 PolarHBondContact O-N 2.97Å; F81-A83 VanDerWaalsContact C-N 3.35Å; F81-A83 PolarHBondContact O-N 3.02Å; A83-L85 VanDerWaalsContact C-N 3.32Å; A83-L85 PolarHBondContact O-N 3.42Å; A83-I86 WeakPolarHBondContact O-CG2 3.32Å; A83-V87 WeakPolarHBondContact O-CB 3.26Å; A83-V87 VanDerWaalsContact O-CG2 3.32Å; A83-V87 WeakPolarHBondContact O-CG2 3.49Å; A83-V87 PolarHBondContact O-N 2.88Å; A83-Y151 HydrophobicContact CB-CE1 4.05Å; A83-F152 HydrophobicContact CB-CZ 4.11Å
84N98.7Very high97.8Very high9 Ų917.5 Ų17.55%0.04810%0.098CC..Hα-helixtrans-62.3-41.8176.8-71-75.2000112Q54 A80 F81 C88 G123 T124Q54-N84 PolarHBondContact NE2-ND2 3.33Å; Q54-N84 VanDerWaalsContact NE2-ND2 3.15Å; Q54-N84 PolarHBondContact NE2-OD1 2.85Å; Q54-N84 PolarHBondContact OE1-ND2 3.2Å; A80-N84 PolarHBondContact O-N 3.09Å; A80-N84 PolarHBondContact O-ND2 3.39Å; F81-N84 PolarHBondContact O-N 3.27Å; N84-C88 VanDerWaalsContact O-CB 3.23Å; N84-C88 WeakPolarHBondContact O-CB 3.44Å; N84-C88 PolarHBondContact O-N 3.41Å; N84-G123 VanDerWaalsContact OD1-CA 3.26Å; N84-G123 WeakPolarHBondContact OD1-CA 3.35Å; N84-T124 PolarHBondContact O-OG1 2.94Å
85L98.7Very high97.7Very high29 Ų2919 Ų1915%0.15211%0.105CC..Hα-helixtrans-67.9-44.9-177.2-175.659.4000111.5F81 T82 A83 C88 I89 T124 C196 V199F81-L85 HydrophobicContact CE1-CB 4.4Å; F81-L85 HydrophobicContact CE1-CD2 3.7Å; F81-L85 HydrophobicContact CZ-CD2 4.19Å; F81-L85 WeakPolarHBondContact O-CB 3.34Å; F81-L85 PolarHBondContact O-N 2.86Å; T82-L85 PolarHBondContact O-N 3.42Å; A83-L85 VanDerWaalsContact C-N 3.32Å; A83-L85 PolarHBondContact O-N 3.42Å; L85-C88 WeakPolarHBondContact O-CB 3.1Å; L85-C88 PolarHBondContact O-N 2.65Å; L85-I89 HydrophobicContact CD1-CD1 3.98Å; L85-I89 HydrophobicContact CD1-CG1 4.38Å; L85-I89 HydrophobicContact CG-CD1 3.94Å; L85-I89 VanDerWaalsContact O-CG1 3.31Å; L85-I89 WeakPolarHBondContact O-CG1 3.24Å; L85-I89 PolarHBondContact O-N 3.04Å; L85-T124 HydrophobicContact CD1-CG2 4.21Å; L85-C196 HydrophobicContact CB-CB 4.39Å; L85-C196 HydrophobicContact CD2-CB 3.92Å; L85-C196 HydrophobicContact CG-CB 4.24Å; L85-V199 HydrophobicContact CD2-CB 4.31Å; L85-V199 HydrophobicContact CD2-CG1 4.23Å
86I98.5Very high97.6Very high3 Ų325.5 Ų25.52%0.01514%0.138CC..Hα-helixtrans-68.2-40.6178.2-169.163.9000111.9T82 A83 C88 I89 M90 F152 A192T82-I86 WeakPolarHBondContact O-CG2 3.26Å; T82-I86 PolarHBondContact O-N 3.24Å; A83-I86 WeakPolarHBondContact O-CG2 3.32Å; I86-C88 VanDerWaalsContact C-N 3.31Å; I86-C88 PolarHBondContact O-N 3Å; I86-I89 PolarHBondContact O-N 2.99Å; I86-M90 HydrophobicContact CD1-CG 3.82Å; I86-M90 HydrophobicContact CD1-SD 4.43Å; I86-M90 HydrophobicContact CG1-CG 3.95Å; I86-M90 VanDerWaalsContact O-CB 3.31Å; I86-M90 WeakPolarHBondContact O-CB 3.43Å; I86-M90 VanDerWaalsContact O-CG 3.31Å; I86-M90 WeakPolarHBondContact O-CG 3.2Å; I86-M90 PolarHBondContact O-N 3.41Å; I86-F152 HydrophobicContact CG2-CE1 3.84Å; I86-F152 HydrophobicContact CG2-CZ 3.72Å; I86-A192 HydrophobicContact CD1-CB 3.63Å
87V98.1Very high97.4Very high9 Ų929.7 Ų29.76%0.05517%0.169CC..Hα-helixtrans-61-43.1175.21680000110.6L46 T47 T50 A83 F91L46-V87 HydrophobicContact CD2-CG2 4.06Å; L46-V87 HydrophobicContact CG-CG2 3.87Å; T47-V87 HydrophobicContact CG2-CG1 4.36Å; T50-V87 HydrophobicContact CG2-CG2 4.32Å; T50-V87 WeakPolarHBondContact OG1-CG2 3.37Å; A83-V87 WeakPolarHBondContact O-CB 3.26Å; A83-V87 VanDerWaalsContact O-CG2 3.32Å; A83-V87 WeakPolarHBondContact O-CG2 3.49Å; A83-V87 PolarHBondContact O-N 2.88Å; V87-F91 WeakPolarHBondContact O-CB 3.32Å; V87-F91 PolarHBondContact O-N 3.24Å
88C98.5Very high97.2Very high25 Ų2532.9 Ų32.917%0.16919%0.186CC..Hα-helixtrans-58-53.2175.8-175.80000111.8N84 L85 I86 W92 H120N84-C88 VanDerWaalsContact O-CB 3.23Å; N84-C88 WeakPolarHBondContact O-CB 3.44Å; N84-C88 PolarHBondContact O-N 3.41Å; L85-C88 WeakPolarHBondContact O-CB 3.1Å; L85-C88 PolarHBondContact O-N 2.65Å; I86-C88 VanDerWaalsContact C-N 3.31Å; I86-C88 PolarHBondContact O-N 3Å; C88-W92 WeakPolarHBondContact O-CB 3.31Å; C88-W92 PolarHBondContact O-N 3.45Å; C88-H120 WeakPolarHBondContact CA-O 3.39Å; C88-H120 WeakPolarHBondContact CB-O 3.3Å; C88-H120 PolarHBondContact SG-O 3.31Å; C88-H120 VanDerWaalsContact SG-O 3.39Å
89I98.1Very high96.9Very high88 Ų8836.9 Ų36.945%0.45120%0.203SC..Hα-helixtrans-62.6-49.3-177.6-69.2167000110.8L85 I86 G93L85-I89 HydrophobicContact CD1-CD1 3.98Å; L85-I89 HydrophobicContact CD1-CG1 4.38Å; L85-I89 HydrophobicContact CG-CD1 3.94Å; L85-I89 VanDerWaalsContact O-CG1 3.31Å; L85-I89 WeakPolarHBondContact O-CG1 3.24Å; L85-I89 PolarHBondContact O-N 3.04Å; I86-I89 PolarHBondContact O-N 2.99Å; I89-G93 WeakPolarHBondContact O-CA 3.19Å; I89-G93 PolarHBondContact O-N 3.28Å
90M97.1Very high96.6Very high46 Ų4639.5 Ų39.523%0.22722%0.219CC..Hα-helixtrans-66.8-44.9-177.1-70.8-57.7-57.600111.7I86 I94 F185I86-M90 HydrophobicContact CD1-CG 3.82Å; I86-M90 HydrophobicContact CD1-SD 4.43Å; I86-M90 HydrophobicContact CG1-CG 3.95Å; I86-M90 VanDerWaalsContact O-CB 3.31Å; I86-M90 WeakPolarHBondContact O-CB 3.43Å; I86-M90 VanDerWaalsContact O-CG 3.31Å; I86-M90 WeakPolarHBondContact O-CG 3.2Å; I86-M90 PolarHBondContact O-N 3.41Å; M90-I94 HydrophobicContact CE-CD1 4.11Å; M90-I94 WeakPolarHBondContact O-CB 3.49Å; M90-I94 VanDerWaalsContact O-CG1 3.26Å; M90-I94 WeakPolarHBondContact O-CG1 3.34Å; M90-I94 PolarHBondContact O-N 2.69Å; M90-F185 HydrophobicContact CE-CE2 3.94Å; M90-F185 HydrophobicContact CE-CZ 3.69Å
91F96.8Very high96.4Very high20 Ų2041.7 Ų41.79%0.08823%0.231CC..Hα-helixtrans-61.2-55.4179.3174.9-95.8000111V87 G93 I94 F95 L102 N116 H120V87-F91 WeakPolarHBondContact O-CB 3.32Å; V87-F91 PolarHBondContact O-N 3.24Å; F91-G93 VanDerWaalsContact C-N 3.34Å; F91-G93 PolarHBondContact O-N 2.83Å; F91-I94 PolarHBondContact O-N 3.45Å; F91-F95 HydrophobicContact CE1-CB 4.35Å; F91-F95 HydrophobicContact CE1-CD2 4.12Å; F91-F95 HydrophobicContact CE1-CG 4.36Å; F91-F95 HydrophobicContact CE2-CD2 4.44Å; F91-F95 AromaticContact CZ-CD2 3.76Å; F91-F95 HydrophobicContact CZ-CD2 3.76Å; F91-F95 HydrophobicContact CZ-CE2 4.37Å; F91-F95 HydrophobicContact CZ-CG 4.41Å; F91-F95 WeakPolarHBondContact O-CB 3.49Å; F91-F95 PolarHBondContact O-N 3.03Å; F91-L102 HydrophobicContact CD2-CD1 3.76Å; F91-L102 HydrophobicContact CD2-CD2 4.48Å; F91-L102 HydrophobicContact CE2-CD1 3.69Å; F91-L102 HydrophobicContact CZ-CD1 4.44Å; F91-N116 HydrophobicContact CE1-CB 4.39Å; F91-N116 HydrophobicContact CZ-CB 4.3Å; F91-H120 HydrophobicContact CB-CB 4.1Å; F91-H120 HydrophobicContact CD1-CB 3.49Å; F91-H120 VanDerWaalsContact CD1-CB 3.49Å; F91-H120 AromaticContact CD1-CD2 3.84Å; F91-H120 AromaticContact CD1-CG 3.37Å; F91-H120 AromaticContact CD1-ND1 3.66Å; F91-H120 AromaticContact CD2-CD2 3.39Å; F91-H120 WeakPolarHBondContact CD2-CD2 3.45Å; F91-H120 AromaticContact CD2-CE1 3.5Å; F91-H120 AromaticContact CD2-CG 3.72Å; F91-H120 AromaticContact CD2-ND1 3.79Å; F91-H120 AromaticContact CD2-NE2 3.25Å; F91-H120 VanDerWaalsContact CD2-NE2 3.25Å; F91-H120 WeakPolarHBondContact CD2-NE2 3.32Å; F91-H120 HydrophobicContact CE1-CB 4.06Å; F91-H120 AromaticContact CE1-CG 3.75Å; F91-H120 AromaticContact CE1-ND1 3.51Å; F91-H120 AromaticContact CE2-CD2 3.99Å; F91-H120 AromaticContact CE2-CE1 3.27Å; F91-H120 WeakPolarHBondContact CE2-CE1 3.37Å; F91-H120 AromaticContact CE2-ND1 3.63Å; F91-H120 AromaticContact CE2-NE2 3.53Å; F91-H120 HydrophobicContact CG-CB 3.83Å; F91-H120 AromaticContact CG-CD2 3.29Å; F91-H120 WeakPolarHBondContact CG-CD2 3.36Å; F91-H120 AromaticContact CG-CE1 3.97Å; F91-H120 AromaticContact CG-CG 3.36Å; F91-H120 AromaticContact CG-ND1 3.8Å; F91-H120 AromaticContact CG-NE2 3.71Å; F91-H120 AromaticContact CZ-CE1 3.57Å; F91-H120 AromaticContact CZ-ND1 3.48Å; F91-H120 WeakPolarHBondContact CZ-ND1 3.48Å
92W97.6Very high96.2Very high40 Ų4042.4 Ų42.415%0.15224%0.235CC..Hα-helixtrans-69.2-33.7-176.9-70.9112.7000112.4C88 F95 I96 W113 N116 H117 T121C88-W92 WeakPolarHBondContact O-CB 3.31Å; C88-W92 PolarHBondContact O-N 3.45Å; W92-F95 HydrophobicContact CE3-CB 4.35Å; W92-F95 AromaticContact CE3-CD1 3.96Å; W92-F95 HydrophobicContact CE3-CD1 3.96Å; W92-F95 HydrophobicContact CE3-CG 4.21Å; W92-F95 AromaticContact CZ3-CD1 3.86Å; W92-F95 HydrophobicContact CZ3-CD1 3.86Å; W92-F95 HydrophobicContact CZ3-CE1 4.01Å; W92-F95 HydrophobicContact CZ3-CG 4.25Å; W92-F95 HydrophobicContact CZ3-CZ 4.49Å; W92-F95 PolarHBondContact O-N 3.34Å; W92-I96 WeakPolarHBondContact O-CB 3.1Å; W92-I96 WeakPolarHBondContact O-CD1 3.32Å; W92-I96 WeakPolarHBondContact O-CG1 3.38Å; W92-I96 PolarHBondContact O-N 3.02Å; W92-W113 HydrophobicContact CH2-CE3 4.46Å; W92-W113 AromaticContact CH2-CZ3 3.95Å; W92-W113 HydrophobicContact CH2-CZ3 3.95Å; W92-W113 AromaticContact CZ3-CZ3 3.97Å; W92-W113 HydrophobicContact CZ3-CZ3 3.97Å; W92-N116 HydrophobicContact CH2-CB 4.26Å; W92-H117 AromaticContact CH2-CE1 3.78Å; W92-H117 AromaticContact CZ2-CE1 3.53Å; W92-H117 AromaticContact CZ2-ND1 3.52Å; W92-T121 PolarHBondContact NE1-OG1 3.45Å
93G96.9Very high95.6Very high38 Ų3843.4 Ų43.439%0.39224%0.243SC..Hα-helixtrans-58-52.8172.800000111.7I89 F91 S97I89-G93 WeakPolarHBondContact O-CA 3.19Å; I89-G93 PolarHBondContact O-N 3.28Å; F91-G93 VanDerWaalsContact C-N 3.34Å; F91-G93 PolarHBondContact O-N 2.83Å; G93-S97 WeakPolarHBondContact O-CB 3.39Å; G93-S97 PolarHBondContact O-N 2.94Å; G93-S97 PolarHBondContact O-OG 3.31Å; G93-S97 VanDerWaalsContact O-OG 3.1Å
94I95.2Very high94.9Very high26 Ų2648 Ų4813%0.13327%0.268CS..Hα-helixtrans-67.8-43.7178.3-61.1168.1000110.7M90 F91 I96 S97 D98 L101 L102M90-I94 HydrophobicContact CE-CD1 4.11Å; M90-I94 WeakPolarHBondContact O-CB 3.49Å; M90-I94 VanDerWaalsContact O-CG1 3.26Å; M90-I94 WeakPolarHBondContact O-CG1 3.34Å; M90-I94 PolarHBondContact O-N 2.69Å; F91-I94 PolarHBondContact O-N 3.45Å; I94-I96 VanDerWaalsContact C-N 3.31Å; I94-I96 PolarHBondContact O-N 2.88Å; I94-S97 PolarHBondContact O-N 3.16Å; I94-D98 CarbonylContact O-C 3.32Å; I94-D98 PolarHBondContact O-N 3.04Å; I94-L101 HydrophobicContact CG2-CB 3.67Å; I94-L101 HydrophobicContact CG2-CD1 4.34Å; I94-L102 HydrophobicContact CB-CD1 4.39Å; I94-L102 HydrophobicContact CB-CD2 4.01Å; I94-L102 HydrophobicContact CB-CG 4.16Å; I94-L102 HydrophobicContact CD1-CD2 4.1Å; I94-L102 HydrophobicContact CG2-CD1 4.25Å; I94-L102 HydrophobicContact CG2-CD2 3.79Å; I94-L102 HydrophobicContact CG2-CG 3.64Å
95F94.3Very high94Very high33 Ų3352.3 Ų52.315%0.14529%0.288CS..Hα-helixtrans-58.2-41.4-177.8-177.1-81.9000112.6F91 W92 K99 L102 M108 W113F91-F95 HydrophobicContact CE1-CB 4.35Å; F91-F95 HydrophobicContact CE1-CD2 4.12Å; F91-F95 HydrophobicContact CE1-CG 4.36Å; F91-F95 HydrophobicContact CE2-CD2 4.44Å; F91-F95 AromaticContact CZ-CD2 3.76Å; F91-F95 HydrophobicContact CZ-CD2 3.76Å; F91-F95 HydrophobicContact CZ-CE2 4.37Å; F91-F95 HydrophobicContact CZ-CG 4.41Å; F91-F95 WeakPolarHBondContact O-CB 3.49Å; F91-F95 PolarHBondContact O-N 3.03Å; W92-F95 HydrophobicContact CE3-CB 4.35Å; W92-F95 AromaticContact CE3-CD1 3.96Å; W92-F95 HydrophobicContact CE3-CD1 3.96Å; W92-F95 HydrophobicContact CE3-CG 4.21Å; W92-F95 AromaticContact CZ3-CD1 3.86Å; W92-F95 HydrophobicContact CZ3-CD1 3.86Å; W92-F95 HydrophobicContact CZ3-CE1 4.01Å; W92-F95 HydrophobicContact CZ3-CG 4.25Å; W92-F95 HydrophobicContact CZ3-CZ 4.49Å; W92-F95 PolarHBondContact O-N 3.34Å; F95-K99 HydrophobicContact CD2-CB 4.24Å; F95-L102 HydrophobicContact CB-CD1 3.85Å; F95-L102 HydrophobicContact CD2-CD1 4.24Å; F95-M108 HydrophobicContact CD2-CE 3.69Å; F95-M108 HydrophobicContact CE2-CE 3.36Å; F95-W113 AromaticContact CE1-CH2 3.68Å; F95-W113 HydrophobicContact CE1-CH2 3.68Å; F95-W113 HydrophobicContact CE1-CZ2 4.42Å; F95-W113 HydrophobicContact CE1-CZ3 4.28Å; F95-W113 AromaticContact CZ-CH2 3.72Å; F95-W113 HydrophobicContact CZ-CH2 3.72Å; F95-W113 HydrophobicContact CZ-CZ2 4.14Å; F95-W113 HydrophobicContact CZ-CZ3 4.24Å
96I95Very high92.9Very high136 Ų13655.1 Ų55.170%0.69731%0.31SS*.Hα-helixtrans-74.9-37.1179.4-66.6166.1000111.1W92 I94W92-I96 WeakPolarHBondContact O-CB 3.1Å; W92-I96 WeakPolarHBondContact O-CD1 3.32Å; W92-I96 WeakPolarHBondContact O-CG1 3.38Å; W92-I96 PolarHBondContact O-N 3.02Å; I94-I96 VanDerWaalsContact C-N 3.31Å; I94-I96 PolarHBondContact O-N 2.88Å
97S94.7Very high91.9Very high106 Ų10659.3 Ų59.374%0.74133%0.329SS*.Hα-helixtrans-72.1-56178.7-64.50000112.6G93 I94G93-S97 WeakPolarHBondContact O-CB 3.39Å; G93-S97 PolarHBondContact O-N 2.94Å; G93-S97 PolarHBondContact O-OG 3.31Å; G93-S97 VanDerWaalsContact O-OG 3.1Å; I94-S97 PolarHBondContact O-N 3.16Å
