A0A3Q0KSV0_SCHMA Loading...

Putative udp-galactose transporter

AlphaFold DB , UniProt , Accession A0A3Q0KSV0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 336 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
1M54.9Low81.1Confident207 Ų207101.5 Ų101.5100%1.0252%0.519SS*.  0-49.70-156176.5-170.600113.3L4 G5M1-L4 PolarHBondContact O-N 3.42Å; M1-G5 PolarHBondContact O-N 3.24Å
2L65.6Low82.1Confident122 Ų12297.8 Ų97.864%0.63949%0.494SS*.Hα-helixtrans-62.7-44.5-178.3-154.2153.2000112.8G5 V6L2-G5 PolarHBondContact O-N 2.72Å; L2-V6 HydrophobicContact CD2-CG2 3.97Å; L2-V6 WeakPolarHBondContact O-CG2 3.42Å; L2-V6 PolarHBondContact O-N 3.23Å
3L74.5Confident83Confident150 Ų15092.2 Ų92.279%0.78547%0.469SS*.Hα-helixtrans-60.7-43.3175.1-72.1168.8000113G5 V6 Y7L3-G5 VanDerWaalsContact C-N 3.32Å; L3-G5 PolarHBondContact O-N 3.32Å; L3-V6 PolarHBondContact O-N 3.37Å; L3-Y7 WeakPolarHBondContact O-CB 3.49Å; L3-Y7 PolarHBondContact O-N 2.97Å
4L77.2Confident83.8Confident130 Ų13087.9 Ų87.968%0.68146%0.459SS*.Hα-helixtrans-62-39.9176-71.2169.3000111.7M1 S8M1-L4 PolarHBondContact O-N 3.42Å; L4-S8 VanDerWaalsContact O-CB 3.25Å; L4-S8 WeakPolarHBondContact O-CB 3.26Å; L4-S8 PolarHBondContact O-N 3.32Å
5G81.7Confident84.5Confident29 Ų2982.7 Ų82.730%0.29944%0.436SS..Hα-helixtrans-64.5-43.6174.700000112.6M1 L2 L3 S8 L9 F254M1-G5 PolarHBondContact O-N 3.24Å; L2-G5 PolarHBondContact O-N 2.72Å; L3-G5 VanDerWaalsContact C-N 3.32Å; L3-G5 PolarHBondContact O-N 3.32Å; G5-S8 PolarHBondContact O-N 3.4Å; G5-L9 WeakPolarHBondContact O-CB 2.94Å; G5-L9 PolarHBondContact O-N 3.29Å; G5-F254 VanDerWaalsContact O-CZ 3.3Å; G5-F254 WeakPolarHBondContact O-CZ 3.25Å
6V84.5Confident85.2Confident49 Ų4977.6 Ų77.630%0.29741%0.408SS..Hα-helixtrans-64.8-45.4176.4173.80000110.9L2 L3 S8 L9 L10L2-V6 HydrophobicContact CD2-CG2 3.97Å; L2-V6 WeakPolarHBondContact O-CG2 3.42Å; L2-V6 PolarHBondContact O-N 3.23Å; L3-V6 PolarHBondContact O-N 3.37Å; V6-S8 PolarHBondContact O-N 3.3Å; V6-L9 WeakPolarHBondContact O-CB 3.33Å; V6-L9 PolarHBondContact O-N 3.35Å; V6-L10 HydrophobicContact CG1-CD1 3.93Å; V6-L10 HydrophobicContact CG1-CG 4.3Å; V6-L10 WeakPolarHBondContact O-CB 3.34Å; V6-L10 WeakPolarHBondContact O-CG 3.48Å; V6-L10 PolarHBondContact O-N 3.31Å
7Y88.2Confident85.6Confident161 Ų16175.2 Ų75.263%0.63139%0.394SS*.Hα-helixtrans-59.7-45.4175.9-179.8-96.3000111.8L3 L9 L10 F11L3-Y7 WeakPolarHBondContact O-CB 3.49Å; L3-Y7 PolarHBondContact O-N 2.97Å; Y7-L9 VanDerWaalsContact C-N 3.32Å; Y7-L9 PolarHBondContact O-N 2.79Å; Y7-L10 PolarHBondContact O-N 2.71Å; Y7-F11 VanDerWaalsContact O-CB 3.28Å; Y7-F11 WeakPolarHBondContact O-CB 3.48Å; Y7-F11 PolarHBondContact O-N 3.07Å
8S89Confident86.1Confident27 Ų2777.4 Ų77.419%0.18941%0.406CS..Hα-helixtrans-61.4-39.1176.8179.40000112.7L4 G5 V6 R12L4-S8 VanDerWaalsContact O-CB 3.25Å; L4-S8 WeakPolarHBondContact O-CB 3.26Å; L4-S8 PolarHBondContact O-N 3.32Å; G5-S8 PolarHBondContact O-N 3.4Å; V6-S8 PolarHBondContact O-N 3.3Å; S8-R12 WeakPolarHBondContact O-CD 3.39Å; S8-R12 WeakPolarHBondContact O-CG 3.48Å; S8-R12 PolarHBondContact O-N 2.83Å; S8-R12 VanDerWaalsContact O-N 3.15Å; S8-R12 PolarHBondContact O-NH1 2.85Å; S8-R12 PolarHBondContact OG-NH1 2.94Å
9L90.9Very high86.5Confident15 Ų1573.9 Ų73.98%0.07939%0.388CS..Hα-helixtrans-65.6-48.8175.2-178.464.3000111.1G5 V6 Y7 R12 S13 L250 F254 T258 V262G5-L9 WeakPolarHBondContact O-CB 2.94Å; G5-L9 PolarHBondContact O-N 3.29Å; V6-L9 WeakPolarHBondContact O-CB 3.33Å; V6-L9 PolarHBondContact O-N 3.35Å; Y7-L9 VanDerWaalsContact C-N 3.32Å; Y7-L9 PolarHBondContact O-N 2.79Å; L9-R12 PolarHBondContact O-N 2.85Å; L9-S13 VanDerWaalsContact O-CB 3.24Å; L9-S13 WeakPolarHBondContact O-CB 3.46Å; L9-S13 PolarHBondContact O-N 3.47Å; L9-S13 PolarHBondContact O-OG 3.49Å; L9-L250 HydrophobicContact CD1-CD2 3.65Å; L9-F254 HydrophobicContact CB-CE1 3.86Å; L9-F254 HydrophobicContact CB-CE2 4.05Å; L9-F254 HydrophobicContact CB-CZ 3.56Å; L9-F254 HydrophobicContact CD1-CD1 4.14Å; L9-F254 HydrophobicContact CD1-CD2 3.99Å; L9-F254 HydrophobicContact CD1-CE1 4.24Å; L9-F254 HydrophobicContact CD1-CE2 4.09Å; L9-F254 HydrophobicContact CD1-CG 4.02Å; L9-F254 HydrophobicContact CD1-CZ 4.22Å; L9-F254 HydrophobicContact CG-CE1 4.49Å; L9-F254 HydrophobicContact CG-CZ 4.47Å; L9-T258 HydrophobicContact CD1-CG2 3.56Å; L9-V262 HydrophobicContact CD1-CG2 4.42Å
10L91.7Very high86.8Confident113 Ų11371.5 Ų71.559%0.59237%0.374SS*.Hα-helixtrans-64.1-43.9-179.9-72.1175.9000111.6V6 Y7 R12 S13 G14V6-L10 HydrophobicContact CG1-CD1 3.93Å; V6-L10 HydrophobicContact CG1-CG 4.3Å; V6-L10 WeakPolarHBondContact O-CB 3.34Å; V6-L10 WeakPolarHBondContact O-CG 3.48Å; V6-L10 PolarHBondContact O-N 3.31Å; Y7-L10 PolarHBondContact O-N 2.71Å; L10-R12 PolarHBondContact O-N 3.35Å; L10-S13 PolarHBondContact O-N 3.48Å; L10-G14 PolarHBondContact O-N 2.96Å
11F93.5Very high87Confident113 Ų11370.8 Ų70.850%0.49637%0.37SS..Hα-helixtrans-58.3-48.7176.6175.9-102.8000111.7Y7 G14 G15 F246Y7-F11 VanDerWaalsContact O-CB 3.28Å; Y7-F11 WeakPolarHBondContact O-CB 3.48Å; Y7-F11 PolarHBondContact O-N 3.07Å; F11-G14 PolarHBondContact O-N 3.34Å; F11-G15 PolarHBondContact O-N 3.11Å; F11-F246 HydrophobicContact CD1-CE1 4.45Å; F11-F246 HydrophobicContact CE1-CD1 4.45Å; F11-F246 AromaticContact CE1-CE1 3.77Å; F11-F246 HydrophobicContact CE1-CE1 3.77Å; F11-F246 HydrophobicContact CZ-CE1 4.05Å
12R93.5Very high88.8Confident58 Ų5863.5 Ų63.522%0.21934%0.337CS..Hα-helixtrans-67.8-37.8177.2-73.7162.9177.454.56.7112.4S8 L9 L10 G14 G15 V16 F246 L250S8-R12 WeakPolarHBondContact O-CD 3.39Å; S8-R12 WeakPolarHBondContact O-CG 3.48Å; S8-R12 PolarHBondContact O-N 2.83Å; S8-R12 VanDerWaalsContact O-N 3.15Å; S8-R12 PolarHBondContact O-NH1 2.85Å; S8-R12 PolarHBondContact OG-NH1 2.94Å; L9-R12 PolarHBondContact O-N 2.85Å; L10-R12 PolarHBondContact O-N 3.35Å; R12-G14 VanDerWaalsContact C-N 3.35Å; R12-G15 PolarHBondContact O-N 3.1Å; R12-V16 WeakPolarHBondContact O-CG2 3.37Å; R12-V16 PolarHBondContact O-N 3.19Å; R12-F246 HydrophobicContact CG-CD1 4.38Å; R12-L250 HydrophobicContact CB-CD1 4.3Å; R12-L250 HydrophobicContact CB-CD2 3.59Å; R12-L250 HydrophobicContact CB-CG 3.7Å; R12-L250 HydrophobicContact CG-CD2 4.49Å
13S93.5Very high90.1Very high25 Ų2558.4 Ų58.418%0.17531%0.309CS..Hα-helixtrans-64.9-40.5176.7-57.70000111.5L9 L10 V16 F17 V262L9-S13 VanDerWaalsContact O-CB 3.24Å; L9-S13 WeakPolarHBondContact O-CB 3.46Å; L9-S13 PolarHBondContact O-N 3.47Å; L9-S13 PolarHBondContact O-OG 3.49Å; L10-S13 PolarHBondContact O-N 3.48Å; S13-V16 PolarHBondContact O-N 2.91Å; S13-F17 VanDerWaalsContact O-CB 3.31Å; S13-F17 WeakPolarHBondContact O-CB 3.47Å; S13-F17 PolarHBondContact O-N 3.2Å; S13-V262 WeakPolarHBondContact OG-CG2 3.36Å
14G94.4Very high90.7Very high32 Ų3252.1 Ų52.133%0.3328%0.281SS..Hα-helixtrans-64.2-43172.800000112.2L10 F11 R12 F17 L18L10-G14 PolarHBondContact O-N 2.96Å; F11-G14 PolarHBondContact O-N 3.34Å; R12-G14 VanDerWaalsContact C-N 3.35Å; G14-F17 WeakPolarHBondContact O-CB 3.39Å; G14-F17 PolarHBondContact O-N 2.59Å; G14-F17 VanDerWaalsContact O-N 3.16Å; G14-L18 WeakPolarHBondContact O-CG 3.39Å; G14-L18 PolarHBondContact O-N 2.84Å
15G95.2Very high91.3Very high10 Ų1050.5 Ų50.510%0.10327%0.272CS..Hα-helixtrans-59.2-46.9173.500000112.7F11 R12 F17 S19F11-G15 PolarHBondContact O-N 3.11Å; R12-G15 PolarHBondContact O-N 3.1Å; G15-F17 VanDerWaalsContact C-N 3.34Å; G15-F17 PolarHBondContact O-N 3.2Å; G15-S19 VanDerWaalsContact O-CB 3.3Å; G15-S19 WeakPolarHBondContact O-CB 3.38Å; G15-S19 PolarHBondContact O-N 3.4Å; G15-S19 PolarHBondContact O-OG 3.25Å
16V94.5Very high91.7Very high0 Ų051.2 Ų51.20%027%0.266CS..Hα-helixtrans-61.2-42.3172.3169.60000111R12 S13 S19 Y20 F246 L247 L250 V262 T263R12-V16 WeakPolarHBondContact O-CG2 3.37Å; R12-V16 PolarHBondContact O-N 3.19Å; S13-V16 PolarHBondContact O-N 2.91Å; V16-S19 PolarHBondContact O-OG 3.07Å; V16-Y20 HydrophobicContact CB-CD2 4.5Å; V16-Y20 HydrophobicContact CG1-CD2 3.86Å; V16-Y20 HydrophobicContact CG1-CE2 4.39Å; V16-Y20 VanDerWaalsContact O-CB 3.27Å; V16-Y20 WeakPolarHBondContact O-CB 3.3Å; V16-Y20 WeakPolarHBondContact O-CD2 3.46Å; V16-Y20 PolarHBondContact O-N 2.87Å; V16-F246 HydrophobicContact CG2-CB 3.68Å; V16-L247 HydrophobicContact CG2-CB 4.39Å; V16-L250 HydrophobicContact CG2-CD1 3.79Å; V16-V262 HydrophobicContact CB-CG1 4.47Å; V16-V262 HydrophobicContact CG1-CG1 4.37Å; V16-T263 HydrophobicContact CG1-CG2 4.08Å