98D93.3Very high90.9Very high67 Ų6760 Ų6036%0.35833%0.333SS..Hα-helixtrans-160.5101.3175.6-176.2-6.7000110.1I94 T100 L101I94-D98 CarbonylContact O-C 3.32Å; I94-D98 PolarHBondContact O-N 3.04Å; D98-T100 VanDerWaalsContact CG-OG1 3.24Å; D98-T100 PolarHBondContact O-N 3.23Å; D98-T100 WeakPolarHBondContact OD1-CB 3.19Å; D98-T100 WeakPolarHBondContact OD1-CG2 3.31Å; D98-T100 PolarHBondContact OD1-N 3.42Å; D98-T100 PolarHBondContact OD1-OG1 3.45Å; D98-T100 PolarHBondContact OD2-OG1 2.97Å; D98-L101 HydrophobicContact CB-CD1 3.93Å; D98-L101 HydrophobicContact CB-CG 4.02Å; D98-L101 WeakPolarHBondContact O-CB 3.29Å; D98-L101 PolarHBondContact O-N 3.08Å
99K91.7Very high89.9Confident84 Ų8466 Ų6637%0.36536%0.356SS..G310 helixtrans-61.2-22178.865.3179.2179.3179.20114.4F95 L101 L102 M108F95-K99 HydrophobicContact CD2-CB 4.24Å; K99-L101 PolarHBondContact O-N 3.39Å; K99-L102 PolarHBondContact O-N 2.89Å; K99-L102 VanDerWaalsContact O-N 3.09Å; K99-M108 HydrophobicContact CB-CE 4.33Å
100T92.1Very high89.2Confident65 Ų6565.4 Ų65.440%0.39936%0.359SS..G310 helixtrans-69.2-17.2-179.970.50000112.3D98 L102D98-T100 VanDerWaalsContact CG-OG1 3.24Å; D98-T100 PolarHBondContact O-N 3.23Å; D98-T100 WeakPolarHBondContact OD1-CB 3.19Å; D98-T100 WeakPolarHBondContact OD1-CG2 3.31Å; D98-T100 PolarHBondContact OD1-N 3.42Å; D98-T100 PolarHBondContact OD1-OG1 3.45Å; D98-T100 PolarHBondContact OD2-OG1 2.97Å; T100-L102 PolarHBondContact O-N 3.25Å
101L94.1Very high88.7Confident47 Ų4764.4 Ų64.425%0.24636%0.356CS..G310 helixtrans-72.8-15.2172.9-63179.7000113.3I94 D98 K99 P172 V173 V176I94-L101 HydrophobicContact CG2-CB 3.67Å; I94-L101 HydrophobicContact CG2-CD1 4.34Å; D98-L101 HydrophobicContact CB-CD1 3.93Å; D98-L101 HydrophobicContact CB-CG 4.02Å; D98-L101 WeakPolarHBondContact O-CB 3.29Å; D98-L101 PolarHBondContact O-N 3.08Å; K99-L101 PolarHBondContact O-N 3.39Å; L101-P172 WeakPolarHBondContact O-CD 3.36Å; L101-V173 HydrophobicContact CB-CB 4Å; L101-V173 HydrophobicContact CB-CG2 4.32Å; L101-V173 HydrophobicContact CD1-CG2 4.38Å; L101-V173 WeakPolarHBondContact O-CB 3.41Å; L101-V173 PolarHBondContact O-N 2.87Å; L101-V176 HydrophobicContact CD2-CG2 4.22Å
102L92.8Very high88.5Confident20 Ų2065.2 Ų65.211%0.10536%0.363CS..THydrogen-bonded Turntrans-95.2-44.8179-66.8172.1000112.7F91 I94 F95 K99 T100 P172F91-L102 HydrophobicContact CD2-CD1 3.76Å; F91-L102 HydrophobicContact CD2-CD2 4.48Å; F91-L102 HydrophobicContact CE2-CD1 3.69Å; F91-L102 HydrophobicContact CZ-CD1 4.44Å; I94-L102 HydrophobicContact CB-CD1 4.39Å; I94-L102 HydrophobicContact CB-CD2 4.01Å; I94-L102 HydrophobicContact CB-CG 4.16Å; I94-L102 HydrophobicContact CD1-CD2 4.1Å; I94-L102 HydrophobicContact CG2-CD1 4.25Å; I94-L102 HydrophobicContact CG2-CD2 3.79Å; I94-L102 HydrophobicContact CG2-CG 3.64Å; F95-L102 HydrophobicContact CB-CD1 3.85Å; F95-L102 HydrophobicContact CD2-CD1 4.24Å; K99-L102 PolarHBondContact O-N 2.89Å; K99-L102 VanDerWaalsContact O-N 3.09Å; T100-L102 PolarHBondContact O-N 3.25Å; L102-P172 VanDerWaalsContact O-CD 3.26Å; L102-P172 WeakPolarHBondContact O-CD 3.49Å
103A87Confident88.2Confident21 Ų2171.1 Ų71.117%0.17439%0.385CS..SBendtrans-161.7166.6-177.800000110.1E107 M108A103-E107 HydrophobicContact CB-CB 4.36Å; A103-M108 HydrophobicContact CB-CG 3.98Å; A103-M108 HydrophobicContact CB-SD 3.8Å
104N83.7Confident88.1Confident95 Ų9575.1 Ų75.151%0.50839%0.388SS..  trans-68.2153.4179.7-69.4-24.2000111.2S106 E107 M108N104-S106 VanDerWaalsContact C-N 3.26Å; N104-S106 PolarHBondContact O-N 3.46Å; N104-E107 HydrophobicContact CB-CG 4.32Å; N104-E107 PolarHBondContact N-OE2 3.48Å; N104-E107 WeakPolarHBondContact O-CB 3.43Å; N104-E107 PolarHBondContact O-N 2.91Å; N104-E107 VanDerWaalsContact O-N 3.12Å; N104-M108 WeakPolarHBondContact O-CG 3.42Å; N104-M108 PolarHBondContact O-N 3.09Å
105E79.2Confident88.1Confident100 Ų10074.5 Ų74.547%0.46738%0.384SS..Hα-helixtrans-61-34.7-174.4-161-169.4158.100113.1M108 K109E105-M108 PolarHBondContact O-N 3.33Å; E105-K109 WeakPolarHBondContact O-CG 3.38Å; E105-K109 PolarHBondContact O-N 3.42Å; E105-K109 WeakPolarHBondContact OE1-CE 3.43Å; E105-K109 IonicContact OE1-NZ 2.74Å; E105-K109 PolarHBondContact OE1-NZ 3.34Å
106S75.8Confident88.2Confident89 Ų8973.4 Ų73.462%0.62238%0.38SS*.Hα-helixtrans-63.4-45.8175.552.70000112N104 K109 S110N104-S106 VanDerWaalsContact C-N 3.26Å; N104-S106 PolarHBondContact O-N 3.46Å; S106-K109 PolarHBondContact O-N 2.97Å; S106-S110 PolarHBondContact O-N 3.45Å
107E77.8Confident88.3Confident90 Ų9070.8 Ų70.842%0.42137%0.365SS..Hα-helixtrans-61.4-48.1176.5-62.4173.4147.700109.2A103 N104 K109 S110 V111A103-E107 HydrophobicContact CB-CB 4.36Å; N104-E107 HydrophobicContact CB-CG 4.32Å; N104-E107 PolarHBondContact N-OE2 3.48Å; N104-E107 WeakPolarHBondContact O-CB 3.43Å; N104-E107 PolarHBondContact O-N 2.91Å; N104-E107 VanDerWaalsContact O-N 3.12Å; E107-K109 VanDerWaalsContact C-N 3.33Å; E107-K109 PolarHBondContact O-N 3.3Å; E107-S110 WeakPolarHBondContact O-CB 3.21Å; E107-S110 PolarHBondContact O-N 2.81Å; E107-S110 PolarHBondContact O-OG 2.87Å; E107-V111 WeakPolarHBondContact O-CG2 3.49Å; E107-V111 PolarHBondContact O-N 3.02Å
108M76.5Confident88.4Confident25 Ų2565.9 Ų65.912%0.12333%0.33CS..Hα-helixtrans-62-34.4-179-69.3-59-69.500114F95 K99 A103 N104 E105 S110 V111F95-M108 HydrophobicContact CD2-CE 3.69Å; F95-M108 HydrophobicContact CE2-CE 3.36Å; K99-M108 HydrophobicContact CB-CE 4.33Å; A103-M108 HydrophobicContact CB-CG 3.98Å; A103-M108 HydrophobicContact CB-SD 3.8Å; N104-M108 WeakPolarHBondContact O-CG 3.42Å; N104-M108 PolarHBondContact O-N 3.09Å; E105-M108 PolarHBondContact O-N 3.33Å; M108-S110 VanDerWaalsContact C-N 3.26Å; M108-S110 PolarHBondContact O-N 3.13Å; M108-V111 PolarHBondContact O-N 3.3Å
109K78.8Confident88.6Confident151 Ų15163 Ų6366%0.65732%0.316SS*.Hα-helixtrans-68.1-27.1176.4-78.8175.1-177.5164.20112.7E105 S106 E107E105-K109 WeakPolarHBondContact O-CG 3.38Å; E105-K109 PolarHBondContact O-N 3.42Å; E105-K109 WeakPolarHBondContact OE1-CE 3.43Å; E105-K109 IonicContact OE1-NZ 2.74Å; E105-K109 PolarHBondContact OE1-NZ 3.34Å; S106-K109 PolarHBondContact O-N 2.97Å; E107-K109 VanDerWaalsContact C-N 3.33Å; E107-K109 PolarHBondContact O-N 3.3Å
110S82.1Confident88.9Confident74 Ų7459.9 Ų59.952%0.51730%0.302SS..Hα-helixtrans-80.8-21-179.775.10000113.4S106 E107 M108 P112S106-S110 PolarHBondContact O-N 3.45Å; E107-S110 WeakPolarHBondContact O-CB 3.21Å; E107-S110 PolarHBondContact O-N 2.81Å; E107-S110 PolarHBondContact O-OG 2.87Å; M108-S110 VanDerWaalsContact C-N 3.26Å; M108-S110 PolarHBondContact O-N 3.13Å; S110-P112 WeakPolarHBondContact O-CD 3.45Å
111V87.7Confident89.2Confident26 Ų2658.8 Ų58.816%0.15830%0.296CS..SBendtrans-82.1119.7-175.4-174.80000111.2L27 E107 M108 Y115L27-V111 HydrophobicContact CD2-CG1 4.49Å; L27-V111 HydrophobicContact CD2-CG2 4.18Å; E107-V111 WeakPolarHBondContact O-CG2 3.49Å; E107-V111 PolarHBondContact O-N 3.02Å; M108-V111 PolarHBondContact O-N 3.3Å; V111-Y115 HydrophobicContact CG1-CD1 3.34Å; V111-Y115 HydrophobicContact CG1-CE1 3.91Å; V111-Y115 HydrophobicContact CG1-CG 4.32Å
112P91.8Very high89.4Confident36 Ų3659.6 Ų59.623%0.23430%0.299CS..  trans-64.3144.2177.2-22.334.4000112.8S110 W114 Y115 N116S110-P112 WeakPolarHBondContact O-CD 3.45Å; P112-W114 VanDerWaalsContact C-N 3.33Å; P112-W114 HydrophobicContact CB-CG 4.31Å; P112-W114 VanDerWaalsContact CB-NE1 3.26Å; P112-W114 PolarHBondContact O-N 2.97Å; P112-Y115 WeakPolarHBondContact O-CB 3.45Å; P112-Y115 PolarHBondContact O-N 3.42Å; P112-N116 PolarHBondContact O-N 3.28Å
113W91.7Very high89.6Confident164 Ų16458.7 Ų58.762%0.62130%0.295SS*.Hα-helixtrans-57.5-41.6179.1-91.599.3000114.1W92 F95 Y115 N116 H117W92-W113 HydrophobicContact CH2-CE3 4.46Å; W92-W113 AromaticContact CH2-CZ3 3.95Å; W92-W113 HydrophobicContact CH2-CZ3 3.95Å; W92-W113 AromaticContact CZ3-CZ3 3.97Å; W92-W113 HydrophobicContact CZ3-CZ3 3.97Å; F95-W113 AromaticContact CE1-CH2 3.68Å; F95-W113 HydrophobicContact CE1-CH2 3.68Å; F95-W113 HydrophobicContact CE1-CZ2 4.42Å; F95-W113 HydrophobicContact CE1-CZ3 4.28Å; F95-W113 AromaticContact CZ-CH2 3.72Å; F95-W113 HydrophobicContact CZ-CH2 3.72Å; F95-W113 HydrophobicContact CZ-CZ2 4.14Å; F95-W113 HydrophobicContact CZ-CZ3 4.24Å; W113-Y115 PolarHBondContact O-N 2.81Å; W113-N116 PolarHBondContact O-N 3.36Å; W113-H117 PolarHBondContact O-N 3.39Å
114W95.6Very high90.2Very high122 Ų12258.5 Ų58.546%0.46229%0.292SS..Hα-helixtrans-61.6-33.6178.667.9-99.7000111.7Y19 I20 Y23 P112 H117 A118Y19-W114 HydrophobicContact CE1-CH2 4.49Å; I20-W114 HydrophobicContact CD1-CZ3 4.12Å; Y23-W114 AromaticContact CD1-CH2 3.9Å; Y23-W114 HydrophobicContact CD1-CH2 3.9Å; Y23-W114 HydrophobicContact CD1-CZ2 4.44Å; Y23-W114 HydrophobicContact CD2-CH2 4.1Å; Y23-W114 HydrophobicContact CD2-CZ2 4.47Å; Y23-W114 AromaticContact CE1-CH2 3.71Å; Y23-W114 HydrophobicContact CE1-CH2 3.71Å; Y23-W114 AromaticContact CE1-CZ2 3.8Å; Y23-W114 HydrophobicContact CE1-CZ2 3.8Å; Y23-W114 AromaticContact CE2-CH2 3.95Å; Y23-W114 HydrophobicContact CE2-CH2 3.95Å; Y23-W114 AromaticContact CE2-CZ2 3.86Å; Y23-W114 HydrophobicContact CE2-CZ2 3.86Å; Y23-W114 HydrophobicContact CG-CH2 4.07Å; Y23-W114 AromaticContact CZ-CH2 3.75Å; Y23-W114 AromaticContact CZ-CZ2 3.49Å; Y23-W114 VanDerWaalsContact CZ-CZ2 3.49Å; P112-W114 VanDerWaalsContact C-N 3.33Å; P112-W114 HydrophobicContact CB-CG 4.31Å; P112-W114 VanDerWaalsContact CB-NE1 3.26Å; P112-W114 PolarHBondContact O-N 2.97Å; W114-H117 PolarHBondContact O-N 3.43Å; W114-A118 HydrophobicContact CE3-CB 4.46Å; W114-A118 WeakPolarHBondContact O-CB 3.38Å; W114-A118 PolarHBondContact O-N 3.41Å
115Y95.3Very high90.9Very high13 Ų1356.6 Ų56.65%0.05129%0.285CS..Hα-helixtrans-69.9-38.4179.8171.3-92.3000111.2I20 Y23 T24 L27 V111 P112 W113 H117 A118 C119I20-Y115 HydrophobicContact CG2-CE2 4.12Å; Y23-Y115 AromaticContact CD1-CD2 3.38Å; Y23-Y115 HydrophobicContact CD1-CD2 3.38Å; Y23-Y115 AromaticContact CD1-CE2 3.63Å; Y23-Y115 HydrophobicContact CD1-CE2 3.63Å; Y23-Y115 HydrophobicContact CD1-CG 4.28Å; Y23-Y115 AromaticContact CE1-CD2 3.65Å; Y23-Y115 HydrophobicContact CE1-CD2 3.65Å; Y23-Y115 HydrophobicContact CE1-CE2 4.21Å; Y23-Y115 HydrophobicContact CE1-CG 4.11Å; T24-Y115 WeakPolarHBondContact CG2-OH 3.47Å; T24-Y115 PolarHBondContact OG1-OH 3.46Å; L27-Y115 HydrophobicContact CD2-CE1 4.17Å; V111-Y115 HydrophobicContact CG1-CD1 3.34Å; V111-Y115 HydrophobicContact CG1-CE1 3.91Å; V111-Y115 HydrophobicContact CG1-CG 4.32Å; P112-Y115 WeakPolarHBondContact O-CB 3.45Å; P112-Y115 PolarHBondContact O-N 3.42Å; W113-Y115 PolarHBondContact O-N 2.81Å; Y115-H117 VanDerWaalsContact C-N 3.32Å; Y115-H117 PolarHBondContact O-N 3.02Å; Y115-A118 WeakPolarHBondContact O-CB 3.38Å; Y115-A118 PolarHBondContact O-N 2.98Å; Y115-A118 VanDerWaalsContact O-N 3.16Å; Y115-C119 WeakPolarHBondContact CE2-SG 3.34Å; Y115-C119 WeakPolarHBondContact O-CB 3.33Å; Y115-C119 PolarHBondContact O-N 3.47Å; Y115-C119 PolarHBondContact O-SG 3.44Å
116N94.9Very high91.8Very high10 Ų1052.4 Ų52.45%0.05327%0.267CS..Hα-helixtrans-59-43.7173-77.9-40.7000111.7F91 W92 P112 W113 C119 H120F91-N116 HydrophobicContact CE1-CB 4.39Å; F91-N116 HydrophobicContact CZ-CB 4.3Å; W92-N116 HydrophobicContact CH2-CB 4.26Å; P112-N116 PolarHBondContact O-N 3.28Å; W113-N116 PolarHBondContact O-N 3.36Å; N116-C119 PolarHBondContact O-N 2.86Å; N116-H120 WeakPolarHBondContact O-CB 3.28Å; N116-H120 PolarHBondContact O-N 3.01Å; N116-H120 PolarHBondContact O-ND1 3.21Å
117H97.6Very high92.8Very high82 Ų8248.2 Ų48.238%0.3824%0.238SC..Hα-helixtrans-66.1-40173.8-76.8-64.1000112.8W92 W113 W114 Y115 C119 T121 I122W92-H117 AromaticContact CH2-CE1 3.78Å; W92-H117 AromaticContact CZ2-CE1 3.53Å; W92-H117 AromaticContact CZ2-ND1 3.52Å; W113-H117 PolarHBondContact O-N 3.39Å; W114-H117 PolarHBondContact O-N 3.43Å; Y115-H117 VanDerWaalsContact C-N 3.32Å; Y115-H117 PolarHBondContact O-N 3.02Å; H117-C119 VanDerWaalsContact C-N 3.3Å; H117-C119 PolarHBondContact O-N 3.35Å; H117-T121 PolarHBondContact ND1-OG1 3.48Å; H117-T121 VanDerWaalsContact ND1-OG1 3.1Å; H117-T121 CarbonylContact O-C 3.56Å; H117-T121 WeakPolarHBondContact O-CA 3.25Å; H117-T121 WeakPolarHBondContact O-CB 3.47Å; H117-T121 PolarHBondContact O-N 2.89Å; H117-I122 WeakPolarHBondContact O-CG1 3.38Å; H117-I122 PolarHBondContact O-N 3.4Å
118A97.7Very high93.8Very high2 Ų246.5 Ų46.52%0.01723%0.231CC..Hα-helixtrans-59-42.2176.900000112.5F16 I20 W114 Y115 I122F16-A118 HydrophobicContact CE1-CB 4.37Å; F16-A118 HydrophobicContact CZ-CB 3.76Å; I20-A118 HydrophobicContact CD1-CB 3.61Å; I20-A118 HydrophobicContact CG1-CB 4.16Å; W114-A118 HydrophobicContact CE3-CB 4.46Å; W114-A118 WeakPolarHBondContact O-CB 3.38Å; W114-A118 PolarHBondContact O-N 3.41Å; Y115-A118 WeakPolarHBondContact O-CB 3.38Å; Y115-A118 PolarHBondContact O-N 2.98Å; Y115-A118 VanDerWaalsContact O-N 3.16Å; A118-I122 HydrophobicContact CB-CD1 4.41Å
119C97.3Very high94.8Very high8 Ų849.1 Ų49.15%0.05425%0.245CC..Hα-helixtrans-80.5-37.8-177.4-64.50000113.5I20 T47 I51 Y115 N116 H117I20-C119 VanDerWaalsContact CG2-SG 3.55Å; T47-C119 HydrophobicContact CG2-CB 3.71Å; I51-C119 HydrophobicContact CD1-CB 4.08Å; Y115-C119 WeakPolarHBondContact CE2-SG 3.34Å; Y115-C119 WeakPolarHBondContact O-CB 3.33Å; Y115-C119 PolarHBondContact O-N 3.47Å; Y115-C119 PolarHBondContact O-SG 3.44Å; N116-C119 PolarHBondContact O-N 2.86Å; H117-C119 VanDerWaalsContact C-N 3.3Å; H117-C119 PolarHBondContact O-N 3.35Å
120H97.5Very high95.7Very high18 Ų1842 Ų428%0.08321%0.214CC..Hα-helixtrans-113.4-22.5-167.2-52.8100.1000114T47 C88 F91 N116T47-H120 VanDerWaalsContact CG2-NE2 3.3Å; T47-H120 WeakPolarHBondContact CG2-NE2 3.3Å; T47-H120 PolarHBondContact OG1-CD2 3.42Å; T47-H120 PolarHBondContact OG1-NE2 3.37Å; C88-H120 WeakPolarHBondContact CA-O 3.39Å; C88-H120 WeakPolarHBondContact CB-O 3.3Å; C88-H120 PolarHBondContact SG-O 3.31Å; C88-H120 VanDerWaalsContact SG-O 3.39Å; F91-H120 HydrophobicContact CB-CB 4.1Å; F91-H120 HydrophobicContact CD1-CB 3.49Å; F91-H120 VanDerWaalsContact CD1-CB 3.49Å; F91-H120 AromaticContact CD1-CD2 3.84Å; F91-H120 AromaticContact CD1-CG 3.37Å; F91-H120 AromaticContact CD1-ND1 3.66Å; F91-H120 AromaticContact CD2-CD2 3.39Å; F91-H120 WeakPolarHBondContact CD2-CD2 3.45Å; F91-H120 AromaticContact CD2-CE1 3.5Å; F91-H120 AromaticContact CD2-CG 3.72Å; F91-H120 AromaticContact CD2-ND1 3.79Å; F91-H120 AromaticContact CD2-NE2 3.25Å; F91-H120 VanDerWaalsContact CD2-NE2 3.25Å; F91-H120 WeakPolarHBondContact CD2-NE2 3.32Å; F91-H120 HydrophobicContact CE1-CB 4.06Å; F91-H120 AromaticContact CE1-CG 3.75Å; F91-H120 AromaticContact CE1-ND1 3.51Å; F91-H120 AromaticContact CE2-CD2 3.99Å; F91-H120 AromaticContact CE2-CE1 3.27Å; F91-H120 WeakPolarHBondContact CE2-CE1 3.37Å; F91-H120 AromaticContact CE2-ND1 3.63Å; F91-H120 AromaticContact CE2-NE2 3.53Å; F91-H120 HydrophobicContact CG-CB 3.83Å; F91-H120 AromaticContact CG-CD2 3.29Å; F91-H120 WeakPolarHBondContact CG-CD2 3.36Å; F91-H120 AromaticContact CG-CE1 3.97Å; F91-H120 AromaticContact CG-CG 3.36Å; F91-H120 AromaticContact CG-ND1 3.8Å; F91-H120 AromaticContact CG-NE2 3.71Å; F91-H120 AromaticContact CZ-CE1 3.57Å; F91-H120 AromaticContact CZ-ND1 3.48Å; F91-H120 WeakPolarHBondContact CZ-ND1 3.48Å; N116-H120 WeakPolarHBondContact O-CB 3.28Å; N116-H120 PolarHBondContact O-N 3.01Å; N116-H120 PolarHBondContact O-ND1 3.21Å
121T98.2Very high96.3Very high42 Ų4238.5 Ų38.526%0.25819%0.189SC..THydrogen-bonded Turntrans-105.2-55.4-178.4-53.90000111.9W92 H117 G123 T124 P125W92-T121 PolarHBondContact NE1-OG1 3.45Å; H117-T121 PolarHBondContact ND1-OG1 3.48Å; H117-T121 VanDerWaalsContact ND1-OG1 3.1Å; H117-T121 CarbonylContact O-C 3.56Å; H117-T121 WeakPolarHBondContact O-CA 3.25Å; H117-T121 WeakPolarHBondContact O-CB 3.47Å; H117-T121 PolarHBondContact O-N 2.89Å; T121-G123 PolarHBondContact O-N 3.13Å; T121-G123 VanDerWaalsContact O-N 3.1Å; T121-T124 PolarHBondContact O-N 3.26Å; T121-P125 WeakPolarHBondContact O-CD 3.49Å
122I98.1Very high96.6Very high63 Ų6341.4 Ų41.432%0.32320%0.203SC..THydrogen-bonded Turntrans-59.6-29.5-164.9-69.3-176.6000113.3F16 F17 H117 A118 T124 P125 A126F16-I122 HydrophobicContact CE1-CB 4.47Å; F16-I122 HydrophobicContact CE1-CD1 4.36Å; F16-I122 HydrophobicContact CE1-CG2 3.87Å; F16-I122 HydrophobicContact CZ-CD1 3.9Å; F16-I122 HydrophobicContact CZ-CG2 4.4Å; F17-I122 HydrophobicContact CZ-CG2 4.41Å; H117-I122 WeakPolarHBondContact O-CG1 3.38Å; H117-I122 PolarHBondContact O-N 3.4Å; A118-I122 HydrophobicContact CB-CD1 4.41Å; I122-T124 VanDerWaalsContact C-N 3.3Å; I122-T124 PolarHBondContact O-N 3.01Å; I122-P125 WeakPolarHBondContact O-CD 3.27Å; I122-P125 WeakPolarHBondContact O-CG 3.45Å; I122-A126 WeakPolarHBondContact O-CB 3.47Å; I122-A126 PolarHBondContact O-N 2.94Å
123G98.4Very high96.7Very high1 Ų142 Ų421%0.0120%0.204CC..Hα-helixtrans-55.2-41.3178.600000114.3Q54 N84 T121 I127Q54-G123 PolarHBondContact NE2-O 2.87Å; N84-G123 VanDerWaalsContact OD1-CA 3.26Å; N84-G123 WeakPolarHBondContact OD1-CA 3.35Å; T121-G123 PolarHBondContact O-N 3.13Å; T121-G123 VanDerWaalsContact O-N 3.1Å; G123-I127 VanDerWaalsContact O-CG2 3.31Å; G123-I127 WeakPolarHBondContact O-CG2 3.26Å; G123-I127 PolarHBondContact O-N 3.05Å; G123-I127 VanDerWaalsContact O-N 3.13Å
124T98.4Very high96.5Very high17 Ų1737.5 Ų37.510%0.10419%0.187CC..Hα-helixtrans-68.9-54.9-179.4-60.70000113.7N84 L85 T121 I122 A126 I127 I128N84-T124 PolarHBondContact O-OG1 2.94Å; L85-T124 HydrophobicContact CD1-CG2 4.21Å; T121-T124 PolarHBondContact O-N 3.26Å; I122-T124 VanDerWaalsContact C-N 3.3Å; I122-T124 PolarHBondContact O-N 3.01Å; T124-A126 VanDerWaalsContact C-N 3.32Å; T124-A126 PolarHBondContact O-N 3.45Å; T124-I127 WeakPolarHBondContact O-CG2 3.33Å; T124-I127 PolarHBondContact O-N 3.26Å; T124-I128 HydrophobicContact CG2-CD1 3.9Å; T124-I128 VanDerWaalsContact O-CG1 3.25Å; T124-I128 WeakPolarHBondContact O-CG1 3.29Å; T124-I128 PolarHBondContact O-N 2.9Å
125P98.1Very high96.1Very high56 Ų5634.2 Ų34.236%0.36418%0.175SC..Hα-helixtrans-63-36.2175.624.7-31.6000112.3T121 I122 I127 I128 I129T121-P125 WeakPolarHBondContact O-CD 3.49Å; I122-P125 WeakPolarHBondContact O-CD 3.27Å; I122-P125 WeakPolarHBondContact O-CG 3.45Å; P125-I127 PolarHBondContact O-N 2.95Å; P125-I128 WeakPolarHBondContact O-CB 3.21Å; P125-I128 PolarHBondContact O-N 3.46Å; P125-I129 VanDerWaalsContact O-CG1 3.29Å; P125-I129 WeakPolarHBondContact O-CG1 3.14Å; P125-I129 PolarHBondContact O-N 3.45Å
126A98.3Very high95.7Very high12 Ų1233.6 Ų33.610%0.09917%0.173CC..Hα-helixtrans-60-47.717700000111.8H9 F17 Y58 I122 T124 I128 I129 D130H9-A126 PolarHBondContact CE1-O 3.47Å; H9-A126 PolarHBondContact NE2-O 3.24Å; F17-A126 HydrophobicContact CZ-CB 4.49Å; Y58-A126 VanDerWaalsContact OH-C 3.28Å; Y58-A126 PolarHBondContact OH-O 3.31Å; I122-A126 WeakPolarHBondContact O-CB 3.47Å; I122-A126 PolarHBondContact O-N 2.94Å; T124-A126 VanDerWaalsContact C-N 3.32Å; T124-A126 PolarHBondContact O-N 3.45Å; A126-I128 VanDerWaalsContact C-N 3.31Å; A126-I128 PolarHBondContact O-N 3.17Å; A126-I129 PolarHBondContact O-N 3.41Å; A126-D130 PolarHBondContact O-N 3.33Å
127I98Very high95.4Very high0 Ų035.6 Ų35.60%019%0.185CC..Hα-helixtrans-70.6-28.5178.6-166152.4000112.4Y57 Y58 Y77 A80 F81 G123 T124 P125 D130 A131Y57-I127 HydrophobicContact CD1-CD1 4.32Å; Y57-I127 HydrophobicContact CE1-CD1 4.18Å; Y57-I127 HydrophobicContact CE1-CG1 4.39Å; Y58-I127 PolarHBondContact OH-N 3.36Å; Y77-I127 HydrophobicContact CD2-CD1 4.08Å; Y77-I127 HydrophobicContact CD2-CG1 3.73Å; Y77-I127 HydrophobicContact CE2-CD1 4.26Å; Y77-I127 HydrophobicContact CE2-CG1 3.51Å; Y77-I127 WeakPolarHBondContact CE2-O 3.26Å; A80-I127 HydrophobicContact CB-CD1 3.38Å; F81-I127 HydrophobicContact CB-CD1 4.22Å; F81-I127 HydrophobicContact CB-CG1 4.49Å; F81-I127 HydrophobicContact CB-CG2 4.3Å; F81-I127 HydrophobicContact CD2-CG2 3.76Å; F81-I127 HydrophobicContact CG-CG2 4.43Å; G123-I127 VanDerWaalsContact O-CG2 3.31Å; G123-I127 WeakPolarHBondContact O-CG2 3.26Å; G123-I127 PolarHBondContact O-N 3.05Å; G123-I127 VanDerWaalsContact O-N 3.13Å; T124-I127 WeakPolarHBondContact O-CG2 3.33Å; T124-I127 PolarHBondContact O-N 3.26Å; P125-I127 PolarHBondContact O-N 2.95Å; I127-D130 PolarHBondContact O-N 3.37Å; I127-A131 PolarHBondContact O-N 3.3Å
128I97.9Very high95.1Very high55 Ų5537.9 Ų37.928%0.28220%0.199SC..Hα-helixtrans-63.8-46.1171-72.7166.9000110.7F81 T124 P125 A126 D130 A131 L132 M203F81-I128 HydrophobicContact CD2-CG1 4.38Å; F81-I128 HydrophobicContact CE2-CD1 4.17Å; F81-I128 HydrophobicContact CE2-CG1 3.68Å; T124-I128 HydrophobicContact CG2-CD1 3.9Å; T124-I128 VanDerWaalsContact O-CG1 3.25Å; T124-I128 WeakPolarHBondContact O-CG1 3.29Å; T124-I128 PolarHBondContact O-N 2.9Å; P125-I128 WeakPolarHBondContact O-CB 3.21Å; P125-I128 PolarHBondContact O-N 3.46Å; A126-I128 VanDerWaalsContact C-N 3.31Å; A126-I128 PolarHBondContact O-N 3.17Å; I128-D130 VanDerWaalsContact C-N 3.32Å; I128-D130 PolarHBondContact O-N 2.98Å; I128-A131 WeakPolarHBondContact O-CB 3.44Å; I128-A131 PolarHBondContact O-N 3.42Å; I128-A131 VanDerWaalsContact O-N 3.16Å; I128-L132 HydrophobicContact CG2-CD1 4.1Å; I128-L132 WeakPolarHBondContact O-CG 3.02Å; I128-L132 PolarHBondContact O-N 3.43Å; I128-M203 HydrophobicContact CB-CE 4Å; I128-M203 HydrophobicContact CG1-CE 3.82Å; I128-M203 HydrophobicContact CG1-SD 4.09Å; I128-M203 HydrophobicContact CG2-CE 3.73Å
129I97.2Very high94.8Very high80 Ų8038.2 Ų38.241%0.4120%0.2SC..Hα-helixtrans-59.7-44.5176.9-69.4163.8000110P125 A126 A131 L132 L133P125-I129 VanDerWaalsContact O-CG1 3.29Å; P125-I129 WeakPolarHBondContact O-CG1 3.14Å; P125-I129 PolarHBondContact O-N 3.45Å; A126-I129 PolarHBondContact O-N 3.41Å; I129-A131 VanDerWaalsContact C-N 3.28Å; I129-A131 PolarHBondContact O-N 2.97Å; I129-L132 PolarHBondContact O-N 3Å; I129-L132 VanDerWaalsContact O-N 3.08Å; I129-L133 HydrophobicContact CG2-CD1 3.84Å; I129-L133 HydrophobicContact CG2-CG 4.25Å; I129-L133 WeakPolarHBondContact O-CG 3.4Å; I129-L133 PolarHBondContact O-N 3.21Å
130D96.9Very high94.7Very high1 Ų138.9 Ų38.91%0.00521%0.205CC..Hα-helixtrans-57.8-43.1175.5-164.462.2000112H9 R10 Y57 Y58 A126 I127 I128 L132 L133 W134H9-D130 IonicContact ND1-OD1 2.79Å; R10-D130 WeakPolarHBondContact CG-OD1 3.36Å; R10-D130 IonicContact CZ-OD1 2.89Å; R10-D130 IonicContact CZ-OD2 3.59Å; R10-D130 IonicContact NE-OD1 3.01Å; R10-D130 PolarHBondContact NE-OD1 2.96Å; R10-D130 IonicContact NE-OD2 3.41Å; R10-D130 IonicContact NH2-OD1 3.17Å; R10-D130 PolarHBondContact NH2-OD1 2.92Å; R10-D130 IonicContact NH2-OD2 3.31Å; R10-D130 PolarHBondContact NH2-OD2 2.87Å; Y57-D130 PolarHBondContact OH-OD2 2.95Å; Y58-D130 HydrophobicContact CE1-CB 4.43Å; A126-D130 PolarHBondContact O-N 3.33Å; I127-D130 PolarHBondContact O-N 3.37Å; I128-D130 VanDerWaalsContact C-N 3.32Å; I128-D130 PolarHBondContact O-N 2.98Å; D130-L132 VanDerWaalsContact C-N 3.3Å; D130-L132 PolarHBondContact O-N 3.46Å; D130-L133 PolarHBondContact O-N 3.29Å; D130-W134 PolarHBondContact O-N 3.41Å
131A95.7Very high94.6Very high0 Ų041.3 Ų41.30%022%0.218CC..Hα-helixtrans-63.2-35.5176.700000112.8Y77 I127 I128 I129 R135 P136 M203 L207Y77-A131 HydrophobicContact CE2-CB 3.55Å; Y77-A131 WeakPolarHBondContact OH-CB 3.38Å; I127-A131 PolarHBondContact O-N 3.3Å; I128-A131 WeakPolarHBondContact O-CB 3.44Å; I128-A131 PolarHBondContact O-N 3.42Å; I128-A131 VanDerWaalsContact O-N 3.16Å; I129-A131 VanDerWaalsContact C-N 3.28Å; I129-A131 PolarHBondContact O-N 2.97Å; A131-R135 WeakPolarHBondContact O-CA 3.49Å; A131-R135 PolarHBondContact O-N 3.42Å; A131-P136 HydrophobicContact CB-CG 4.42Å; A131-M203 HydrophobicContact CB-CE 3.84Å; A131-L207 HydrophobicContact CB-CD1 3.76Å
132L94.6Very high94.4Very high87 Ų8743.8 Ų43.846%0.45524%0.237SC..Hα-helixtrans-72.2-37.7177.7-70.1170.9000112.2I128 I129 D130 L207I128-L132 HydrophobicContact CG2-CD1 4.1Å; I128-L132 WeakPolarHBondContact O-CG 3.02Å; I128-L132 PolarHBondContact O-N 3.43Å; I129-L132 PolarHBondContact O-N 3Å; I129-L132 VanDerWaalsContact O-N 3.08Å; D130-L132 VanDerWaalsContact C-N 3.3Å; D130-L132 PolarHBondContact O-N 3.46Å; L132-L207 HydrophobicContact CD2-CD2 3.68Å
133L93.4Very high94.2Very high49 Ų4944.6 Ų44.626%0.25724%0.242SC..Hα-helixtrans-71.9-43.9-179.5-69.6174.4000112.1L5 H9 I129 D130L5-L133 HydrophobicContact CB-CD2 4.07Å; H9-L133 HydrophobicContact CB-CD1 3.67Å; I129-L133 HydrophobicContact CG2-CD1 3.84Å; I129-L133 HydrophobicContact CG2-CG 4.25Å; I129-L133 WeakPolarHBondContact O-CG 3.4Å; I129-L133 PolarHBondContact O-N 3.21Å; D130-L133 PolarHBondContact O-N 3.29Å