17F93Very high92Very high37 Ų3750.4 Ų50.416%0.16226%0.259CS..Hα-helixtrans-59.8-54-179.8-178.2-83.1000111.7S13 G14 G15 L21 R266 F269 F273S13-F17 VanDerWaalsContact O-CB 3.31Å; S13-F17 WeakPolarHBondContact O-CB 3.47Å; S13-F17 PolarHBondContact O-N 3.2Å; G14-F17 WeakPolarHBondContact O-CB 3.39Å; G14-F17 PolarHBondContact O-N 2.59Å; G14-F17 VanDerWaalsContact O-N 3.16Å; G15-F17 VanDerWaalsContact C-N 3.34Å; G15-F17 PolarHBondContact O-N 3.2Å; F17-L21 HydrophobicContact CE1-CD1 3.91Å; F17-L21 HydrophobicContact CZ-CD1 4.27Å; F17-L21 VanDerWaalsContact O-CB 3.27Å; F17-L21 WeakPolarHBondContact O-CB 3.41Å; F17-L21 PolarHBondContact O-N 3.22Å; F17-R266 HydrophobicContact CB-CG 4.23Å; F17-R266 HydrophobicContact CD2-CB 4.19Å; F17-R266 HydrophobicContact CD2-CG 3.5Å; F17-R266 VanDerWaalsContact CD2-CG 3.5Å; F17-R266 HydrophobicContact CE2-CG 4.12Å; F17-R266 HydrophobicContact CG-CG 4.15Å; F17-F269 HydrophobicContact CD2-CB 4.35Å; F17-F269 HydrophobicContact CE2-CB 3.66Å; F17-F273 HydrophobicContact CE2-CD2 4.38Å; F17-F273 HydrophobicContact CE2-CE2 4.32Å; F17-F273 AromaticContact CZ-CD2 3.8Å; F17-F273 HydrophobicContact CZ-CD2 3.8Å; F17-F273 AromaticContact CZ-CE2 3.92Å; F17-F273 HydrophobicContact CZ-CE2 3.92Å
18L94Very high91.8Very high116 Ų11646.5 Ų46.561%0.60725%0.247SC*.Hα-helixtrans-66.7-49-176.5-66.8171.4000111.9G14 L21 V22G14-L18 WeakPolarHBondContact O-CG 3.39Å; G14-L18 PolarHBondContact O-N 2.84Å; L18-L21 PolarHBondContact O-N 2.97Å; L18-V22 PolarHBondContact O-N 2.91Å
19S94.5Very high91.8Very high10 Ų1048.8 Ų48.87%0.0725%0.253CS..Hα-helixtrans-61.8-46.4179.955.20000112.2G15 V16 L21 V22 Y23 G243G15-S19 VanDerWaalsContact O-CB 3.3Å; G15-S19 WeakPolarHBondContact O-CB 3.38Å; G15-S19 PolarHBondContact O-N 3.4Å; G15-S19 PolarHBondContact O-OG 3.25Å; V16-S19 PolarHBondContact O-OG 3.07Å; S19-L21 VanDerWaalsContact C-N 3.31Å; S19-L21 PolarHBondContact O-N 3.01Å; S19-V22 PolarHBondContact O-N 3.4Å; S19-Y23 WeakPolarHBondContact O-CB 3.43Å; S19-Y23 PolarHBondContact O-N 3.44Å; S19-G243 VanDerWaalsContact CB-CA 3.49Å; S19-G243 WeakPolarHBondContact OG-CA 3.36Å
20Y91.6Very high91.8Very high26 Ų2648.1 Ų48.110%0.10225%0.25CC..Hα-helixtrans-79.2-12.4-178.3-77.8-87.1000114.2V16 Y23 G24 L247 R266V16-Y20 HydrophobicContact CB-CD2 4.5Å; V16-Y20 HydrophobicContact CG1-CD2 3.86Å; V16-Y20 HydrophobicContact CG1-CE2 4.39Å; V16-Y20 VanDerWaalsContact O-CB 3.27Å; V16-Y20 WeakPolarHBondContact O-CB 3.3Å; V16-Y20 WeakPolarHBondContact O-CD2 3.46Å; V16-Y20 PolarHBondContact O-N 2.87Å; Y20-Y23 AromaticContact CD1-CD1 3.71Å; Y20-Y23 HydrophobicContact CD1-CD1 3.71Å; Y20-Y23 HydrophobicContact CD1-CE1 4.25Å; Y20-Y23 AromaticContact CD1-CG 3.98Å; Y20-Y23 HydrophobicContact CD1-CG 3.98Å; Y20-Y23 HydrophobicContact CE1-CD1 4.19Å; Y20-Y23 HydrophobicContact CE1-CE1 4.37Å; Y20-Y23 HydrophobicContact CE1-CG 4.37Å; Y20-G24 PolarHBondContact O-N 3.32Å; Y20-G24 VanDerWaalsContact O-N 3.09Å; Y20-L247 HydrophobicContact CE2-CD1 4.07Å; Y20-L247 WeakPolarHBondContact OH-CD1 3.09Å; Y20-R266 PolarHBondContact O-NH1 2.77Å
21L91Very high91.5Very high56 Ų5643.7 Ų43.729%0.29323%0.227SC..Hα-helixtrans-68.6-53.9166.3-171.9163.9000109.1F17 L18 S19 Y23 G24 I25F17-L21 HydrophobicContact CE1-CD1 3.91Å; F17-L21 HydrophobicContact CZ-CD1 4.27Å; F17-L21 VanDerWaalsContact O-CB 3.27Å; F17-L21 WeakPolarHBondContact O-CB 3.41Å; F17-L21 PolarHBondContact O-N 3.22Å; L18-L21 PolarHBondContact O-N 2.97Å; S19-L21 VanDerWaalsContact C-N 3.31Å; S19-L21 PolarHBondContact O-N 3.01Å; L21-Y23 PolarHBondContact O-N 3.22Å; L21-G24 PolarHBondContact O-N 3.44Å; L21-G24 VanDerWaalsContact O-N 3.17Å; L21-I25 HydrophobicContact CD2-CD1 3.52Å; L21-I25 HydrophobicContact CD2-CG1 4.29Å; L21-I25 WeakPolarHBondContact O-CG1 3.23Å; L21-I25 PolarHBondContact O-N 3.48Å