134W88.3Confident94.2Very high70 Ų7044.6 Ų44.627%0.26524%0.242SC..Hα-helixtrans-106.6-36.3-175.3-174-87.8000115.1I3 Q65 F70 D130I3-W134 HydrophobicContact CB-CZ3 4.31Å; I3-W134 HydrophobicContact CD1-CZ3 4.37Å; I3-W134 HydrophobicContact CG1-CZ3 3.81Å; I3-W134 HydrophobicContact CG2-CZ3 4.18Å; Q65-W134 HydrophobicContact CB-CH2 4.18Å; Q65-W134 HydrophobicContact CB-CZ2 3.74Å; Q65-W134 VanDerWaalsContact CD-NE1 3.26Å; Q65-W134 HydrophobicContact CG-CD2 4.36Å; Q65-W134 HydrophobicContact CG-CZ2 3.81Å; Q65-W134 VanDerWaalsContact NE2-CD2 3.29Å; Q65-W134 VanDerWaalsContact NE2-CE2 3.3Å; Q65-W134 VanDerWaalsContact OE1-CE3 3.31Å; F70-W134 HydrophobicContact CE1-CZ2 4.49Å; D130-W134 PolarHBondContact O-N 3.41Å
135R86.4Confident94.1Very high52 Ų5247.3 Ų47.320%0.19626%0.255CS..  trans65.9102-172.6-53.4177.1-176-81.1-22.6113.1A131 L207A131-R135 WeakPolarHBondContact O-CA 3.49Å; A131-R135 PolarHBondContact O-N 3.42Å; R135-L207 PolarHBondContact NH1-O 3.31Å; R135-L207 VanDerWaalsContact NH1-O 3.13Å
136P85.9Confident94.1Very high1 Ų149.8 Ų49.81%0.00626%0.264CS..PPolyproline II helixtrans-58.5144.9172.3-20.731.9000111Y77 A131 V204 N208Y77-P136 HydrophobicContact CD1-CB 4.08Å; Y77-P136 HydrophobicContact CD1-CG 3.58Å; Y77-P136 HydrophobicContact CD2-CG 3.81Å; Y77-P136 HydrophobicContact CE1-CG 3.82Å; Y77-P136 HydrophobicContact CE2-CG 4.03Å; Y77-P136 HydrophobicContact CG-CB 4.24Å; Y77-P136 HydrophobicContact CG-CG 3.58Å; A131-P136 HydrophobicContact CB-CG 4.42Å; P136-V204 HydrophobicContact CB-CG1 4.41Å; P136-V204 HydrophobicContact CB-CG2 4.2Å; P136-V204 HydrophobicContact CG-CG2 4.32Å; P136-N208 PolarHBondContact O-ND2 3.09Å
137T90.2Very high94.1Very high51 Ų5151.5 Ų51.531%0.31327%0.27SS..PPolyproline II helixtrans-65.5170.3167.5610000110.8F70 S74 V139 V204F70-T137 HydrophobicContact CB-CG2 3.69Å; F70-T137 HydrophobicContact CD1-CG2 4.34Å; F70-T137 HydrophobicContact CG-CG2 3.97Å; F70-T137 PolarHBondContact O-OG1 2.94Å; S74-T137 PolarHBondContact OG-N 3.15Å; S74-T137 PolarHBondContact OG-O 2.97Å; S74-T137 PolarHBondContact OG-OG1 3.1Å; T137-V139 PolarHBondContact O-N 3.41Å; T137-V204 VanDerWaalsContact O-CG1 3.28Å; T137-V204 WeakPolarHBondContact O-CG1 3.45Å
138I91.5Very high94.1Very high130 Ų13052.4 Ų52.467%0.66727%0.274SS*.PPolyproline II helixtrans-47132.8176.7-61.6172.1000110.4P140I138-P140 VanDerWaalsContact O-CD 3.31Å; I138-P140 WeakPolarHBondContact O-CD 3.45Å
139V91.5Very high94.1Very high9 Ų955.4 Ų55.46%0.05529%0.29CS..PPolyproline II helixtrans-64.7119.3-179-175.30000109.7S78 T137 I141 S144 F197 V201 V204S78-V139 WeakPolarHBondContact OG-CG1 3.4Å; S78-V139 WeakPolarHBondContact OG-CG2 3.37Å; T137-V139 PolarHBondContact O-N 3.41Å; V139-I141 HydrophobicContact CB-CD1 4.29Å; V139-I141 HydrophobicContact CG1-CD1 4.16Å; V139-I141 PolarHBondContact O-N 3.15Å; V139-S144 WeakPolarHBondContact CG1-OG 3.46Å; V139-F197 HydrophobicContact CG1-CE2 4.27Å; V139-F197 HydrophobicContact CG1-CZ 4.4Å; V139-V201 HydrophobicContact CB-CG2 4.41Å; V139-V201 HydrophobicContact CG1-CG2 4.34Å; V139-V201 HydrophobicContact CG2-CG2 4.37Å; V139-V204 HydrophobicContact CG2-CB 3.78Å; V139-V204 HydrophobicContact CG2-CG1 3.83Å; V139-V204 HydrophobicContact CG2-CG2 3.78Å
140P93.4Very high94.2Very high23 Ų2354.7 Ų54.715%0.14930%0.296CS..  trans-74.789.9172.532.4-35.2000109.6K71 S75 I138 S142 N143 S144K71-P140 HydrophobicContact CB-CG 4.28Å; K71-P140 WeakPolarHBondContact O-CG 3.42Å; S75-P140 WeakPolarHBondContact OG-CG 3.29Å; I138-P140 VanDerWaalsContact O-CD 3.31Å; I138-P140 WeakPolarHBondContact O-CD 3.45Å; P140-S142 VanDerWaalsContact C-N 3.32Å; P140-S142 PolarHBondContact O-N 2.91Å; P140-S142 VanDerWaalsContact O-N 3.15Å; P140-N143 HydrophobicContact CB-CB 4.33Å; P140-N143 HydrophobicContact CG-CB 4.2Å; P140-N143 PolarHBondContact O-N 3.31Å; P140-S144 PolarHBondContact O-N 3.48Å; P140-S144 PolarHBondContact O-OG 2.71Å
141I95.7Very high94.2Very high68 Ų6856.1 Ų56.135%0.34930%0.302SS..Hα-helixtrans-48.1-48.3-168.6-60.4-60.1000113.2V139 N143 S144 I145 F197 V201V139-I141 HydrophobicContact CB-CD1 4.29Å; V139-I141 HydrophobicContact CG1-CD1 4.16Å; V139-I141 PolarHBondContact O-N 3.15Å; I141-N143 PolarHBondContact O-N 2.85Å; I141-S144 PolarHBondContact O-N 3.33Å; I141-I145 HydrophobicContact CG2-CD1 3.58Å; I141-I145 HydrophobicContact CG2-CG1 4.25Å; I141-I145 WeakPolarHBondContact O-CB 3.33Å; I141-I145 VanDerWaalsContact O-CG1 3.3Å; I141-I145 WeakPolarHBondContact O-CG1 3.44Å; I141-I145 PolarHBondContact O-N 3.33Å; I141-F197 HydrophobicContact CD1-CZ 4.22Å; I141-V201 HydrophobicContact CD1-CG1 4.35Å; I141-V201 HydrophobicContact CD1-CG2 3.88Å
142S94.9Very high94.3Very high95 Ų9557.3 Ų57.366%0.66431%0.307SS*.Hα-helixtrans-60.8-45.7-178.9-50.10000112.9P140 I145 L146P140-S142 VanDerWaalsContact C-N 3.32Å; P140-S142 PolarHBondContact O-N 2.91Å; P140-S142 VanDerWaalsContact O-N 3.15Å; S142-I145 PolarHBondContact O-N 3.25Å; S142-L146 PolarHBondContact O-N 3.29Å
143N94.5Very high94.5Very high80 Ų8054.5 Ų54.543%0.42830%0.299SS..Hα-helixtrans-66.6-40.7177.8-65.860.6000111.4S75 P140 I141 L146 F147S75-N143 WeakPolarHBondContact OG-CB 3.44Å; P140-N143 HydrophobicContact CB-CB 4.33Å; P140-N143 HydrophobicContact CG-CB 4.2Å; P140-N143 PolarHBondContact O-N 3.31Å; I141-N143 PolarHBondContact O-N 2.85Å; N143-L146 PolarHBondContact O-N 3.13Å; N143-F147 WeakPolarHBondContact O-CG 3.45Å; N143-F147 PolarHBondContact O-N 3.15Å
144S97.1Very high94.7Very high1 Ų153.8 Ų53.81%0.00730%0.304CS..Hα-helixtrans-65.1-41.1177.9-59.40000111.9V139 P140 I141 F147 L148V139-S144 WeakPolarHBondContact CG1-OG 3.46Å; P140-S144 PolarHBondContact O-N 3.48Å; P140-S144 PolarHBondContact O-OG 2.71Å; I141-S144 PolarHBondContact O-N 3.33Å; S144-F147 PolarHBondContact O-N 3.14Å; S144-L148 VanDerWaalsContact O-CG 3.29Å; S144-L148 WeakPolarHBondContact O-CG 3.13Å; S144-L148 PolarHBondContact O-N 3.19Å
145I97.5Very high95.2Very high73 Ų7351.4 Ų51.437%0.37430%0.295SS..Hα-helixtrans-63.4-44.4175-71171.7000110.4I141 S142 F147 L148 L149 F197I141-I145 HydrophobicContact CG2-CD1 3.58Å; I141-I145 HydrophobicContact CG2-CG1 4.25Å; I141-I145 WeakPolarHBondContact O-CB 3.33Å; I141-I145 VanDerWaalsContact O-CG1 3.3Å; I141-I145 WeakPolarHBondContact O-CG1 3.44Å; I141-I145 PolarHBondContact O-N 3.33Å; S142-I145 PolarHBondContact O-N 3.25Å; I145-F147 VanDerWaalsContact C-N 3.3Å; I145-F147 PolarHBondContact O-N 3.03Å; I145-L148 PolarHBondContact O-N 3.17Å; I145-L149 HydrophobicContact CG2-CD1 3.87Å; I145-L149 HydrophobicContact CG2-CG 4.22Å; I145-L149 WeakPolarHBondContact O-CB 3.31Å; I145-L149 WeakPolarHBondContact O-CG 3.48Å; I145-L149 PolarHBondContact O-N 3.23Å; I145-F197 HydrophobicContact CG1-CE1 4.18Å
146L97.7Very high95.7Very high108 Ų10851 Ų5157%0.56530%0.296SS*.Hα-helixtrans-57.4-44.7176.217862.8000111.6S142 N143 L149 A150S142-L146 PolarHBondContact O-N 3.29Å; N143-L146 PolarHBondContact O-N 3.13Å; L146-L149 PolarHBondContact O-N 3.49Å; L146-A150 WeakPolarHBondContact O-CB 3.41Å; L146-A150 PolarHBondContact O-N 3.47Å
147F97.9Very high96.2Very high49 Ų4957 Ų5722%0.21533%0.327CS..Hα-helixtrans-65-39.9176.7-76.4-3000113M72 L76 L79 N143 S144 I145 Y151M72-F147 HydrophobicContact CE-CE2 3.79Å; M72-F147 HydrophobicContact CE-CZ 3.55Å; M72-F147 HydrophobicContact SD-CE2 3.63Å; M72-F147 HydrophobicContact SD-CZ 3.52Å; M72-F147 VanDerWaalsContact SD-CZ 3.52Å; L76-F147 HydrophobicContact CD2-CD2 4.23Å; L76-F147 HydrophobicContact CD2-CE2 3.98Å; L76-F147 HydrophobicContact CG-CE2 4.33Å; L79-F147 HydrophobicContact CD2-CB 4.13Å; N143-F147 WeakPolarHBondContact O-CG 3.45Å; N143-F147 PolarHBondContact O-N 3.15Å; S144-F147 PolarHBondContact O-N 3.14Å; I145-F147 VanDerWaalsContact C-N 3.3Å; I145-F147 PolarHBondContact O-N 3.03Å; F147-Y151 WeakPolarHBondContact O-CB 3.31Å; F147-Y151 PolarHBondContact O-N 2.88Å
148L98.2Very high96.5Very high19 Ų1957.8 Ų57.810%0.09933%0.327CS..Hα-helixtrans-63.6-45174.7-73.1167.1000111.8L79 T82 S144 I145 Y151 F152 F197L79-L148 HydrophobicContact CD1-CD2 3.74Å; L79-L148 HydrophobicContact CD1-CG 4.32Å; T82-L148 HydrophobicContact CG2-CD2 3.81Å; S144-L148 VanDerWaalsContact O-CG 3.29Å; S144-L148 WeakPolarHBondContact O-CG 3.13Å; S144-L148 PolarHBondContact O-N 3.19Å; I145-L148 PolarHBondContact O-N 3.17Å; L148-Y151 PolarHBondContact O-N 2.93Å; L148-F152 HydrophobicContact CB-CD2 4.46Å; L148-F152 HydrophobicContact CD2-CD2 3.85Å; L148-F152 HydrophobicContact CD2-CE2 3.52Å; L148-F152 WeakPolarHBondContact O-CB 3.31Å; L148-F152 PolarHBondContact O-N 3.41Å; L148-F197 HydrophobicContact CD1-CB 3.96Å; L148-F197 HydrophobicContact CD1-CD1 3.97Å; L148-F197 HydrophobicContact CD1-CD2 3.52Å; L148-F197 HydrophobicContact CD1-CE1 4.35Å; L148-F197 HydrophobicContact CD1-CE2 3.94Å; L148-F197 HydrophobicContact CD1-CG 3.53Å; L148-F197 HydrophobicContact CD1-CZ 4.33Å
149L98Very high96.8Very high117 Ų11751.7 Ų51.761%0.61330%0.296SS*.Iπ-helixtrans-63-45.8177.5-72173.8000111.2I145 L146 G153I145-L149 HydrophobicContact CG2-CD1 3.87Å; I145-L149 HydrophobicContact CG2-CG 4.22Å; I145-L149 WeakPolarHBondContact O-CB 3.31Å; I145-L149 WeakPolarHBondContact O-CG 3.48Å; I145-L149 PolarHBondContact O-N 3.23Å; L146-L149 PolarHBondContact O-N 3.49Å; L149-G153 WeakPolarHBondContact O-CA 3.35Å; L149-G153 PolarHBondContact O-N 3.49Å
150A98.1Very high97.1Very high65 Ų6552.2 Ų52.254%0.53730%0.298SS..Iπ-helixtrans-62.1-45.4177.200000111.6L146 G154L146-A150 WeakPolarHBondContact O-CB 3.41Å; L146-A150 PolarHBondContact O-N 3.47Å; A150-G154 WeakPolarHBondContact O-CA 3.48Å; A150-G154 PolarHBondContact O-N 2.95Å
151Y98.4Very high97.3Very high31 Ų3156.9 Ų56.912%0.12231%0.313CS..Iπ-helixtrans-70.7-59.4-176.9-176.4-96.7000112.4L46 L49 T50 L53 L79 A83 F147 L148 Y155L46-Y151 HydrophobicContact CD1-CE1 4.08Å; L49-Y151 VanDerWaalsContact C-OH 3.26Å; L49-Y151 HydrophobicContact CD1-CE2 4.45Å; L49-Y151 HydrophobicContact CD2-CE2 3.93Å; L49-Y151 HydrophobicContact CG-CE2 3.74Å; L49-Y151 PolarHBondContact O-OH 3.1Å; T50-Y151 WeakPolarHBondContact CA-OH 3.31Å; T50-Y151 PolarHBondContact N-OH 3.38Å; T50-Y151 VanDerWaalsContact N-OH 3.1Å; T50-Y151 PolarHBondContact OG1-OH 3.48Å; L53-Y151 HydrophobicContact CB-CE2 4.14Å; L53-Y151 HydrophobicContact CD2-CD2 4.38Å; L53-Y151 HydrophobicContact CD2-CE1 4.42Å; L53-Y151 HydrophobicContact CD2-CE2 3.88Å; L53-Y151 HydrophobicContact CG-CE2 4.48Å; L79-Y151 HydrophobicContact CD1-CD1 4.11Å; L79-Y151 HydrophobicContact CD1-CG 3.97Å; A83-Y151 HydrophobicContact CB-CE1 4.05Å; F147-Y151 WeakPolarHBondContact O-CB 3.31Å; F147-Y151 PolarHBondContact O-N 2.88Å; L148-Y151 PolarHBondContact O-N 2.93Å; Y151-Y155 WeakPolarHBondContact O-CB 3.37Å; Y151-Y155 PolarHBondContact O-N 2.87Å
152F98.2Very high97.3Very high26 Ų2654.7 Ų54.711%0.11430%0.302CS..Iπ-helixtrans-77.4-39.9-176.7-69.7-70.8000112.5L46 T82 A83 I86 L148 Y155 L156 T193L46-F152 HydrophobicContact CD1-CE1 4.41Å; L46-F152 HydrophobicContact CD2-CE1 4.4Å; T82-F152 HydrophobicContact CG2-CE2 4.32Å; A83-F152 HydrophobicContact CB-CZ 4.11Å; I86-F152 HydrophobicContact CG2-CE1 3.84Å; I86-F152 HydrophobicContact CG2-CZ 3.72Å; L148-F152 HydrophobicContact CB-CD2 4.46Å; L148-F152 HydrophobicContact CD2-CD2 3.85Å; L148-F152 HydrophobicContact CD2-CE2 3.52Å; L148-F152 WeakPolarHBondContact O-CB 3.31Å; L148-F152 PolarHBondContact O-N 3.41Å; F152-Y155 PolarHBondContact O-N 2.91Å; F152-L156 WeakPolarHBondContact O-CG 2.97Å; F152-L156 PolarHBondContact O-N 3.23Å; F152-T193 HydrophobicContact CD2-CG2 3.78Å; F152-T193 HydrophobicContact CE1-CG2 4.39Å; F152-T193 HydrophobicContact CE2-CG2 3.5Å; F152-T193 HydrophobicContact CG-CG2 4.33Å; F152-T193 HydrophobicContact CZ-CG2 3.82Å
153G97.8Very high97.4Very high27 Ų2750.5 Ų50.528%0.27827%0.272SS..Iπ-helixtrans-64.8-42.9175.100000111.5L149 Y155 L156 I157L149-G153 WeakPolarHBondContact O-CA 3.35Å; L149-G153 PolarHBondContact O-N 3.49Å; G153-Y155 VanDerWaalsContact C-N 3.33Å; G153-Y155 PolarHBondContact O-N 3.06Å; G153-L156 PolarHBondContact O-N 3.28Å; G153-I157 WeakPolarHBondContact O-CG1 3.26Å; G153-I157 PolarHBondContact O-N 3.16Å
154G97.7Very high97.5Very high35 Ų3552.7 Ų52.736%0.36127%0.274SS..Hα-helixtrans-59.6-42.3172.400000112.5A150 I157 H158A150-G154 WeakPolarHBondContact O-CA 3.48Å; A150-G154 PolarHBondContact O-N 2.95Å; G154-I157 PolarHBondContact O-N 3.29Å; G154-H158 WeakPolarHBondContact O-CB 3.21Å; G154-H158 PolarHBondContact O-N 3.24Å