22V92.9Very high91.1Very high54 Ų5443.6 Ų43.633%0.32723%0.227SC..Hα-helixtrans-62.6-44.3178-173.10000110.9L18 S19 G24 I25 Y26 I235 T239L18-V22 PolarHBondContact O-N 2.91Å; S19-V22 PolarHBondContact O-N 3.4Å; V22-G24 VanDerWaalsContact C-N 3.29Å; V22-G24 PolarHBondContact O-N 2.98Å; V22-I25 PolarHBondContact O-N 3.24Å; V22-Y26 HydrophobicContact CG1-CD2 3.88Å; V22-Y26 HydrophobicContact CG1-CE2 3.98Å; V22-Y26 WeakPolarHBondContact O-CD2 3.46Å; V22-Y26 PolarHBondContact O-N 2.78Å; V22-I235 HydrophobicContact CG1-CG2 4.4Å; V22-T239 HydrophobicContact CB-CG2 3.97Å; V22-T239 HydrophobicContact CG1-CG2 3.63Å
23Y92.2Very high90.8Very high15 Ų1543.3 Ų43.36%0.05923%0.231CC..Hα-helixtrans-51.9-47.3172.8175.7-94000112.1S19 Y20 L21 Y26 Q27 Q52 F236S19-Y23 WeakPolarHBondContact O-CB 3.43Å; S19-Y23 PolarHBondContact O-N 3.44Å; Y20-Y23 AromaticContact CD1-CD1 3.71Å; Y20-Y23 HydrophobicContact CD1-CD1 3.71Å; Y20-Y23 HydrophobicContact CD1-CE1 4.25Å; Y20-Y23 AromaticContact CD1-CG 3.98Å; Y20-Y23 HydrophobicContact CD1-CG 3.98Å; Y20-Y23 HydrophobicContact CE1-CD1 4.19Å; Y20-Y23 HydrophobicContact CE1-CE1 4.37Å; Y20-Y23 HydrophobicContact CE1-CG 4.37Å; L21-Y23 PolarHBondContact O-N 3.22Å; Y23-Y26 PolarHBondContact O-N 3.17Å; Y23-Q27 VanDerWaalsContact CE1-OE1 3.26Å; Y23-Q27 VanDerWaalsContact O-CB 3.31Å; Y23-Q27 WeakPolarHBondContact O-CB 3.48Å; Y23-Q27 PolarHBondContact O-N 3.4Å; Y23-Q52 PolarHBondContact OH-NE2 3.46Å; Y23-Q52 PolarHBondContact OH-OE1 2.92Å; Y23-F236 HydrophobicContact CD1-CE2 4.45Å; Y23-F236 AromaticContact CD2-CD2 3.7Å; Y23-F236 HydrophobicContact CD2-CD2 3.7Å; Y23-F236 AromaticContact CD2-CE2 3.6Å; Y23-F236 HydrophobicContact CD2-CE2 3.6Å; Y23-F236 HydrophobicContact CD2-CG 4.48Å; Y23-F236 HydrophobicContact CD2-CZ 4.3Å; Y23-F236 AromaticContact CE1-CE2 3.98Å; Y23-F236 HydrophobicContact CE1-CE2 3.98Å; Y23-F236 AromaticContact CE2-CD2 3.58Å; Y23-F236 HydrophobicContact CE2-CD2 3.58Å; Y23-F236 HydrophobicContact CE2-CE1 4.14Å; Y23-F236 AromaticContact CE2-CE2 3.01Å; Y23-F236 HydrophobicContact CE2-CE2 3.01Å; Y23-F236 HydrophobicContact CE2-CG 4.34Å; Y23-F236 AromaticContact CE2-CZ 3.35Å; Y23-F236 HydrophobicContact CE2-CZ 3.35Å; Y23-F236 HydrophobicContact CG-CD2 4.4Å; Y23-F236 HydrophobicContact CG-CE2 4.29Å; Y23-F236 AromaticContact CZ-CE2 3.24Å; Y23-F236 AromaticContact CZ-CZ 3.54Å; Y23-F236 VanDerWaalsContact OH-CZ 3.32Å; Y23-F236 WeakPolarHBondContact OH-CZ 3.43Å
24G87.3Confident90.6Very high19 Ų1947.9 Ų47.920%0.19625%0.248CC..Hα-helixtrans-64.1-41-179.300000112.8Y20 L21 V22 Q27 E28Y20-G24 PolarHBondContact O-N 3.32Å; Y20-G24 VanDerWaalsContact O-N 3.09Å; L21-G24 PolarHBondContact O-N 3.44Å; L21-G24 VanDerWaalsContact O-N 3.17Å; V22-G24 VanDerWaalsContact C-N 3.29Å; V22-G24 PolarHBondContact O-N 2.98Å; G24-Q27 PolarHBondContact O-N 3.28Å; G24-E28 WeakPolarHBondContact O-CB 3.31Å; G24-E28 PolarHBondContact O-N 3.29Å
25I89.4Confident90.3Very high96 Ų9647.1 Ų47.149%0.49224%0.235SC..Hα-helixtrans-60.3-47.9175.6-67.8173000110.5L21 V22 E28 K29L21-I25 HydrophobicContact CD2-CD1 3.52Å; L21-I25 HydrophobicContact CD2-CG1 4.29Å; L21-I25 WeakPolarHBondContact O-CG1 3.23Å; L21-I25 PolarHBondContact O-N 3.48Å; V22-I25 PolarHBondContact O-N 3.24Å; I25-E28 PolarHBondContact O-N 3.34Å; I25-K29 WeakPolarHBondContact O-CB 3.06Å; I25-K29 PolarHBondContact O-N 3.23Å
26Y92Very high89.8Confident43 Ų4348.3 Ų48.317%0.16925%0.248CC..Hα-helixtrans-71.8-33.3-179.9-83.7-93.1000112.7V22 Y23 K29 I30 D232 I235V22-Y26 HydrophobicContact CG1-CD2 3.88Å; V22-Y26 HydrophobicContact CG1-CE2 3.98Å; V22-Y26 WeakPolarHBondContact O-CD2 3.46Å; V22-Y26 PolarHBondContact O-N 2.78Å; Y23-Y26 PolarHBondContact O-N 3.17Å; Y26-K29 HydrophobicContact CD1-CD 4.5Å; Y26-K29 PolarHBondContact O-N 3.4Å; Y26-I30 WeakPolarHBondContact O-CB 3.44Å; Y26-I30 WeakPolarHBondContact O-CD1 3.4Å; Y26-I30 WeakPolarHBondContact O-CG1 3.19Å; Y26-I30 PolarHBondContact O-N 3.25Å; Y26-D232 HydrophobicContact CD1-CB 4Å; Y26-D232 WeakPolarHBondContact CD1-O 3.09Å; Y26-D232 HydrophobicContact CE1-CB 4.32Å; Y26-D232 WeakPolarHBondContact CE1-OD1 3.49Å; Y26-I235 HydrophobicContact CD1-CB 4Å; Y26-I235 HydrophobicContact CD1-CG2 4.09Å; Y26-I235 HydrophobicContact CD2-CB 4.48Å; Y26-I235 HydrophobicContact CD2-CG2 3.67Å; Y26-I235 HydrophobicContact CE1-CB 3.81Å; Y26-I235 HydrophobicContact CE1-CD1 3.73Å; Y26-I235 HydrophobicContact CE1-CG1 4.31Å; Y26-I235 HydrophobicContact CE1-CG2 3.92Å; Y26-I235 HydrophobicContact CE2-CB 4.32Å; Y26-I235 HydrophobicContact CE2-CD1 4.43Å; Y26-I235 HydrophobicContact CE2-CG2 3.48Å; Y26-I235 VanDerWaalsContact CE2-CG2 3.48Å; Y26-I235 HydrophobicContact CG-CB 4.33Å; Y26-I235 HydrophobicContact CG-CG2 3.97Å; Y26-I235 VanDerWaalsContact OH-CD1 3.22Å; Y26-I235 WeakPolarHBondContact OH-CD1 3.01Å
27Q90.1Very high89.2Confident32 Ų3255 Ų5515%0.1529%0.291CS..Hα-helixtrans-59.8-47.8172-171.5179.6-3.900110.9Y23 G24 I30 T31 N94 F236Y23-Q27 VanDerWaalsContact CE1-OE1 3.26Å; Y23-Q27 VanDerWaalsContact O-CB 3.31Å; Y23-Q27 WeakPolarHBondContact O-CB 3.48Å; Y23-Q27 PolarHBondContact O-N 3.4Å; G24-Q27 PolarHBondContact O-N 3.28Å; Q27-I30 PolarHBondContact O-N 3.25Å; Q27-T31 WeakPolarHBondContact O-CB 3.22Å; Q27-T31 WeakPolarHBondContact O-CG2 3.46Å; Q27-T31 PolarHBondContact O-N 3.39Å; Q27-T31 PolarHBondContact O-OG1 3Å; Q27-N94 PolarHBondContact NE2-OD1 3Å; Q27-F236 HydrophobicContact CB-CD2 4.17Å; Q27-F236 HydrophobicContact CB-CE2 3.81Å; Q27-F236 HydrophobicContact CG-CE2 4.06Å
28E84.3Confident88.6Confident80 Ų8056 Ų5637%0.37431%0.312SS..Hα-helixtrans-65.7-42.6177.4-176.9164.8-167.900111.6G24 I25 I30 T31 K32G24-E28 WeakPolarHBondContact O-CB 3.31Å; G24-E28 PolarHBondContact O-N 3.29Å; I25-E28 PolarHBondContact O-N 3.34Å; E28-I30 PolarHBondContact O-N 3.43Å; E28-T31 PolarHBondContact O-N 2.84Å; E28-T31 PolarHBondContact O-OG1 3.43Å; E28-K32 HydrophobicContact CG-CD 3.72Å; E28-K32 HydrophobicContact CG-CG 4.16Å; E28-K32 VanDerWaalsContact O-CB 3.31Å; E28-K32 WeakPolarHBondContact O-CB 3.14Å; E28-K32 PolarHBondContact O-N 2.84Å; E28-K32 WeakPolarHBondContact OE1-CE 3.41Å; E28-K32 IonicContact OE1-NZ 3.07Å; E28-K32 PolarHBondContact OE1-NZ 3.5Å
29K88.7Confident88.2Confident75 Ų7555.7 Ų55.733%0.32631%0.309SS..Hα-helixtrans-57.5-49.9175.3-171.7-177.6179.3-169.50111.1I25 Y26 T33 D232I25-K29 WeakPolarHBondContact O-CB 3.06Å; I25-K29 PolarHBondContact O-N 3.23Å; Y26-K29 HydrophobicContact CD1-CD 4.5Å; Y26-K29 PolarHBondContact O-N 3.4Å; K29-T33 WeakPolarHBondContact O-CB 3.5Å; K29-T33 PolarHBondContact O-N 3.09Å; K29-T33 PolarHBondContact O-OG1 3.35Å; K29-D232 WeakPolarHBondContact CE-OD1 3.39Å; K29-D232 WeakPolarHBondContact CE-OD2 3.37Å; K29-D232 IonicContact NZ-OD1 3.4Å; K29-D232 PolarHBondContact NZ-OD1 3.27Å; K29-D232 IonicContact NZ-OD2 3.9Å
30I90.5Very high87.8Confident0 Ų058.5 Ų58.50%032%0.321CS..Hα-helixtrans-62.4-46.7-179.9-69163.7000111.1Y26 Q27 E28 F42 L48 I229 D232 M233 F236Y26-I30 WeakPolarHBondContact O-CB 3.44Å; Y26-I30 WeakPolarHBondContact O-CD1 3.4Å; Y26-I30 WeakPolarHBondContact O-CG1 3.19Å; Y26-I30 PolarHBondContact O-N 3.25Å; Q27-I30 PolarHBondContact O-N 3.25Å; E28-I30 PolarHBondContact O-N 3.43Å; I30-F42 HydrophobicContact CG2-CB 4.32Å; I30-F42 HydrophobicContact CG2-CD1 3.65Å; I30-F42 HydrophobicContact CG2-CD2 4.35Å; I30-F42 HydrophobicContact CG2-CE1 3.98Å; I30-F42 HydrophobicContact CG2-CG 3.83Å; I30-F42 HydrophobicContact CG2-CZ 4.42Å; I30-F42 VanDerWaalsContact O-CB 3.22Å; I30-F42 WeakPolarHBondContact O-CB 3.31Å; I30-L48 HydrophobicContact CD1-CD1 4.19Å; I30-L48 HydrophobicContact CG2-CD2 4.15Å; I30-I229 HydrophobicContact CG2-CD1 4.24Å; I30-D232 HydrophobicContact CD1-CB 4.23Å; I30-D232 HydrophobicContact CG1-CB 3.83Å; I30-M233 HydrophobicContact CD1-CG 4.07Å; I30-F236 HydrophobicContact CD1-CB 3.85Å; I30-F236 HydrophobicContact CD1-CG 4.11Å
31T86.5Confident87.7Confident20 Ų2062 Ų6212%0.12334%0.341CS..Hα-helixtrans-81-26.1-171.553.30000114.5Q27 E28 Y45Q27-T31 WeakPolarHBondContact O-CB 3.22Å; Q27-T31 WeakPolarHBondContact O-CG2 3.46Å; Q27-T31 PolarHBondContact O-N 3.39Å; Q27-T31 PolarHBondContact O-OG1 3Å; E28-T31 PolarHBondContact O-N 2.84Å; E28-T31 PolarHBondContact O-OG1 3.43Å; T31-Y45 HydrophobicContact CG2-CE1 3.75Å