155Y97.8Very high97.5Very high19 Ų1957.9 Ų57.98%0.07530%0.301CS..Hα-helixtrans-61.9-45.4174.9-177.1-106.8000112.5R44 L46 L49 Y151 F152 G153 I157 H158 V159 Y171R44-Y155 VanDerWaalsContact O-CE2 3.28Å; R44-Y155 WeakPolarHBondContact O-CE2 3.07Å; R44-Y155 PolarHBondContact O-OH 3.31Å; L46-Y155 HydrophobicContact CB-CD1 4.45Å; L46-Y155 HydrophobicContact CB-CE1 3.78Å; L46-Y155 HydrophobicContact CB-CE2 4.17Å; L46-Y155 HydrophobicContact CD1-CD1 3.92Å; L46-Y155 HydrophobicContact CD1-CD2 4.25Å; L46-Y155 HydrophobicContact CD1-CE1 4.13Å; L46-Y155 HydrophobicContact CD1-CE2 4.46Å; L46-Y155 HydrophobicContact CD1-CG 3.99Å; L46-Y155 HydrophobicContact CD2-CD1 4.47Å; L46-Y155 HydrophobicContact CD2-CE1 4.26Å; L46-Y155 HydrophobicContact CG-CE1 4.27Å; L46-Y155 PolarHBondContact N-OH 2.9Å; L49-Y155 HydrophobicContact CD2-CD2 3.75Å; L49-Y155 HydrophobicContact CD2-CG 4.33Å; Y151-Y155 WeakPolarHBondContact O-CB 3.37Å; Y151-Y155 PolarHBondContact O-N 2.87Å; F152-Y155 PolarHBondContact O-N 2.91Å; G153-Y155 VanDerWaalsContact C-N 3.33Å; G153-Y155 PolarHBondContact O-N 3.06Å; Y155-I157 PolarHBondContact O-N 3.02Å; Y155-H158 WeakPolarHBondContact O-CB 3.09Å; Y155-H158 PolarHBondContact O-N 2.96Å; Y155-V159 HydrophobicContact CD1-CG2 3.99Å; Y155-V159 HydrophobicContact CD2-CG2 4.34Å; Y155-V159 HydrophobicContact CE1-CG2 3.52Å; Y155-V159 HydrophobicContact CE2-CG2 3.91Å; Y155-V159 HydrophobicContact CG-CG2 4.37Å; Y155-V159 VanDerWaalsContact CZ-CG2 3.46Å; Y155-V159 VanDerWaalsContact O-CG2 3.3Å; Y155-V159 WeakPolarHBondContact O-CG2 3.23Å; Y155-V159 PolarHBondContact O-N 2.92Å; Y155-Y171 WeakPolarHBondContact OH-CE2 3.22Å
156L97.4Very high97.5Very high44 Ų4459.4 Ų59.423%0.2331%0.306CS..Hα-helixtrans-62-42177.5-71177.7000112.3F152 G153 H158 V159 E160 Y186 I190F152-L156 WeakPolarHBondContact O-CG 2.97Å; F152-L156 PolarHBondContact O-N 3.23Å; G153-L156 PolarHBondContact O-N 3.28Å; L156-H158 VanDerWaalsContact C-N 3.31Å; L156-H158 PolarHBondContact O-N 2.77Å; L156-V159 PolarHBondContact O-N 3.33Å; L156-E160 PolarHBondContact O-N 3.36Å; L156-Y186 HydrophobicContact CD2-CD1 3.67Å; L156-Y186 HydrophobicContact CD2-CD2 4.31Å; L156-Y186 HydrophobicContact CD2-CE1 3.99Å; L156-Y186 HydrophobicContact CD2-CG 3.86Å; L156-I190 HydrophobicContact CD1-CD1 3.89Å; L156-I190 HydrophobicContact CD1-CG1 4.27Å
157I97.5Very high97.4Very high126 Ų12658.9 Ų58.965%0.64631%0.312SS*.Hα-helixtrans-59.5-45.1174.4-68.7165.3000110.1G153 G154 Y155 Y161G153-I157 WeakPolarHBondContact O-CG1 3.26Å; G153-I157 PolarHBondContact O-N 3.16Å; G154-I157 PolarHBondContact O-N 3.29Å; Y155-I157 PolarHBondContact O-N 3.02Å; I157-Y161 VanDerWaalsContact O-CB 3.28Å; I157-Y161 WeakPolarHBondContact O-CB 3.46Å; I157-Y161 PolarHBondContact O-N 3Å
158H96.7Very high97.2Very high68 Ų6859.7 Ų59.732%0.31532%0.315SS..Hα-helixtrans-62.5-44.9177.8177.758.3000112.4G154 Y155 L156 Y161 L162G154-H158 WeakPolarHBondContact O-CB 3.21Å; G154-H158 PolarHBondContact O-N 3.24Å; Y155-H158 WeakPolarHBondContact O-CB 3.09Å; Y155-H158 PolarHBondContact O-N 2.96Å; L156-H158 VanDerWaalsContact C-N 3.31Å; L156-H158 PolarHBondContact O-N 2.77Å; H158-Y161 WeakPolarHBondContact O-CB 3.49Å; H158-Y161 PolarHBondContact O-N 3.48Å; H158-L162 WeakPolarHBondContact O-CG 3.38Å; H158-L162 PolarHBondContact O-N 3.49Å
159V97.2Very high97Very high3 Ų362.7 Ų62.72%0.01833%0.326CS..Hα-helixtrans-61.1-48.7177.8170.40000111.2Y155 L156 Y161 L162 I163 P170 L174Y155-V159 HydrophobicContact CD1-CG2 3.99Å; Y155-V159 HydrophobicContact CD2-CG2 4.34Å; Y155-V159 HydrophobicContact CE1-CG2 3.52Å; Y155-V159 HydrophobicContact CE2-CG2 3.91Å; Y155-V159 HydrophobicContact CG-CG2 4.37Å; Y155-V159 VanDerWaalsContact CZ-CG2 3.46Å; Y155-V159 VanDerWaalsContact O-CG2 3.3Å; Y155-V159 WeakPolarHBondContact O-CG2 3.23Å; Y155-V159 PolarHBondContact O-N 2.92Å; L156-V159 PolarHBondContact O-N 3.33Å; V159-Y161 VanDerWaalsContact C-N 3.32Å; V159-Y161 PolarHBondContact O-N 3.23Å; V159-L162 PolarHBondContact O-N 2.84Å; V159-I163 HydrophobicContact CG1-CD1 3.79Å; V159-I163 WeakPolarHBondContact O-CG1 3.33Å; V159-I163 PolarHBondContact O-N 3.44Å; V159-P170 HydrophobicContact CG1-CG 4.23Å; V159-P170 HydrophobicContact CG2-CG 4.23Å; V159-L174 HydrophobicContact CG1-CD1 3.62Å
160E97.3Very high96.8Very high20 Ų2057.3 Ų57.39%0.09330%0.298CS..Hα-helixtrans-67.6-32.5178.3-80.7-70.2124.100112.2L156 I163 R164 R182 Y186L156-E160 PolarHBondContact O-N 3.36Å; E160-I163 PolarHBondContact O-N 2.97Å; E160-R164 VanDerWaalsContact O-CB 3.31Å; E160-R164 WeakPolarHBondContact O-CB 3.37Å; E160-R164 WeakPolarHBondContact O-CG 3.49Å; E160-R164 PolarHBondContact O-N 2.86Å; E160-R164 IonicContact OE2-CZ 2.92Å; E160-R164 IonicContact OE2-NE 2.74Å; E160-R164 PolarHBondContact OE2-NE 3.43Å; E160-R164 IonicContact OE2-NH2 3.5Å; E160-R164 PolarHBondContact OE2-NH2 2.74Å; E160-R182 IonicContact OE1-CZ 3.67Å; E160-R182 IonicContact OE1-NE 2.89Å; E160-R182 PolarHBondContact OE1-NE 3.45Å; E160-R182 IonicContact OE1-NH2 3.52Å; E160-R182 IonicContact OE2-NH2 3.55Å; E160-Y186 HydrophobicContact CG-CE2 3.95Å; E160-Y186 PolarHBondContact OE1-OH 2.81Å; E160-Y186 VanDerWaalsContact OE1-OH 3.12Å
161Y97.4Very high96.5Very high121 Ų12156.1 Ų56.148%0.47528%0.28SS..Hα-helixtrans-60.4-46.9170.7169-97.2000111.6I157 H158 V159 I163 I165 H166I157-Y161 VanDerWaalsContact O-CB 3.28Å; I157-Y161 WeakPolarHBondContact O-CB 3.46Å; I157-Y161 PolarHBondContact O-N 3Å; H158-Y161 WeakPolarHBondContact O-CB 3.49Å; H158-Y161 PolarHBondContact O-N 3.48Å; V159-Y161 VanDerWaalsContact C-N 3.32Å; V159-Y161 PolarHBondContact O-N 3.23Å; Y161-I163 VanDerWaalsContact C-N 3.35Å; Y161-I163 PolarHBondContact O-N 2.98Å; Y161-I165 HydrophobicContact CD2-CB 4.26Å; Y161-I165 HydrophobicContact CD2-CG1 3.68Å; Y161-I165 HydrophobicContact CE2-CB 4.11Å; Y161-I165 HydrophobicContact CE2-CG1 3.81Å; Y161-I165 HydrophobicContact CE2-CG2 4.2Å; Y161-I165 HydrophobicContact CG-CG1 4.49Å; Y161-I165 VanDerWaalsContact O-CB 3.26Å; Y161-I165 WeakPolarHBondContact O-CB 3.11Å; Y161-I165 WeakPolarHBondContact O-CG1 3.35Å; Y161-I165 PolarHBondContact O-N 3.17Å; Y161-H166 AromaticContact CE1-CD2 3.8Å; Y161-H166 AromaticContact CE1-NE2 3.6Å; Y161-H166 AromaticContact CZ-NE2 3.47Å; Y161-H166 PolarHBondContact OH-NE2 3.45Å; Y161-H166 VanDerWaalsContact OH-NE2 3.17Å
162L96.7Very high96.3Very high22 Ų2256.7 Ų56.712%0.11529%0.287CS..Hα-helixtrans-60.8-43.8176.1-69175.9000111.8R44 H158 V159 H166 S167 F168 P170R44-L162 HydrophobicContact CB-CD1 4.05Å; H158-L162 WeakPolarHBondContact O-CG 3.38Å; H158-L162 PolarHBondContact O-N 3.49Å; V159-L162 PolarHBondContact O-N 2.84Å; L162-H166 CarbonylContact O-C 3.42Å; L162-H166 WeakPolarHBondContact O-CA 3.34Å; L162-H166 WeakPolarHBondContact O-CB 3.28Å; L162-H166 PolarHBondContact O-N 3.01Å; L162-H166 VanDerWaalsContact O-N 3.08Å; L162-S167 PolarHBondContact O-N 3.4Å; L162-F168 CarbonylContact C-O 3.59Å; L162-F168 HydrophobicContact CB-CD1 4.43Å; L162-F168 WeakPolarHBondContact CB-O 3.42Å; L162-F168 HydrophobicContact CD1-CD1 4.35Å; L162-F168 HydrophobicContact CD2-CD1 4.48Å; L162-F168 PolarHBondContact O-N 3.09Å; L162-P170 HydrophobicContact CD1-CG 3.94Å
163I97.1Very high96.1Very high7 Ų756 Ų564%0.03629%0.285CS..Hα-helixtrans-68.2-49.8-178.6-68.7170.2000111.2V159 E160 Y161 S167 F168 Y169 L174V159-I163 HydrophobicContact CG1-CD1 3.79Å; V159-I163 WeakPolarHBondContact O-CG1 3.33Å; V159-I163 PolarHBondContact O-N 3.44Å; E160-I163 PolarHBondContact O-N 2.97Å; Y161-I163 VanDerWaalsContact C-N 3.35Å; Y161-I163 PolarHBondContact O-N 2.98Å; I163-S167 WeakPolarHBondContact O-CA 3.33Å; I163-S167 PolarHBondContact O-N 3.18Å; I163-S167 VanDerWaalsContact O-N 3.13Å; I163-F168 WeakPolarHBondContact CG1-O 3.3Å; I163-F168 PolarHBondContact N-O 3.48Å; I163-Y169 HydrophobicContact CB-CE1 4.37Å; I163-Y169 HydrophobicContact CD1-CD1 3.78Å; I163-Y169 HydrophobicContact CD1-CE1 4.03Å; I163-Y169 HydrophobicContact CG1-CD1 3.7Å; I163-Y169 HydrophobicContact CG1-CE1 3.94Å; I163-Y169 HydrophobicContact CG1-CG 4.24Å; I163-Y169 HydrophobicContact CG2-CD1 4.24Å; I163-Y169 HydrophobicContact CG2-CE1 3.57Å; I163-L174 HydrophobicContact CD1-CB 4.23Å; I163-L174 HydrophobicContact CD1-CD1 4.1Å
164R96.3Very high96Very high126 Ų12654.9 Ų54.948%0.47527%0.273SS..Hα-helixtrans-78.9-34.1-171.7-67.1-172.9-178-94.2-10.9113.7E160 D179E160-R164 VanDerWaalsContact O-CB 3.31Å; E160-R164 WeakPolarHBondContact O-CB 3.37Å; E160-R164 WeakPolarHBondContact O-CG 3.49Å; E160-R164 PolarHBondContact O-N 2.86Å; E160-R164 IonicContact OE2-CZ 2.92Å; E160-R164 IonicContact OE2-NE 2.74Å; E160-R164 PolarHBondContact OE2-NE 3.43Å; E160-R164 IonicContact OE2-NH2 3.5Å; E160-R164 PolarHBondContact OE2-NH2 2.74Å; R164-D179 IonicContact CZ-OD2 3.68Å; R164-D179 VanDerWaalsContact CZ-OD2 3.31Å; R164-D179 IonicContact NH1-OD2 3.38Å; R164-D179 PolarHBondContact NH1-OD2 2.96Å; R164-D179 IonicContact NH2-OD2 3.51Å; R164-D179 PolarHBondContact NH2-OD2 2.89Å
165I97.3Very high95.9Very high109 Ų10955.7 Ų55.756%0.55928%0.276SS*.Hα-helixtrans-95.6-36.2-175-53.5-55.5000111.5Y161Y161-I165 HydrophobicContact CD2-CB 4.26Å; Y161-I165 HydrophobicContact CD2-CG1 3.68Å; Y161-I165 HydrophobicContact CE2-CB 4.11Å; Y161-I165 HydrophobicContact CE2-CG1 3.81Å; Y161-I165 HydrophobicContact CE2-CG2 4.2Å; Y161-I165 HydrophobicContact CG-CG1 4.49Å; Y161-I165 VanDerWaalsContact O-CB 3.26Å; Y161-I165 WeakPolarHBondContact O-CB 3.11Å; Y161-I165 WeakPolarHBondContact O-CG1 3.35Å; Y161-I165 PolarHBondContact O-N 3.17Å
166H96.1Very high95.7Very high105 Ų10559.9 Ų59.949%0.48630%0.303SS..Hα-helixtrans-111.51.5-174.6-60.9-81000113.5Y161 L162 F168Y161-H166 AromaticContact CE1-CD2 3.8Å; Y161-H166 AromaticContact CE1-NE2 3.6Å; Y161-H166 AromaticContact CZ-NE2 3.47Å; Y161-H166 PolarHBondContact OH-NE2 3.45Å; Y161-H166 VanDerWaalsContact OH-NE2 3.17Å; L162-H166 CarbonylContact O-C 3.42Å; L162-H166 WeakPolarHBondContact O-CA 3.34Å; L162-H166 WeakPolarHBondContact O-CB 3.28Å; L162-H166 PolarHBondContact O-N 3.01Å; L162-H166 VanDerWaalsContact O-N 3.08Å; H166-F168 HydrophobicContact CB-CB 4.05Å; H166-F168 PolarHBondContact O-N 2.79Å; H166-F168 VanDerWaalsContact O-N 3.08Å
167S95.4Very high95.6Very high98 Ų9861.4 Ų61.469%0.68531%0.308SS*.  trans51.730.7-174-62.10000112.7L162 I163L162-S167 PolarHBondContact O-N 3.4Å; I163-S167 WeakPolarHBondContact O-CA 3.33Å; I163-S167 PolarHBondContact O-N 3.18Å; I163-S167 VanDerWaalsContact O-N 3.13Å
168F94.4Very high95.6Very high65 Ų6559.2 Ų59.229%0.28530%0.304SS..  trans-114.6118.5-169.2-175.8-106.1000110.8F41 R44 L162 I163 H166 P170F41-F168 HydrophobicContact CE1-CZ 4.47Å; F41-F168 AromaticContact CE2-CE1 3.88Å; F41-F168 HydrophobicContact CE2-CE1 3.88Å; F41-F168 AromaticContact CE2-CZ 3.92Å; F41-F168 HydrophobicContact CE2-CZ 3.92Å; F41-F168 AromaticContact CZ-CE1 3.87Å; F41-F168 HydrophobicContact CZ-CE1 3.87Å; F41-F168 HydrophobicContact CZ-CE2 4.3Å; F41-F168 AromaticContact CZ-CZ 3.46Å; F41-F168 HydrophobicContact CZ-CZ 3.46Å; F41-F168 VanDerWaalsContact CZ-CZ 3.46Å; R44-F168 VanDerWaalsContact CD-CE1 3.5Å; L162-F168 CarbonylContact C-O 3.59Å; L162-F168 HydrophobicContact CB-CD1 4.43Å; L162-F168 WeakPolarHBondContact CB-O 3.42Å; L162-F168 HydrophobicContact CD1-CD1 4.35Å; L162-F168 HydrophobicContact CD2-CD1 4.48Å; L162-F168 PolarHBondContact O-N 3.09Å; I163-F168 WeakPolarHBondContact CG1-O 3.3Å; I163-F168 PolarHBondContact N-O 3.48Å; H166-F168 HydrophobicContact CB-CB 4.05Å; H166-F168 PolarHBondContact O-N 2.79Å; H166-F168 VanDerWaalsContact O-N 3.08Å; F168-P170 WeakPolarHBondContact O-CD 3.39Å
169Y95Very high95.5Very high82 Ų8259.4 Ų59.432%0.32231%0.307SS..  trans-99.6119.3-175.9-64.7-94.7000110I163 Y171 L174 A175I163-Y169 HydrophobicContact CB-CE1 4.37Å; I163-Y169 HydrophobicContact CD1-CD1 3.78Å; I163-Y169 HydrophobicContact CD1-CE1 4.03Å; I163-Y169 HydrophobicContact CG1-CD1 3.7Å; I163-Y169 HydrophobicContact CG1-CE1 3.94Å; I163-Y169 HydrophobicContact CG1-CG 4.24Å; I163-Y169 HydrophobicContact CG2-CD1 4.24Å; I163-Y169 HydrophobicContact CG2-CE1 3.57Å; Y169-Y171 PolarHBondContact O-N 3.12Å; Y169-L174 HydrophobicContact CD1-CB 3.95Å; Y169-A175 HydrophobicContact CD1-CB 3.79Å; Y169-A175 HydrophobicContact CD2-CB 4.04Å; Y169-A175 HydrophobicContact CE1-CB 4.12Å; Y169-A175 HydrophobicContact CE2-CB 4.36Å; Y169-A175 HydrophobicContact CG-CB 3.74Å