32K83.6Confident87.5Confident111 Ų11159.4 Ų59.448%0.48333%0.327SS..Hα-helixtrans-109-14.3-176.4-60.6-168.1-173169.20115E28 K34E28-K32 HydrophobicContact CG-CD 3.72Å; E28-K32 HydrophobicContact CG-CG 4.16Å; E28-K32 VanDerWaalsContact O-CB 3.31Å; E28-K32 WeakPolarHBondContact O-CB 3.14Å; E28-K32 PolarHBondContact O-N 2.84Å; E28-K32 WeakPolarHBondContact OE1-CE 3.41Å; E28-K32 IonicContact OE1-NZ 3.07Å; E28-K32 PolarHBondContact OE1-NZ 3.5Å; K32-K34 PolarHBondContact O-N 2.7Å
33T87Confident87.3Confident52 Ų5260.8 Ų60.832%0.31933%0.333SS..PPolyproline II helixtrans-67133.2175.8-62.10000109.5K29 Y35K29-T33 WeakPolarHBondContact O-CB 3.5Å; K29-T33 PolarHBondContact O-N 3.09Å; K29-T33 PolarHBondContact O-OG1 3.35Å; T33-Y35 HydrophobicContact CG2-CD1 4.3Å; T33-Y35 HydrophobicContact CG2-CD2 4.31Å; T33-Y35 HydrophobicContact CG2-CE1 4.05Å; T33-Y35 HydrophobicContact CG2-CE2 4.08Å; T33-Y35 HydrophobicContact CG2-CG 4.43Å; T33-Y35 WeakPolarHBondContact O-CD2 3.5Å; T33-Y35 VanDerWaalsContact O-CE2 3.31Å; T33-Y35 WeakPolarHBondContact O-CE2 3.26Å
34K89.3Confident87.3Confident122 Ų12261.6 Ų61.653%0.5334%0.337SS..EExtended strand (participates in β ladder)trans-89.3116.6170.9-60.1-177.6179.8-168.90107.9K32 M39 L41K32-K34 PolarHBondContact O-N 2.7Å; K34-M39 HydrophobicContact CB-CB 4.18Å; K34-M39 HydrophobicContact CB-CE 4.09Å; K34-M39 HydrophobicContact CB-SD 3.57Å; K34-M39 VanDerWaalsContact CB-SD 3.57Å; K34-M39 HydrophobicContact CD-CB 4.2Å; K34-M39 HydrophobicContact CD-CE 3.3Å; K34-M39 HydrophobicContact CD-CG 4.48Å; K34-M39 HydrophobicContact CD-SD 3.86Å; K34-M39 HydrophobicContact CG-CE 4.33Å; K34-M39 HydrophobicContact CG-SD 4.37Å; K34-L41 HydrophobicContact CG-CD2 3.83Å
35Y88.3Confident87.5Confident15 Ų1561.7 Ų61.76%0.05933%0.331CS..EExtended strand (participates in β ladder)trans-94.3134.4-172.7-67.4-90.1000111.4T33 M39 E40 F42 F222 H226 I229T33-Y35 HydrophobicContact CG2-CD1 4.3Å; T33-Y35 HydrophobicContact CG2-CD2 4.31Å; T33-Y35 HydrophobicContact CG2-CE1 4.05Å; T33-Y35 HydrophobicContact CG2-CE2 4.08Å; T33-Y35 HydrophobicContact CG2-CG 4.43Å; T33-Y35 WeakPolarHBondContact O-CD2 3.5Å; T33-Y35 VanDerWaalsContact O-CE2 3.31Å; T33-Y35 WeakPolarHBondContact O-CE2 3.26Å; Y35-M39 PolarHBondContact O-N 2.91Å; Y35-E40 PolarHBondContact N-O 3.45Å; Y35-E40 PolarHBondContact O-N 3.06Å; Y35-F42 HydrophobicContact CE2-CB 4.32Å; Y35-F222 HydrophobicContact CD2-CE1 4.37Å; Y35-F222 AromaticContact CD2-CZ 3.66Å; Y35-F222 HydrophobicContact CD2-CZ 3.66Å; Y35-F222 HydrophobicContact CE2-CZ 4.3Å; Y35-F222 HydrophobicContact CG-CE1 4.45Å; Y35-F222 AromaticContact CG-CZ 3.85Å; Y35-F222 HydrophobicContact CG-CZ 3.85Å; Y35-H226 HydrophobicContact CD1-CB 4.21Å; Y35-I229 HydrophobicContact CE1-CB 4.29Å; Y35-I229 HydrophobicContact CE1-CG1 4.47Å; Y35-I229 HydrophobicContact CE2-CD1 4.28Å
36G85.5Confident87.7Confident36 Ų3658.9 Ų58.937%0.37132%0.316SS..THydrogen-bonded Turntrans65.6-176.517600000115.4G38 M39G36-G38 PolarHBondContact O-N 3.33Å; G36-M39 PolarHBondContact O-N 3.31Å
37P80.4Confident87.8Confident140 Ų14057.1 Ų57.191%0.90931%0.309SS*.THydrogen-bonded Turntrans-66.7-26178.127.3-34.3000112.9M39P37-M39 PolarHBondContact O-N 3.44Å
38G80.7Confident88Confident58 Ų5855.7 Ų55.760%0.59830%0.303SS*.THydrogen-bonded Turntrans-73.9-5.4176.800000114.3G36 E40G36-G38 PolarHBondContact O-N 3.33Å; G38-E40 PolarHBondContact O-N 2.93Å
39M85.5Confident88.5Confident109 Ų10951.9 Ų51.954%0.53729%0.285SS..THydrogen-bonded Turntrans54.636.1-178.5-64-67.1-103.500112.6K34 Y35 G36 P37 L41K34-M39 HydrophobicContact CB-CB 4.18Å; K34-M39 HydrophobicContact CB-CE 4.09Å; K34-M39 HydrophobicContact CB-SD 3.57Å; K34-M39 VanDerWaalsContact CB-SD 3.57Å; K34-M39 HydrophobicContact CD-CB 4.2Å; K34-M39 HydrophobicContact CD-CE 3.3Å; K34-M39 HydrophobicContact CD-CG 4.48Å; K34-M39 HydrophobicContact CD-SD 3.86Å; K34-M39 HydrophobicContact CG-CE 4.33Å; K34-M39 HydrophobicContact CG-SD 4.37Å; Y35-M39 PolarHBondContact O-N 2.91Å; G36-M39 PolarHBondContact O-N 3.31Å; P37-M39 PolarHBondContact O-N 3.44Å; M39-L41 PolarHBondContact O-N 2.71Å
40E87.7Confident88.9Confident69 Ų6950.1 Ų50.132%0.32228%0.279SS..EExtended strand (participates in β ladder)trans-66.5131.1-177.6-64.6-177.4-162.900109.6Y35 G38 F222 R225Y35-E40 PolarHBondContact N-O 3.45Å; Y35-E40 PolarHBondContact O-N 3.06Å; G38-E40 PolarHBondContact O-N 2.93Å; E40-F222 HydrophobicContact CB-CE2 3.9Å; E40-R225 IonicContact OE1-NE 3.62Å; E40-R225 IonicContact OE1-NH2 2.72Å; E40-R225 IonicContact OE2-CZ 2.75Å; E40-R225 IonicContact OE2-NE 3.64Å; E40-R225 PolarHBondContact OE2-NE 3.03Å; E40-R225 IonicContact OE2-NH2 2.68Å; E40-R225 PolarHBondContact OE2-NH2 3.02Å
41L88.2Confident89.1Confident99 Ų9952.4 Ų52.452%0.51829%0.289SS..EExtended strand (participates in β ladder)trans-92.9143.5173.5-71.4173.2000109.8K34 M39 D43K34-L41 HydrophobicContact CG-CD2 3.83Å; M39-L41 PolarHBondContact O-N 2.71Å; L41-D43 PolarHBondContact O-N 3.06Å
42F88.3Confident89.6Confident2 Ų251.4 Ų51.41%0.00928%0.283CS..  trans-70.1113.2173.9-175.9-93.9000110.5I30 Y35 F44 L48 F219 F222 I229I30-F42 HydrophobicContact CG2-CB 4.32Å; I30-F42 HydrophobicContact CG2-CD1 3.65Å; I30-F42 HydrophobicContact CG2-CD2 4.35Å; I30-F42 HydrophobicContact CG2-CE1 3.98Å; I30-F42 HydrophobicContact CG2-CG 3.83Å; I30-F42 HydrophobicContact CG2-CZ 4.42Å; I30-F42 VanDerWaalsContact O-CB 3.22Å; I30-F42 WeakPolarHBondContact O-CB 3.31Å; Y35-F42 HydrophobicContact CE2-CB 4.32Å; F42-F44 AromaticContact CD2-CD2 4Å; F42-F44 HydrophobicContact CD2-CD2 4Å; F42-F44 HydrophobicContact CE1-CB 4.12Å; F42-F44 VanDerWaalsContact CE1-O 3.3Å; F42-F44 WeakPolarHBondContact CE1-O 3.3Å; F42-F44 HydrophobicContact CE2-CB 3.87Å; F42-F44 AromaticContact CE2-CD2 3.93Å; F42-F44 HydrophobicContact CE2-CD2 3.93Å; F42-F44 HydrophobicContact CE2-CG 4.41Å; F42-F44 HydrophobicContact CZ-CB 3.64Å; F42-F44 VanDerWaalsContact CZ-O 3.26Å; F42-F44 WeakPolarHBondContact CZ-O 3.31Å; F42-L48 HydrophobicContact CE1-CB 3.81Å; F42-L48 HydrophobicContact CE1-CD2 3.93Å; F42-L48 HydrophobicContact CE1-CG 4.36Å; F42-L48 HydrophobicContact CZ-CB 3.9Å; F42-F219 HydrophobicContact CE2-CD2 4.14Å; F42-F219 AromaticContact CE2-CE2 3.91Å; F42-F219 HydrophobicContact CE2-CE2 3.91Å; F42-F219 HydrophobicContact CZ-CD2 4.43Å; F42-F219 HydrophobicContact CZ-CE2 4.08Å; F42-F222 HydrophobicContact CD2-CD1 4.3Å; F42-F222 AromaticContact CD2-CE1 3.96Å; F42-F222 HydrophobicContact CD2-CE1 3.96Å; F42-F222 HydrophobicContact CD2-CZ 4.43Å; F42-I229 HydrophobicContact CB-CD1 4.38Å; F42-I229 HydrophobicContact CD2-CD1 3.15Å; F42-I229 HydrophobicContact CE2-CD1 3.53Å; F42-I229 HydrophobicContact CG-CD1 3.96Å
43D88.3Confident90.2Very high84 Ų8446.1 Ų46.145%0.44926%0.26SS..  trans-115.211.2-179.9-150.337.7000114.5L41 Y45 K98L41-D43 PolarHBondContact O-N 3.06Å; D43-Y45 WeakPolarHBondContact O-CD2 3.3Å; D43-Y45 PolarHBondContact O-N 2.58Å; D43-Y45 WeakPolarHBondContact OD1-CE2 3.39Å; D43-K98 WeakPolarHBondContact OD1-CE 3.21Å; D43-K98 IonicContact OD1-NZ 3.35Å; D43-K98 PolarHBondContact OD1-NZ 2.88Å; D43-K98 IonicContact OD2-NZ 2.71Å; D43-K98 PolarHBondContact OD2-NZ 3.49Å
44F92.2Very high90.8Very high32 Ų3247.5 Ų47.514%0.1426%0.264CS..  trans-95.861-170.7-53.7-60.4000112.5F42 S47 L48 E215 P218 F219 F222F42-F44 AromaticContact CD2-CD2 4Å; F42-F44 HydrophobicContact CD2-CD2 4Å; F42-F44 HydrophobicContact CE1-CB 4.12Å; F42-F44 VanDerWaalsContact CE1-O 3.3Å; F42-F44 WeakPolarHBondContact CE1-O 3.3Å; F42-F44 HydrophobicContact CE2-CB 3.87Å; F42-F44 AromaticContact CE2-CD2 3.93Å; F42-F44 HydrophobicContact CE2-CD2 3.93Å; F42-F44 HydrophobicContact CE2-CG 4.41Å; F42-F44 HydrophobicContact CZ-CB 3.64Å; F42-F44 VanDerWaalsContact CZ-O 3.26Å; F42-F44 WeakPolarHBondContact CZ-O 3.31Å; F44-S47 PolarHBondContact O-N 3.38Å; F44-L48 PolarHBondContact O-N 2.71Å; F44-E215 VanDerWaalsContact CA-CD 3.5Å; F44-E215 WeakPolarHBondContact