170P92.9Very high95.5Very high4 Ų464.9 Ų64.93%0.02634%0.341CS..SBendtrans-60.6-32.1175.3-27.937.6000113.1R44 F45 V159 L162 F168R44-P170 HydrophobicContact CB-CB 4.5Å; R44-P170 PolarHBondContact NH1-O 2.89Å; F45-P170 WeakPolarHBondContact CE1-O 3.49Å; V159-P170 HydrophobicContact CG1-CG 4.23Å; V159-P170 HydrophobicContact CG2-CG 4.23Å; L162-P170 HydrophobicContact CD1-CG 3.94Å; F168-P170 WeakPolarHBondContact O-CD 3.39Å
171Y92.7Very high95.5Very high41 Ų4164.9 Ų64.916%0.16135%0.346CS..SBendtrans-134.5139179.6-58.3-75000110.6F45 L46 Y155 Y169 V173 L174F45-Y171 WeakPolarHBondContact CA-OH 3.46Å; F45-Y171 HydrophobicContact CD1-CD1 4.38Å; F45-Y171 AromaticContact CD1-CE1 3.72Å; F45-Y171 HydrophobicContact CD1-CE1 3.72Å; F45-Y171 AromaticContact CD1-CZ 3.95Å; F45-Y171 HydrophobicContact CE1-CE1 4.3Å; L46-Y171 PolarHBondContact N-OH 3Å; Y155-Y171 WeakPolarHBondContact OH-CE2 3.22Å; Y169-Y171 PolarHBondContact O-N 3.12Å; Y171-V173 PolarHBondContact O-N 3.35Å; Y171-L174 HydrophobicContact CD2-CD1 4.35Å; Y171-L174 PolarHBondContact O-N 3.39Å
172P94Very high95.5Very high42 Ų4259.3 Ų59.327%0.27333%0.325SS..Hα-helixtrans-53.5-35.4174.8-27.134.6000113.8L101 L102 L174 A175 V176L101-P172 WeakPolarHBondContact O-CD 3.36Å; L102-P172 VanDerWaalsContact O-CD 3.26Å; L102-P172 WeakPolarHBondContact O-CD 3.49Å; P172-L174 PolarHBondContact O-N 2.84Å; P172-L174 VanDerWaalsContact O-N 3.1Å; P172-A175 WeakPolarHBondContact O-CB 3.45Å; P172-A175 PolarHBondContact O-N 3.45Å; P172-V176 PolarHBondContact O-N 3.31Å
173V94Very high95.6Very high11 Ų1163.3 Ų63.37%0.06734%0.341CS..Hα-helixtrans-52.7-35.417772.70000113.2L101 Y171 A175 V176 F177L101-V173 HydrophobicContact CB-CB 4Å; L101-V173 HydrophobicContact CB-CG2 4.32Å; L101-V173 HydrophobicContact CD1-CG2 4.38Å; L101-V173 WeakPolarHBondContact O-CB 3.41Å; L101-V173 PolarHBondContact O-N 2.87Å; Y171-V173 PolarHBondContact O-N 3.35Å; V173-A175 VanDerWaalsContact C-N 3.35Å; V173-V176 PolarHBondContact O-N 3.44Å; V173-F177 HydrophobicContact CG2-CE2 3.94Å; V173-F177 WeakPolarHBondContact O-CD2 3.44Å
174L95.8Very high95.6Very high4 Ų464.7 Ų64.72%0.02136%0.357CS..Hα-helixtrans-76-26.6-179.4-61.7179.7000112.1V159 I163 Y169 Y171 P172 V176 R182 F185 Y186V159-L174 HydrophobicContact CG1-CD1 3.62Å; I163-L174 HydrophobicContact CD1-CB 4.23Å; I163-L174 HydrophobicContact CD1-CD1 4.1Å; Y169-L174 HydrophobicContact CD1-CB 3.95Å; Y171-L174 HydrophobicContact CD2-CD1 4.35Å; Y171-L174 PolarHBondContact O-N 3.39Å; P172-L174 PolarHBondContact O-N 2.84Å; P172-L174 VanDerWaalsContact O-N 3.1Å; L174-V176 VanDerWaalsContact C-N 3.33Å; L174-R182 WeakPolarHBondContact O-CD 3.41Å; L174-F185 HydrophobicContact CD2-CD1 3.84Å; L174-F185 HydrophobicContact CD2-CE1 4.02Å; L174-Y186 HydrophobicContact CD2-CE1 3.76Å
175A95Very high95.6Very high53 Ų5361 Ų6144%0.43834%0.344SS..Hα-helixtrans-75.2-24.4176.800000112.5Y169 P172 V173 F177Y169-A175 HydrophobicContact CD1-CB 3.79Å; Y169-A175 HydrophobicContact CD2-CB 4.04Å; Y169-A175 HydrophobicContact CE1-CB 4.12Å; Y169-A175 HydrophobicContact CE2-CB 4.36Å; Y169-A175 HydrophobicContact CG-CB 3.74Å; P172-A175 WeakPolarHBondContact O-CB 3.45Å; P172-A175 PolarHBondContact O-N 3.45Å; V173-A175 VanDerWaalsContact C-N 3.35Å; A175-F177 VanDerWaalsContact C-N 3.31Å
176V94.5Very high95.6Very high106 Ų10656.5 Ų56.564%0.64232%0.321SS*.Hα-helixtrans-71.4-28.5176178.70000111.7L101 P172 V173 L174L101-V176 HydrophobicContact CD2-CG2 4.22Å; P172-V176 PolarHBondContact O-N 3.31Å; V173-V176 PolarHBondContact O-N 3.44Å; L174-V176 VanDerWaalsContact C-N 3.33Å
177F95Very high95.7Very high76 Ų7655 Ų5533%0.33332%0.322SS..SBendtrans-88.2140.9-176.5-70.7-58.3000113.1V173 A175 R182 F185V173-F177 HydrophobicContact CG2-CE2 3.94Å; V173-F177 WeakPolarHBondContact O-CD2 3.44Å; A175-F177 VanDerWaalsContact C-N 3.31Å; F177-R182 HydrophobicContact CB-CG 3.66Å; F177-F185 HydrophobicContact CD2-CB 4.29Å; F177-F185 HydrophobicContact CE2-CB 4Å; F177-F185 AromaticContact CE2-CD2 3.94Å; F177-F185 HydrophobicContact CE2-CD2 3.94Å; F177-F185 HydrophobicContact CE2-CG 4.05Å; F177-F185 HydrophobicContact CZ-CD2 4.46Å
178S96.3Very high95.8Very high80 Ų8055.2 Ų55.256%0.55932%0.319SS*.  trans-61.5167.6159.468.80000111V180 G181 R182S178-V180 VanDerWaalsContact C-N 3.28Å; S178-V180 PolarHBondContact O-N 2.89Å; S178-G181 CarbonylContact O-C 3.18Å; S178-G181 WeakPolarHBondContact O-CA 3.38Å; S178-G181 PolarHBondContact O-N 3Å; S178-G181 PolarHBondContact OG-N 3.47Å; S178-R182 PolarHBondContact O-N 3.06Å
179D95.4Very high95.9Very high72 Ų7253.4 Ų53.439%0.38531%0.313SS..Hα-helixtrans-50.6-47.8175.2-8224.5000112.5R164 G181 R182 F183R164-D179 IonicContact CZ-OD2 3.68Å; R164-D179 VanDerWaalsContact CZ-OD2 3.31Å; R164-D179 IonicContact NH1-OD2 3.38Å; R164-D179 PolarHBondContact NH1-OD2 2.96Å; R164-D179 IonicContact NH2-OD2 3.51Å; R164-D179 PolarHBondContact NH2-OD2 2.89Å; D179-G181 VanDerWaalsContact C-N 3.33Å; D179-G181 PolarHBondContact O-N 3.38Å; D179-R182 VanDerWaalsContact CG-NH2 3.3Å; D179-R182 PolarHBondContact O-N 3.4Å; D179-R182 IonicContact OD1-CZ 3.25Å; D179-R182 VanDerWaalsContact OD1-CZ 3.25Å; D179-R182 IonicContact OD1-NH1 2.95Å; D179-R182 PolarHBondContact OD1-NH1 3.24Å; D179-R182 IonicContact OD1-NH2 2.72Å; D179-R182 PolarHBondContact OD1-NH2 2.94Å; D179-R182 IonicContact OD2-NH2 3.79Å; D179-F183 WeakPolarHBondContact O-CD2 3.34Å; D179-F183 PolarHBondContact O-N 2.98Å; D179-F183 VanDerWaalsContact O-N 3.16Å
180V97.2Very high96.1Very high118 Ų11853.5 Ų53.572%0.71532%0.318SS*.Hα-helixtrans-64.4-40.5177.3-179.90000110.9S178 R182 F183 G184S178-V180 VanDerWaalsContact C-N 3.28Å; S178-V180 PolarHBondContact O-N 2.89Å; V180-R182 PolarHBondContact O-N 3.39Å; V180-F183 PolarHBondContact O-N 3.39Å; V180-G184 PolarHBondContact O-N 3.08Å
181G97.5Very high96.3Very high21 Ų2159.2 Ų59.222%0.21635%0.346CS..Hα-helixtrans-60-42.3175.600000112.7S178 D179 G184 F185S178-G181 CarbonylContact O-C 3.18Å; S178-G181 WeakPolarHBondContact O-CA 3.38Å; S178-G181 PolarHBondContact O-N 3Å; S178-G181 PolarHBondContact OG-N 3.47Å; D179-G181 VanDerWaalsContact C-N 3.33Å; D179-G181 PolarHBondContact O-N 3.38Å; G181-G184 PolarHBondContact O-N 2.93Å; G181-F185 PolarHBondContact O-N 2.65Å
182R97.6Very high96.6Very high4 Ų458.5 Ų58.52%0.01535%0.349CS..Hα-helixtrans-63.1-45.1176.8-68.5-163.8-52.2-79.70.3111.5E160 L174 F177 S178 D179 V180 G184 F185 Y186E160-R182 IonicContact OE1-CZ 3.67Å; E160-R182 IonicContact OE1-NE 2.89Å; E160-R182 PolarHBondContact OE1-NE 3.45Å; E160-R182 IonicContact OE1-NH2 3.52Å; E160-R182 IonicContact OE2-NH2 3.55Å; L174-R182 WeakPolarHBondContact O-CD 3.41Å; F177-R182 HydrophobicContact CB-CG 3.66Å; S178-R182 PolarHBondContact O-N 3.06Å; D179-R182 VanDerWaalsContact CG-NH2 3.3Å; D179-R182 PolarHBondContact O-N 3.4Å; D179-R182 IonicContact OD1-CZ 3.25Å; D179-R182 VanDerWaalsContact OD1-CZ 3.25Å; D179-R182 IonicContact OD1-NH1 2.95Å; D179-R182 PolarHBondContact OD1-NH1 3.24Å; D179-R182 IonicContact OD1-NH2 2.72Å; D179-R182 PolarHBondContact OD1-NH2 2.94Å; D179-R182 IonicContact OD2-NH2 3.79Å; V180-R182 PolarHBondContact O-N 3.39Å; R182-G184 VanDerWaalsContact C-N 3.3Å; R182-G184 PolarHBondContact O-N 3.22Å; R182-F185 WeakPolarHBondContact O-CB 3.34Å; R182-F185 PolarHBondContact O-N 3.01Å; R182-F185 VanDerWaalsContact O-N 3.16Å; R182-Y186 HydrophobicContact CB-CE2 4.05Å; R182-Y186 VanDerWaalsContact O-CD2 3.31Å; R182-Y186 WeakPolarHBondContact O-CD2 3.4Å; R182-Y186 PolarHBondContact O-N 3.11Å
183F97.4Very high96.8Very high105 Ų10557.2 Ų57.246%0.46134%0.34SS..Hα-helixtrans-64.1-34.7175.5-73.7-65.8000113D179 V180 Y186 S187D179-F183 WeakPolarHBondContact O-CD2 3.34Å; D179-F183 PolarHBondContact O-N 2.98Å; D179-F183 VanDerWaalsContact O-N 3.16Å; V180-F183 PolarHBondContact O-N 3.39Å; F183-Y186 HydrophobicContact CD1-CD2 4.06Å; F183-Y186 PolarHBondContact O-N 3.07Å; F183-S187 WeakPolarHBondContact O-CB 3.4Å; F183-S187 PolarHBondContact O-N 3.25Å; F183-S187 PolarHBondContact O-OG 2.91Å
184G97.8Very high97Very high36 Ų3660.8 Ų60.837%0.37136%0.362SS..Hα-helixtrans-59.9-49.7169.400000111.9V180 G181 R182 Y186 S187 V188V180-G184 PolarHBondContact O-N 3.08Å; G181-G184 PolarHBondContact O-N 2.93Å; R182-G184 VanDerWaalsContact C-N 3.3Å; R182-G184 PolarHBondContact O-N 3.22Å; G184-Y186 PolarHBondContact O-N 3.21Å; G184-S187 WeakPolarHBondContact O-CB 3.44Å; G184-S187 PolarHBondContact O-N 3.06Å; G184-V188 PolarHBondContact O-N 2.96Å; G184-V188 VanDerWaalsContact O-N 3.09Å
185F96.9Very high97.2Very high48 Ų4866.2 Ų66.221%0.21139%0.39CS..Hα-helixtrans-59.6-43176.7179.1-99.7000112.6M90 L174 F177 G181 R182 S187 V188 T189M90-F185 HydrophobicContact CE-CE2 3.94Å; M90-F185 HydrophobicContact CE-CZ 3.69Å; L174-F185 HydrophobicContact CD2-CD1 3.84Å; L174-F185 HydrophobicContact CD2-CE1 4.02Å; F177-F185 HydrophobicContact CD2-CB 4.29Å; F177-F185 HydrophobicContact CE2-CB 4Å; F177-F185 AromaticContact CE2-CD2 3.94Å; F177-F185 HydrophobicContact CE2-CD2 3.94Å; F177-F185 HydrophobicContact CE2-CG 4.05Å; F177-F185 HydrophobicContact CZ-CD2 4.46Å; G181-F185 PolarHBondContact O-N 2.65Å; R182-F185 WeakPolarHBondContact O-CB 3.34Å; R182-F185 PolarHBondContact O-N 3.01Å; R182-F185 VanDerWaalsContact O-N 3.16Å; F185-S187 VanDerWaalsContact C-N 3.34Å; F185-S187 PolarHBondContact O-N 3.36Å; F185-V188 PolarHBondContact O-N 3.1Å; F185-T189 WeakPolarHBondContact O-CB 3.5Å; F185-T189 PolarHBondContact O-N 2.87Å; F185-T189 PolarHBondContact O-OG1 3.09Å
186Y97.6Very high97.3Very high15 Ų1564 Ų646%0.05937%0.372CS..Hα-helixtrans-62.3-41.7175.2-59.3-26.4000111.8L156 E160 L174 R182 F183 G184 V188 T189 I190L156-Y186 HydrophobicContact CD2-CD1 3.67Å; L156-Y186 HydrophobicContact CD2-CD2 4.31Å; L156-Y186 HydrophobicContact CD2-CE1 3.99Å; L156-Y186 HydrophobicContact CD2-CG 3.86Å; E160-Y186 HydrophobicContact CG-CE2 3.95Å; E160-Y186 PolarHBondContact OE1-OH 2.81Å; E160-Y186 VanDerWaalsContact OE1-OH 3.12Å; L174-Y186 HydrophobicContact CD2-CE1 3.76Å; R182-Y186 HydrophobicContact CB-CE2 4.05Å; R182-Y186 VanDerWaalsContact O-CD2 3.31Å; R182-Y186 WeakPolarHBondContact O-CD2 3.4Å; R182-Y186 PolarHBondContact O-N 3.11Å; F183-Y186 HydrophobicContact CD1-CD2 4.06Å; F183-Y186 PolarHBondContact O-N 3.07Å; G184-Y186 PolarHBondContact O-N 3.21Å; Y186-V188 PolarHBondContact O-N 2.9Å; Y186-T189 PolarHBondContact O-N 3.24Å; Y186-I190 WeakPolarHBondContact O-CB 3.35Å; Y186-I190 WeakPolarHBondContact O-CG1 3.19Å; Y186-I190 PolarHBondContact O-N 3.12Å
187S97.7Very high97.5Very high74 Ų7460 Ų6052%0.51735%0.346SS..Hα-helixtrans-61.5-44178.7-59.30000112F183 G184 F185 I190 M191F183-S187 WeakPolarHBondContact O-CB 3.4Å; F183-S187 PolarHBondContact O-N 3.25Å; F183-S187 PolarHBondContact O-OG 2.91Å; G184-S187 WeakPolarHBondContact O-CB 3.44Å; G184-S187 PolarHBondContact O-N 3.06Å; F185-S187 VanDerWaalsContact C-N 3.34Å; F185-S187 PolarHBondContact O-N 3.36Å; S187-I190 PolarHBondContact O-N 3.3Å; S187-M191 PolarHBondContact O-N 3.09Å
188V97.5Very high97.7Very high102 Ų10257.8 Ų57.862%0.61834%0.344SS*.Hα-helixtrans-64-43.6175.4175.60000111G184 F185 Y186 I190 M191 A192G184-V188 PolarHBondContact O-N 2.96Å; G184-V188 VanDerWaalsContact O-N 3.09Å; F185-V188 PolarHBondContact O-N 3.1Å; Y186-V188 PolarHBondContact O-N 2.9Å; V188-I190 PolarHBondContact O-N 2.93Å; V188-M191 WeakPolarHBondContact O-CB 3.48Å; V188-M191 PolarHBondContact O-N 2.87Å; V188-A192 PolarHBondContact O-N 2.97Å
189T97.2Very high97.8Very high27 Ų2757.2 Ų57.217%0.16634%0.337CS..Hα-helixtrans-65.6-38.7179.4-55.30000111.9F185 Y186 A192 T193F185-T189 WeakPolarHBondContact O-CB 3.5Å; F185-T189 PolarHBondContact O-N 2.87Å; F185-T189 PolarHBondContact O-OG1 3.09Å; Y186-T189 PolarHBondContact O-N 3.24Å; T189-A192 PolarHBondContact O-N 3.34Å; T189-T193 WeakPolarHBondContact O-CB 3.31Å; T189-T193 PolarHBondContact O-N 3.45Å; T189-T193 PolarHBondContact O-OG1 3.33Å
190I98.1Very high97.9Very high84 Ų8453.8 Ų53.843%0.43132%0.319SS..Hα-helixtrans-63.4-45.2174-71.4164.1000110.1L156 Y186 S187 V188 A192 T193 V194L156-I190 HydrophobicContact CD1-CD1 3.89Å; L156-I190 HydrophobicContact CD1-CG1 4.27Å; Y186-I190 WeakPolarHBondContact O-CB 3.35Å; Y186-I190 WeakPolarHBondContact O-CG1 3.19Å; Y186-I190 PolarHBondContact O-N 3.12Å; S187-I190 PolarHBondContact O-N 3.3Å; V188-I190 PolarHBondContact O-N 2.93Å; I190-A192 PolarHBondContact O-N 3.23Å; I190-T193 WeakPolarHBondContact O-CB 3.46Å; I190-T193 PolarHBondContact O-N 3.46Å; I190-T193 VanDerWaalsContact O-N 3.13Å; I190-V194 WeakPolarHBondContact O-CG2 3.29Å; I190-V194 PolarHBondContact O-N 3.41Å
191M98.2Very high97.9Very high125 Ų12548.8 Ų48.862%0.61629%0.289SS*.Hα-helixtrans-58.3-48.1176.7-171.667.969.400111.2S187 V188 T193 V194 L195S187-M191 PolarHBondContact O-N 3.09Å; V188-M191 WeakPolarHBondContact O-CB 3.48Å; V188-M191 PolarHBondContact O-N 2.87Å; M191-T193 VanDerWaalsContact C-N 3.3Å; M191-T193 PolarHBondContact O-N 3.24Å; M191-V194 PolarHBondContact O-N 3.44Å; M191-L195 WeakPolarHBondContact O-CG 3.2Å; M191-L195 PolarHBondContact O-N 2.68Å
192A98.4Very high97.9Very high26 Ų2653.1 Ų53.122%0.21531%0.306CS..Hα-helixtrans-60-40.117500000112.1I86 V188 T189 I190 V194 L195 C196I86-A192 HydrophobicContact CD1-CB 3.63Å; V188-A192 PolarHBondContact O-N 2.97Å; T189-A192 PolarHBondContact O-N 3.34Å; I190-A192 PolarHBondContact O-N 3.23Å; A192-V194 PolarHBondContact O-N 3.49Å; A192-L195 WeakPolarHBondContact O-CB 3.5Å; A192-L195 PolarHBondContact O-N 3.16Å; A192-C196 PolarHBondContact O-N 3.01Å; A192-C196 PolarHBondContact O-SG 2.82Å
193T98.5Very high97.8Very high15 Ų1554.5 Ų54.59%0.09231%0.313CS..Hα-helixtrans-62.1-42.1175.6-56.80000112T82 F152 T189 I190 M191 L195 C196 F197T82-T193 HydrophobicContact CG2-CG2 3.83Å; F152-T193 HydrophobicContact CD2-CG2 3.78Å; F152-T193 HydrophobicContact CE1-CG2 4.39Å; F152-T193 HydrophobicContact CE2-CG2 3.5Å; F152-T193 HydrophobicContact CG-CG2 4.33Å; F152-T193 HydrophobicContact CZ-CG2 3.82Å; T189-T193 WeakPolarHBondContact O-CB 3.31Å; T189-T193 PolarHBondContact O-N 3.45Å; T189-T193 PolarHBondContact O-OG1 3.33Å; I190-T193 WeakPolarHBondContact O-CB 3.46Å; I190-T193 PolarHBondContact O-N 3.46Å; I190-T193 VanDerWaalsContact O-N 3.13Å; M191-T193 VanDerWaalsContact C-N 3.3Å; M191-T193 PolarHBondContact O-N 3.24Å; T193-L195 VanDerWaalsContact C-N 3.32Å; T193-L195 PolarHBondContact O-N 2.79Å; T193-C196 WeakPolarHBondContact O-CB 3.48Å; T193-C196 PolarHBondContact O-N 3.25Å; T193-F197 PolarHBondContact O-N 3.15Å
194V98.3Very high97.7Very high86 Ų8649.5 Ų49.552%0.52129%0.291SS..Hα-helixtrans-62.8-40.3175.9171.20000110.9I190 M191 A192 F197 G198I190-V194 WeakPolarHBondContact O-CG2 3.29Å; I190-V194 PolarHBondContact O-N 3.41Å; M191-V194 PolarHBondContact O-N 3.44Å; A192-V194 PolarHBondContact O-N 3.49Å; V194-F197 PolarHBondContact O-N 2.77Å; V194-G198 PolarHBondContact O-N 3.35Å
195L98.5Very high97.5Very high118 Ų11855.1 Ų55.162%0.61830%0.301SS*.Hα-helixtrans-62.5-45.7174-66.6173000111.5M191 A192 T193 F197 G198 V199M191-L195 WeakPolarHBondContact O-CG 3.2Å; M191-L195 PolarHBondContact O-N 2.68Å; A192-L195 WeakPolarHBondContact O-CB 3.5Å; A192-L195 PolarHBondContact O-N 3.16Å; T193-L195 VanDerWaalsContact C-N 3.32Å; T193-L195 PolarHBondContact O-N 2.79Å; L195-F197 VanDerWaalsContact C-N 3.3Å; L195-F197 PolarHBondContact O-N 3.48Å; L195-G198 WeakPolarHBondContact O-CA 3.37Å; L195-G198 PolarHBondContact O-N 3.47Å; L195-G198 VanDerWaalsContact O-N 3.08Å; L195-V199 WeakPolarHBondContact O-CG2 3.49Å; L195-V199 PolarHBondContact O-N 3.27Å
196C98.6Very high97.4Very high6 Ų656.1 Ų56.14%0.04131%0.314CS..Hα-helixtrans-58.7-40174.3-69.60000112.5T82 L85 A192 T193 V199 S200T82-C196 HydrophobicContact CG2-CB 3.96Å; L85-C196 HydrophobicContact CB-CB 4.39Å; L85-C196 HydrophobicContact CD2-CB 3.92Å; L85-C196 HydrophobicContact CG-CB 4.24Å; A192-C196 PolarHBondContact O-N 3.01Å; A192-C196 PolarHBondContact O-SG 2.82Å; T193-C196 WeakPolarHBondContact O-CB 3.48Å; T193-C196 PolarHBondContact O-N 3.25Å; C196-V199 WeakPolarHBondContact O-CB 3.25Å; C196-V199 PolarHBondContact O-N 3.16Å; C196-S200 PolarHBondContact O-N 3.16Å
197F98.5Very high97.1Very high22 Ų2256.2 Ų56.210%0.09632%0.316CS..Hα-helixtrans-64.8-41173.3175.6-119.5000111.8T82 V139 I141 I145 L148 T193 V194 L195 V199 S200 V201T82-F197 HydrophobicContact CG2-CB 4.01Å; T82-F197 WeakPolarHBondContact OG1-CA 3.27Å; V139-F197 HydrophobicContact CG1-CE2 4.27Å; V139-F197 HydrophobicContact CG1-CZ 4.4Å; I141-F197 HydrophobicContact CD1-CZ 4.22Å; I145-F197 HydrophobicContact CG1-CE1 4.18Å; L148-F197 HydrophobicContact CD1-CB 3.96Å; L148-F197 HydrophobicContact CD1-CD1 3.97Å; L148-F197 HydrophobicContact CD1-CD2 3.52Å; L148-F197 HydrophobicContact CD1-CE1 4.35Å; L148-F197 HydrophobicContact CD1-CE2 3.94Å; L148-F197 HydrophobicContact CD1-CG 3.53Å; L148-F197 HydrophobicContact CD1-CZ 4.33Å; T193-F197 PolarHBondContact O-N 3.15Å; V194-F197 PolarHBondContact O-N 2.77Å; L195-F197 VanDerWaalsContact C-N 3.3Å; L195-F197 PolarHBondContact O-N 3.48Å; F197-V199 VanDerWaalsContact C-N 3.29Å; F197-V199 PolarHBondContact O-N 3.2Å; F197-S200 WeakPolarHBondContact O-CA 3.48Å; F197-S200 VanDerWaalsContact O-CB 3.26Å; F197-S200 WeakPolarHBondContact O-CB 3.39Å; F197-S200 PolarHBondContact O-N 2.98Å; F197-S200 VanDerWaalsContact O-N 3.09Å; F197-V201 HydrophobicContact CD2-CG2 4.37Å; F197-V201 HydrophobicContact CE1-CG2 4.12Å; F197-V201 HydrophobicContact CE2-CG2 3.91Å; F197-V201 HydrophobicContact CZ-CG2 3.78Å; F197-V201 WeakPolarHBondContact O-CG2 3.33Å; F197-V201 PolarHBondContact O-N 2.97Å
198G98.2Very high96.8Very high29 Ų2954.7 Ų54.730%0.29930%0.302SS..Hα-helixtrans-55.2-44.3171.600000112.3V194 L195 S200 V201 L202V194-G198 PolarHBondContact O-N 3.35Å; L195-G198 WeakPolarHBondContact O-CA 3.37Å; L195-G198 PolarHBondContact O-N 3.47Å; L195-G198 VanDerWaalsContact O-N 3.08Å; G198-S200 PolarHBondContact O-N 2.9Å; G198-V201 PolarHBondContact O-N 3.41Å; G198-L202 VanDerWaalsContact O-CG 3.31Å; G198-L202 WeakPolarHBondContact O-CG 3.42Å; G198-L202 PolarHBondContact O-N 2.88Å
199V98.2Very high96.4Very high69 Ų6956.3 Ų56.342%0.41830%0.301SS..Hα-helixtrans-59.7-44.3173.9175.80000111.2F81 L85 L195 C196 F197 V201 L202 M203F81-V199 HydrophobicContact CE1-CB 4.42Å; F81-V199 HydrophobicContact CE1-CG1 4Å; F81-V199 HydrophobicContact CZ-CG1 4.07Å; L85-V199 HydrophobicContact CD2-CB 4.31Å; L85-V199 HydrophobicContact CD2-CG1 4.23Å; L195-V199 WeakPolarHBondContact O-CG2 3.49Å; L195-V199 PolarHBondContact O-N 3.27Å; C196-V199 WeakPolarHBondContact O-CB 3.25Å; C196-V199 PolarHBondContact O-N 3.16Å; F197-V199 VanDerWaalsContact C-N 3.29Å; F197-V199 PolarHBondContact O-N 3.2Å; V199-V201 VanDerWaalsContact C-N 3.34Å; V199-V201 PolarHBondContact O-N 3.25Å; V199-L202 PolarHBondContact O-N 3.13Å; V199-M203 WeakPolarHBondContact O-CB 3.35Å; V199-M203 PolarHBondContact O-N 3.3Å
200S97.5Very high95.8Very high0 Ų057.6 Ų57.60%031%0.308CS..Hα-helixtrans-56.2-47.6174.9-173.10000111.9S78 C196 F197 G198 M203 V204S78-S200 WeakPolarHBondContact CA-OG 3.4Å; S78-S200 PolarHBondContact OG-OG 2.93Å; C196-S200 PolarHBondContact O-N 3.16Å; F197-S200 WeakPolarHBondContact O-CA 3.48Å; F197-S200 VanDerWaalsContact O-CB 3.26Å; F197-S200 WeakPolarHBondContact O-CB 3.39Å; F197-S200 PolarHBondContact O-N 2.98Å; F197-S200 VanDerWaalsContact O-N 3.09Å; G198-S200 PolarHBondContact O-N 2.9Å; S200-M203 PolarHBondContact O-N 3.05Å; S200-V204 WeakPolarHBondContact O-CG2 3.43Å; S200-V204 PolarHBondContact O-N 3.29Å
201V97.4Very high95Very high13 Ų1357.5 Ų57.58%0.07931%0.306CS..Hα-helixtrans-63.4-44.7179.7173.50000111.3V139 I141 F197 G198 V199 M203 V204 R205V139-V201 HydrophobicContact CB-CG2 4.41Å; V139-V201 HydrophobicContact CG1-CG2 4.34Å; V139-V201 HydrophobicContact CG2-CG2 4.37Å; I141-V201 HydrophobicContact CD1-CG1 4.35Å; I141-V201 HydrophobicContact CD1-CG2 3.88Å; F197-V201 HydrophobicContact CD2-CG2 4.37Å; F197-V201 HydrophobicContact CE1-CG2 4.12Å; F197-V201 HydrophobicContact CE2-CG2 3.91Å; F197-V201 HydrophobicContact CZ-CG2 3.78Å; F197-V201 WeakPolarHBondContact O-CG2 3.33Å; F197-V201 PolarHBondContact O-N 2.97Å; G198-V201 PolarHBondContact O-N 3.41Å; V199-V201 VanDerWaalsContact C-N 3.34Å; V199-V201 PolarHBondContact O-N 3.25Å; V201-M203 VanDerWaalsContact C-N 3.34Å; V201-M203 PolarHBondContact O-N 2.86Å; V201-V204 PolarHBondContact O-N 2.72Å; V201-R205 WeakPolarHBondContact O-CB 3.36Å; V201-R205 VanDerWaalsContact O-CG 3.32Å; V201-R205 WeakPolarHBondContact O-CG 3.5Å; V201-R205 PolarHBondContact O-N 2.95Å
202L96.9Very high94.2Very high111 Ų11159.9 Ų59.958%0.58131%0.309SS*.Hα-helixtrans-63.4-40.5177.8-69.6171.5000111.6G198 V199 R205 S206G198-L202 VanDerWaalsContact O-CG 3.31Å; G198-L202 WeakPolarHBondContact O-CG 3.42Å; G198-L202 PolarHBondContact O-N 2.88Å; V199-L202 PolarHBondContact O-N 3.13Å; L202-R205 PolarHBondContact O-N 3.41Å; L202-S206 WeakPolarHBondContact O-CB 3.47Å; L202-S206 PolarHBondContact O-N 3.3Å
203M95.8Very high93.5Very high34 Ų3464.7 Ų64.717%0.16733%0.326CS..Hα-helixtrans-61.1-51176.4-175.3176.9176.400111.2Y77 F81 I128 A131 V199 S200 V201 R205 S206 L207Y77-M203 PolarHBondContact OH-SD 3.08Å; Y77-M203 VanDerWaalsContact OH-SD 3.41Å; F81-M203 HydrophobicContact CD2-SD 4.26Å; F81-M203 HydrophobicContact CE2-SD 3.59Å; F81-M203 VanDerWaalsContact CE2-SD 3.59Å; F81-M203 HydrophobicContact CZ-SD 4.09Å; I128-M203 HydrophobicContact CB-CE 4Å; I128-M203 HydrophobicContact CG1-CE 3.82Å; I128-M203 HydrophobicContact CG1-SD 4.09Å; I128-M203 HydrophobicContact CG2-CE 3.73Å; A131-M203 HydrophobicContact CB-CE 3.84Å; V199-M203 WeakPolarHBondContact O-CB 3.35Å; V199-M203 PolarHBondContact O-N 3.3Å; S200-M203 PolarHBondContact O-N 3.05Å; V201-M203 VanDerWaalsContact C-N 3.34Å; V201-M203 PolarHBondContact O-N 2.86Å; M203-R205 VanDerWaalsContact C-N 3.33Å; M203-R205 PolarHBondContact O-N 3.48Å; M203-S206 WeakPolarHBondContact O-CB 3.42Å; M203-S206 PolarHBondContact O-N 3.16Å; M203-L207 HydrophobicContact CE-CD1 4.16Å; M203-L207 HydrophobicContact CG-CD1 4.28Å; M203-L207 WeakPolarHBondContact O-CG 3.13Å; M203-L207 PolarHBondContact O-N 2.97Å
204V95.3Very high92.8Very high0 Ų071 Ų710%035%0.347CS..Hα-helixtrans-60-43.2177.9173.40000111.2Y77 P136 T137 V139 S200 V201 S206 L207 N208Y77-V204 HydrophobicContact CD1-CG2 3.92Å; Y77-V204 HydrophobicContact CE1-CG2 3.52Å; P136-V204 HydrophobicContact CB-CG1 4.41Å; P136-V204 HydrophobicContact CB-CG2 4.2Å; P136-V204 HydrophobicContact CG-CG2 4.32Å; T137-V204 VanDerWaalsContact O-CG1 3.28Å; T137-V204 WeakPolarHBondContact O-CG1 3.45Å; V139-V204 HydrophobicContact CG2-CB 3.78Å; V139-V204 HydrophobicContact CG2-CG1 3.83Å; V139-V204 HydrophobicContact CG2-CG2 3.78Å; S200-V204 WeakPolarHBondContact O-CG2 3.43Å; S200-V204 PolarHBondContact O-N 3.29Å; V201-V204 PolarHBondContact O-N 2.72Å; V204-S206 PolarHBondContact O-N 2.91Å; V204-L207 PolarHBondContact O-N 3.48Å; V204-N208 WeakPolarHBondContact CG1-ND2 3.26Å; V204-N208 PolarHBondContact O-N 2.96Å; V204-N208 VanDerWaalsContact O-N 3.07Å; V204-N208 PolarHBondContact O-ND2 3.1Å
205R94.5Very high92.2Very high153 Ų15371.4 Ų71.458%0.57735%0.346SS*.Hα-helixtrans-61.1-44.2176-75.1176.5176.6175.90.1112V201 L202 M203 N208 K209V201-R205 WeakPolarHBondContact O-CB 3.36Å; V201-R205 VanDerWaalsContact O-CG 3.32Å; V201-R205 WeakPolarHBondContact O-CG 3.5Å; V201-R205 PolarHBondContact O-N 2.95Å; L202-R205 PolarHBondContact O-N 3.41Å; M203-R205 VanDerWaalsContact C-N 3.33Å; M203-R205 PolarHBondContact O-N 3.48Å; R205-N208 PolarHBondContact O-N 3.24Å; R205-K209 WeakPolarHBondContact O-CB 3.48Å; R205-K209 PolarHBondContact O-N 3.35Å
206S93.8Very high91.7Very high70 Ų7068.4 Ų68.449%0.4934%0.336SS..Hα-helixtrans-61.8-44.7178-178.10000112.1L202 M203 V204 N208 K209 T210L202-S206 WeakPolarHBondContact O-CB 3.47Å; L202-S206 PolarHBondContact O-N 3.3Å; M203-S206 WeakPolarHBondContact O-CB 3.42Å; M203-S206 PolarHBondContact O-N 3.16Å; V204-S206 PolarHBondContact O-N 2.91Å; S206-N208 VanDerWaalsContact C-N 3.34Å; S206-N208 PolarHBondContact O-N 3.32Å; S206-K209 PolarHBondContact O-N 2.85Å; S206-T210 WeakPolarHBondContact O-CB 3.28Å; S206-T210 PolarHBondContact O-N 3.41Å; S206-T210 PolarHBondContact O-OG1 3.34Å
207L92.6Very high91.2Very high16 Ų1671 Ų718%0.08435%0.354CS..Hα-helixtrans-62.6-39.8177.6-69.2176.7000112.5A131 L132 R135 M203 V204 Q211A131-L207 HydrophobicContact CB-CD1 3.76Å; L132-L207 HydrophobicContact CD2-CD2 3.68Å; R135-L207 PolarHBondContact NH1-O 3.31Å; R135-L207 VanDerWaalsContact NH1-O 3.13Å; M203-L207 HydrophobicContact CE-CD1 4.16Å; M203-L207 HydrophobicContact CG-CD1 4.28Å; M203-L207 WeakPolarHBondContact O-CG 3.13Å; M203-L207 PolarHBondContact O-N 2.97Å; V204-L207 PolarHBondContact O-N 3.48Å; L207-Q211 PolarHBondContact O-N 3.5Å
208N91Very high90.6Very high43 Ų4376.8 Ų76.823%0.2338%0.379CS..Hα-helixtrans-73.1-41.9178.2-79.6-75.2000112.4P136 V204 R205 S206 T210 Q211 Y212P136-N208 PolarHBondContact O-ND2 3.09Å; V204-N208 WeakPolarHBondContact CG1-ND2 3.26Å; V204-N208 PolarHBondContact O-N 2.96Å; V204-N208 VanDerWaalsContact O-N 3.07Å; V204-N208 PolarHBondContact O-ND2 3.1Å; R205-N208 PolarHBondContact O-N 3.24Å; S206-N208 VanDerWaalsContact C-N 3.34Å; S206-N208 PolarHBondContact O-N 3.32Å; N208-T210 VanDerWaalsContact C-N 3.29Å; N208-T210 PolarHBondContact O-N 3.3Å; N208-Q211 WeakPolarHBondContact O-CB 3.15Å; N208-Q211 PolarHBondContact O-N 3.05Å; N208-Q211 VanDerWaalsContact O-N 3.1Å; N208-Y212 PolarHBondContact O-N 3.12Å
209K90.1Very high90.1Very high136 Ų13679.6 Ų79.659%0.59139%0.39SS*.Hα-helixtrans-59.5-42.1175.6-175.8176.3-176.9176.30111.6R205 S206 Q211 Y212 K213R205-K209 WeakPolarHBondContact O-CB 3.48Å; R205-K209 PolarHBondContact O-N 3.35Å; S206-K209 PolarHBondContact O-N 2.85Å; K209-Q211 VanDerWaalsContact C-N 3.25Å; K209-Q211 PolarHBondContact O-N 3.27Å; K209-Y212 PolarHBondContact O-N 3.31Å; K209-K213 PolarHBondContact O-N 3Å; K209-K213 VanDerWaalsContact O-N 3.15Å
210T84Confident89.6Confident54 Ų5481.8 Ų81.833%0.33140%0.396SS..Hα-helixtrans-62.3-34.5177.3-56.90000111.7S206 N208 R214S206-T210 WeakPolarHBondContact O-CB 3.28Å; S206-T210 PolarHBondContact O-N 3.41Å; S206-T210 PolarHBondContact O-OG1 3.34Å; N208-T210 VanDerWaalsContact C-N 3.29Å; N208-T210 PolarHBondContact O-N 3.3Å; T210-R214 VanDerWaalsContact O-CG 3.31Å; T210-R214 WeakPolarHBondContact O-CG 3.42Å; T210-R214 PolarHBondContact O-N 2.86Å
211Q81.1Confident89.1Confident81 Ų8188.2 Ų88.238%0.37943%0.426SS..Hα-helixtrans-71.5-45.3177179.7175.7-20.100112.4L207 N208 K209 K213 R214 L215L207-Q211 PolarHBondContact O-N 3.5Å; N208-Q211 WeakPolarHBondContact O-CB 3.15Å; N208-Q211 PolarHBondContact O-N 3.05Å; N208-Q211 VanDerWaalsContact O-N 3.1Å; K209-Q211 VanDerWaalsContact C-N 3.25Å; K209-Q211 PolarHBondContact O-N 3.27Å; Q211-K213 VanDerWaalsContact C-N 3.31Å; Q211-K213 PolarHBondContact O-N 3.37Å; Q211-R214 PolarHBondContact O-N 3.39Å; Q211-R214 VanDerWaalsContact O-N 3.16Å; Q211-L215 HydrophobicContact CG-CD1 3.95Å; Q211-L215 HydrophobicContact CG-CG 4.49Å; Q211-L215 WeakPolarHBondContact O-CG 3.38Å; Q211-L215 PolarHBondContact O-N 2.9Å
212Y80.9Confident88.6Confident176 Ų17696 Ų9669%0.6945%0.454SS*.Hα-helixtrans-57.6-45.6176.8-178.5-96.9000111.3N208 K209 R214 L215 S216N208-Y212 PolarHBondContact O-N 3.12Å; K209-Y212 PolarHBondContact O-N 3.31Å; Y212-R214 PolarHBondContact O-N 3.14Å; Y212-L215 PolarHBondContact O-N 3.35Å; Y212-S216 PolarHBondContact O-N 3.48Å; Y212-S216 PolarHBondContact O-OG 3.1Å
213K84.7Confident88.1Confident127 Ų12794 Ų9455%0.55245%0.446SS*.Hα-helixtrans-60.1-39.7175.6-73-174173.2-167.10113.6K209 Q211 S216 S217K209-K213 PolarHBondContact O-N 3Å; K209-K213 VanDerWaalsContact O-N 3.15Å; Q211-K213 VanDerWaalsContact C-N 3.31Å; Q211-K213 PolarHBondContact O-N 3.37Å; K213-S216 WeakPolarHBondContact CA-OG 3.12Å; K213-S216 PolarHBondContact O-OG 3.07Å; K213-S217 WeakPolarHBondContact O-CB 3.47Å; K213-S217 PolarHBondContact O-N 3.2Å; K213-S217 VanDerWaalsContact O-N 3.08Å; K213-S217 PolarHBondContact O-OG 2.94Å
214R83.1Confident87.6Confident146 Ų14697 Ų9755%0.55146%0.46SS*.Hα-helixtrans-70.4-33.6177.3-75.3175.5179.9-172.6-0.1112.6T210 Q211 Y212 S217 K218T210-R214 VanDerWaalsContact O-CG 3.31Å; T210-R214 WeakPolarHBondContact O-CG 3.42Å; T210-R214 PolarHBondContact O-N 2.86Å; Q211-R214 PolarHBondContact O-N 3.39Å; Q211-R214 VanDerWaalsContact O-N 3.16Å; Y212-R214 PolarHBondContact O-N 3.14Å; R214-S217 PolarHBondContact O-OG 3.42Å; R214-K218 WeakPolarHBondContact O-CB 3.4Å; R214-K218 VanDerWaalsContact O-CG 3.3Å; R214-K218 WeakPolarHBondContact O-CG 3.33Å; R214-K218 PolarHBondContact O-N 3.09Å
215L85.7Confident87.1Confident95 Ų95106.2 Ų106.250%0.49750%0.495SS..Hα-helixtrans-72.6-43.3176.2-74.1167.4000110.7Q211 Y212 K218 T219Q211-L215 HydrophobicContact CG-CD1 3.95Å; Q211-L215 HydrophobicContact CG-CG 4.49Å; Q211-L215 WeakPolarHBondContact O-CG 3.38Å; Q211-L215 PolarHBondContact O-N 2.9Å; Y212-L215 PolarHBondContact O-N 3.35Å; L215-K218 PolarHBondContact O-N 3.1Å; L215-T219 WeakPolarHBondContact O-CB 3.36Å; L215-T219 PolarHBondContact O-N 3.19Å; L215-T219 PolarHBondContact O-OG1 3.48Å
216S87.5Confident86.5Confident56 Ų56106 Ų10639%0.39250%0.498SS..Hα-helixtrans-62.5-44.3177.366.70000111.6Y212 K213 K218 T219 Q220Y212-S216 PolarHBondContact O-N 3.48Å; Y212-S216 PolarHBondContact O-OG 3.1Å; K213-S216 WeakPolarHBondContact CA-OG 3.12Å; K213-S216 PolarHBondContact O-OG 3.07Å; S216-K218 PolarHBondContact O-N 3.45Å; S216-T219 PolarHBondContact O-N 3.29Å; S216-Q220 WeakPolarHBondContact O-CB 3.37Å; S216-Q220 PolarHBondContact O-N 2.92Å
217S88.4Confident85.8Confident61 Ų61110 Ų11043%0.42751%0.509SS..Hα-helixtrans-65-40.2178.567.80000113K213 R214 Q220 Q221K213-S217 WeakPolarHBondContact O-CB 3.47Å; K213-S217 PolarHBondContact O-N 3.2Å; K213-S217 VanDerWaalsContact O-N 3.08Å; K213-S217 PolarHBondContact O-OG 2.94Å; R214-S217 PolarHBondContact O-OG 3.42Å; S217-Q220 PolarHBondContact O-N 2.8Å; S217-Q221 WeakPolarHBondContact O-CB 3.21Å; S217-Q221 PolarHBondContact O-N 3.03Å
218K86.6Confident85.1Confident143 Ų143113.4 Ų113.462%0.62253%0.534SS*.Hα-helixtrans-65.5-39.1174.9-77.5-177.6177.4-170.60112.5R214 L215 S216 R222R214-K218 WeakPolarHBondContact O-CB 3.4Å; R214-K218 VanDerWaalsContact O-CG 3.3Å; R214-K218 WeakPolarHBondContact O-CG 3.33Å; R214-K218 PolarHBondContact O-N 3.09Å; L215-K218 PolarHBondContact O-N 3.1Å; S216-K218 PolarHBondContact O-N 3.45Å; K218-R222 WeakPolarHBondContact O-CB 3.26Å; K218-R222 PolarHBondContact O-N 3.3Å
219T87.2Confident84Confident88 Ų88115.9 Ų115.954%0.5455%0.55SS.*Hα-helixtrans-65.9-42.5176.2-61.30000110.9L215 S216 R222 T223L215-T219 WeakPolarHBondContact O-CB 3.36Å; L215-T219 PolarHBondContact O-N 3.19Å; L215-T219 PolarHBondContact O-OG1 3.48Å; S216-T219 PolarHBondContact O-N 3.29Å; T219-R222 PolarHBondContact O-N 3.32Å; T219-T223 PolarHBondContact O-N 3.2Å; T219-T223 PolarHBondContact O-OG1 3.2Å
220Q87.6Confident82.6Confident115 Ų115114.2 Ų114.254%0.53755%0.554SS.*Hα-helixtrans-61-51.8175.2-175.8177.4-7.300111.3S216 S217 R222 T223 E224S216-Q220 WeakPolarHBondContact O-CB 3.37Å; S216-Q220 PolarHBondContact O-N 2.92Å; S217-Q220 PolarHBondContact O-N 2.8Å; Q220-R222 VanDerWaalsContact C-N 3.26Å; Q220-R222 PolarHBondContact O-N 2.8Å; Q220-T223 WeakPolarHBondContact O-CA 3.37Å; Q220-T223 WeakPolarHBondContact O-CB 3.35Å; Q220-T223 PolarHBondContact O-N 3.26Å; Q220-E224 WeakPolarHBondContact CG-OE1 3.36Å; Q220-E224 PolarHBondContact NE2-OE1 2.99Å; Q220-E224 PolarHBondContact O-N 3.2Å
221Q86.7Confident81.5Confident134 Ų134117.8 Ų117.863%0.62658%0.575SS**Hα-helixtrans-59.2-35.6178.2-169.1-177.417.400112.8S217 T223 R225S217-Q221 WeakPolarHBondContact O-CB 3.21Å; S217-Q221 PolarHBondContact O-N 3.03Å; Q221-T223 VanDerWaalsContact C-N 3.34Å; Q221-R225 VanDerWaalsContact O-CB 3.3Å; Q221-R225 WeakPolarHBondContact O-CB 3.49Å; Q221-R225 PolarHBondContact O-N 2.66Å
222R88Confident80.1Confident176 Ų176122.7 Ų122.766%0.66460%0.598SS**Hα-helixtrans-70-32.3175.6-171.7178.8-177.2-168.91.1112.2K218 T219 Q220 K226K218-R222 WeakPolarHBondContact O-CB 3.26Å; K218-R222 PolarHBondContact O-N 3.3Å; T219-R222 PolarHBondContact O-N 3.32Å; Q220-R222 VanDerWaalsContact C-N 3.26Å; Q220-R222 PolarHBondContact O-N 2.8Å; R222-K226 WeakPolarHBondContact O-CG 3.48Å; R222-K226 PolarHBondContact O-N 3.18Å
223T86.1Confident78.8Confident69 Ų69118.4 Ų118.442%0.42359%0.594SS.*Hα-helixtrans-72.5-49.5177.9-52.80000109.8T219 Q220 Q221 R225 K226 E227T219-T223 PolarHBondContact O-N 3.2Å; T219-T223 PolarHBondContact O-OG1 3.2Å; Q220-T223 WeakPolarHBondContact O-CA 3.37Å; Q220-T223 WeakPolarHBondContact O-CB 3.35Å; Q220-T223 PolarHBondContact O-N 3.26Å; Q221-T223 VanDerWaalsContact C-N 3.34Å; T223-R225 VanDerWaalsContact C-N 3.32Å; T223-R225 PolarHBondContact O-N 2.9Å; T223-K226 WeakPolarHBondContact O-CB 3.49Å; T223-K226 PolarHBondContact O-N 3.22Å; T223-E227 PolarHBondContact O-N 3.12Å; T223-E227 VanDerWaalsContact O-N 3.08Å
224E84.8Confident77.1Confident99 Ų99121.9 Ų121.946%0.46361%0.609SS.*Hα-helixtrans-56.6-43.4174.6-69.6169.7-174.300111.8Q220 K226 E227 S228Q220-E224 WeakPolarHBondContact CG-OE1 3.36Å; Q220-E224 PolarHBondContact NE2-OE1 2.99Å; Q220-E224 PolarHBondContact O-N 3.2Å; E224-K226 VanDerWaalsContact C-N 3.31Å; E224-K226 PolarHBondContact O-N 2.98Å; E224-E227 PolarHBondContact O-N 3.29Å; E224-S228 WeakPolarHBondContact O-CB 3.08Å; E224-S228 PolarHBondContact O-N 3.41Å; E224-S228 PolarHBondContact O-OG 3.45Å
225R85.3Confident75.3Confident192 Ų192124.4 Ų124.473%0.72563%0.627SS**Hα-helixtrans-64.7-31.1176.4-172.5178-178.4-166.31.7113.3Q221 T223 S228 V229Q221-R225 VanDerWaalsContact O-CB 3.3Å; Q221-R225 WeakPolarHBondContact O-CB 3.49Å; Q221-R225 PolarHBondContact O-N 2.66Å; T223-R225 VanDerWaalsContact C-N 3.32Å; T223-R225 PolarHBondContact O-N 2.9Å; R225-S228 PolarHBondContact O-OG 2.64Å; R225-V229 WeakPolarHBondContact O-CG2 3.42Å
226K80.7Confident73.4Confident148 Ų148128.5 Ų128.564%0.64364%0.641SS**Hα-helixtrans-73.3-36.7176.3-80.3-179.7175.9-171.40111.4R222 T223 E224R222-K226 WeakPolarHBondContact O-CG 3.48Å; R222-K226 PolarHBondContact O-N 3.18Å; T223-K226 WeakPolarHBondContact O-CB 3.49Å; T223-K226 PolarHBondContact O-N 3.22Å; E224-K226 VanDerWaalsContact C-N 3.31Å; E224-K226 PolarHBondContact O-N 2.98Å
227E80.6Confident71.5Confident156 Ų156135.1 Ų135.173%0.72966%0.662SS**Hα-helixtrans-71.7-32.2176.7-69.7174.1-176.600112.2T223 E224 V229T223-E227 PolarHBondContact O-N 3.12Å; T223-E227 VanDerWaalsContact O-N 3.08Å; E224-E227 PolarHBondContact O-N 3.29Å; E227-V229 PolarHBondContact O-N 3.04Å
228S77.9Confident69.7Low86 Ų86137.6 Ų137.660%0.60168%0.68SS**THydrogen-bonded Turntrans-79.5-9.8-179.674.50000114.9E224 R225 P230E224-S228 WeakPolarHBondContact O-CB 3.08Å; E224-S228 PolarHBondContact O-N 3.41Å; E224-S228 PolarHBondContact O-OG 3.45Å; R225-S228 PolarHBondContact O-OG 2.64Å; S228-P230 VanDerWaalsContact O-CD 3.25Å; S228-P230 WeakPolarHBondContact O-CD 3.41Å
229V67.8Low68Low95 Ų95140.3 Ų140.358%0.57669%0.692SS**SBendtrans-77.1111.7173175.20000106.9R225 E227 V231R225-V229 WeakPolarHBondContact O-CG2 3.42Å; E227-V229 PolarHBondContact O-N 3.04Å; V229-V231 PolarHBondContact O-N 3.05Å
230P59.7Low66Low101 Ų101145.1 Ų145.166%0.65671%0.705SS**  trans-58.4132.8177.9-15.829.1000108S228 Q232S228-P230 VanDerWaalsContact O-CD 3.25Å; S228-P230 WeakPolarHBondContact O-CD 3.41Å; P230-Q232 PolarHBondContact O-N 3.46Å
231V61.6Low64.5Low130 Ų130145.8 Ų145.879%0.78872%0.717SS**  trans-60.888.8163.3179.70000105.8V229 S233V229-V231 PolarHBondContact O-N 3.05Å; V231-S233 PolarHBondContact O-N 3.43Å
232Q51.3Low63.3Low183 Ų183150.5 Ų150.586%0.85575%0.746SS**  trans-66.877.3156.4-79.9-169.2-9.200105.3P230 K234P230-Q232 PolarHBondContact O-N 3.46Å; Q232-K234 VanDerWaalsContact C-N 3.26Å; Q232-K234 PolarHBondContact O-N 3.44Å
233S53.7Low62.1Low87 Ų87149.2 Ų149.261%0.60875%0.75SS**  trans-62100.8166.9540000105.5V231 H235V231-S233 PolarHBondContact O-N 3.43Å; S233-H235 PolarHBondContact O-N 3.45Å
234K49Very low60.8Low199 Ų199153.4 Ų153.487%0.86577%0.768SS**  trans-10.272.4145.4-66.2175.1173.4178.30113.8Q232 K236Q232-K234 VanDerWaalsContact C-N 3.26Å; Q232-K234 PolarHBondContact O-N 3.44Å; K234-K236 PolarHBondContact O-N 2.74Å
235H45.4Very low59.5Low199 Ų199156.4 Ų156.492%0.92179%0.785SS**  trans-88.966.7151.5-105.4-3.7000106.8S233S233-H235 PolarHBondContact O-N 3.45Å
236K46.3Very low58Low182 Ų182154.4 Ų154.479%0.79179%0.788SS**  trans-107.5107.9162.2-109.2-176.4179.7178.20107.6K234K234-K236 PolarHBondContact O-N 2.74Å
237K47.8Very low56.6Low194 Ų194154.8 Ų154.884%0.84380%0.797SS**  trans59.386.2143.8-63.8-177172.4-171.50116.5
238S50.7Low55Low114 Ų114154.7 Ų154.780%0.79780%0.802SS**  trans-117.484.4137.2-176.20000107.6
239K50.2Low53.3Low200 Ų200159.6 Ų159.687%0.8782%0.816SS**  trans-117.986.4153.1-99.5-171.4173.6-174.80105.2
240K45.1Very low52.2Low189 Ų189164.5 Ų164.582%0.82283%0.834SS**  trans-72.3117.4153-88.5-178.4167.7-174.20106.2
241T56.7Low51.6Low128 Ų128169.8 Ų169.879%0.78585%0.849SS**  trans-149.493.6153.441.10000104.2
242D61.6Low50.7Low233 Ų233173.5 Ų173.5100%1.24686%0.855SS**  trans-69.60151.2-62.4-40.6000108.3

Retrieved 242 of 242 residues in 411.2 ms (Link to these results)

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