CA-OE1 3.47Å; F44-E215 HydrophobicContact CB-CG 4.2Å; F44-E215 WeakPolarHBondContact CB-OE1 3.37Å; F44-E215 HydrophobicContact CD1-CG 3.43Å; F44-E215 VanDerWaalsContact CD1-CG 3.43Å; F44-E215 HydrophobicContact CE1-CG 4.26Å; F44-E215 HydrophobicContact CG-CG 4.26Å; F44-P218 HydrophobicContact CE1-CB 3.64Å; F44-P218 HydrophobicContact CZ-CB 3.88Å; F44-F219 HydrophobicContact CB-CB 4.21Å; F44-F219 HydrophobicContact CB-CD2 3.56Å; F44-F219 HydrophobicContact CB-CE2 4.35Å; F44-F219 HydrophobicContact CB-CG 4.25Å; F44-F219 HydrophobicContact CD1-CB 4.1Å; F44-F219 HydrophobicContact CD2-CB 4.32Å; F44-F219 AromaticContact CD2-CD2 3.96Å; F44-F219 HydrophobicContact CD2-CD2 3.96Å; F44-F219 HydrophobicContact CG-CB 3.93Å; F44-F219 AromaticContact CG-CD2 3.87Å; F44-F219 HydrophobicContact CG-CD2 3.87Å; F44-F219 HydrophobicContact CG-CG 4.38Å; F44-F222 HydrophobicContact CD2-CB 4.16Å; F44-F222 HydrophobicContact CD2-CD1 4.48Å; F44-F222 HydrophobicContact CD2-CG 4.15Å; F44-F222 HydrophobicContact CE2-CB 3.44Å; F44-F222 VanDerWaalsContact CE2-CB 3.44Å; F44-F222 HydrophobicContact CE2-CD1 4.31Å; F44-F222 AromaticContact CE2-CD2 3.71Å; F44-F222 HydrophobicContact CE2-CD2 3.71Å; F44-F222 AromaticContact CE2-CG 3.55Å; F44-F222 HydrophobicContact CE2-CG 3.55Å; F44-F222 HydrophobicContact CZ-CB 4.18Å
45Y91.2Very high91.1Very high21 Ų2142.8 Ų42.88%0.08224%0.244CC..Hα-helixtrans-66.7-38.4-172.4-69.4-85.2000113.2T31 D43 S47 L48 L49 N94T31-Y45 HydrophobicContact CG2-CE1 3.75Å; D43-Y45 WeakPolarHBondContact O-CD2 3.3Å; D43-Y45 PolarHBondContact O-N 2.58Å; D43-Y45 WeakPolarHBondContact OD1-CE2 3.39Å; Y45-S47 VanDerWaalsContact C-N 3.34Å; Y45-L48 PolarHBondContact O-N 3.23Å; Y45-L49 WeakPolarHBondContact O-CB 3.48Å; Y45-L49 WeakPolarHBondContact O-CG 3.42Å; Y45-L49 PolarHBondContact O-N 3.46Å; Y45-N94 HydrophobicContact CD1-CB 3.89Å; Y45-N94 HydrophobicContact CE1-CB 4.2Å
46F93.6Very high91.6Very high36 Ų3642.1 Ų42.116%0.15824%0.242CC..Hα-helixtrans-66.4-41.9179.1-67.8-66.3000110.5L48 L49 L50 Y91 L206 V209 I210 E215F46-L48 PolarHBondContact O-N 2.99Å; F46-L49 PolarHBondContact O-N 3.06Å; F46-L50 WeakPolarHBondContact O-CB 3.49Å; F46-L50 PolarHBondContact O-N 2.86Å; F46-Y91 AromaticContact CD1-CD2 3.6Å; F46-Y91 HydrophobicContact CD1-CD2 3.6Å; F46-Y91 AromaticContact CD1-CE2 3.67Å; F46-Y91 HydrophobicContact CD1-CE2 3.67Å; F46-Y91 HydrophobicContact CD1-CG 4.37Å; F46-Y91 AromaticContact CD2-CE2 3.99Å; F46-Y91 HydrophobicContact CD2-CE2 3.99Å; F46-Y91 HydrophobicContact CE1-CD1 4.14Å; F46-Y91 AromaticContact CE1-CD2 3.28Å; F46-Y91 HydrophobicContact CE1-CD2 3.28Å; F46-Y91 HydrophobicContact CE1-CE1 4.09Å; F46-Y91 AromaticContact CE1-CE2 3.21Å; F46-Y91 HydrophobicContact CE1-CE2 3.21Å; F46-Y91 AromaticContact CE1-CG 3.76Å; F46-Y91 HydrophobicContact CE1-CG 3.76Å; F46-Y91 AromaticContact CE1-CZ 3.63Å; F46-Y91 HydrophobicContact CE2-CD2 4.45Å; F46-Y91 AromaticContact CE2-CE2 3.57Å; F46-Y91 HydrophobicContact CE2-CE2 3.57Å; F46-Y91 AromaticContact CE2-CZ 3.73Å; F46-Y91 HydrophobicContact CG-CD2 4.31Å; F46-Y91 HydrophobicContact CG-CE2 4.04Å; F46-Y91 HydrophobicContact CZ-CD1 4.35Å; F46-Y91 AromaticContact CZ-CD2 3.78Å; F46-Y91 HydrophobicContact CZ-CD2 3.78Å; F46-Y91 AromaticContact CZ-CE1 3.83Å; F46-Y91 HydrophobicContact CZ-CE1 3.83Å; F46-Y91 AromaticContact CZ-CE2 3.16Å; F46-Y91 HydrophobicContact CZ-CE2 3.16Å; F46-Y91 HydrophobicContact CZ-CG 4.32Å; F46-Y91 AromaticContact CZ-CZ 3.18Å; F46-Y91 WeakPolarHBondContact CZ-OH 3.07Å; F46-L206 HydrophobicContact CD1-CD2 4.06Å; F46-V209 HydrophobicContact CD1-CG1 3.86Å; F46-V209 HydrophobicContact CD2-CG1 4.3Å; F46-V209 HydrophobicContact CE1-CG1 3.49Å; F46-V209 VanDerWaalsContact CE1-CG1 3.49Å; F46-V209 HydrophobicContact CE2-CG1 3.98Å; F46-V209 HydrophobicContact CG-CG1 4.24Å; F46-V209 HydrophobicContact CZ-CG1 3.55Å; F46-I210 HydrophobicContact CB-CD1 4.04Å; F46-I210 HydrophobicContact CB-CG1 3.41Å; F46-I210 VanDerWaalsContact CB-CG1 3.41Å; F46-I210 HydrophobicContact CG-CG1 4.37Å; F46-I210 WeakPolarHBondContact O-CD1 3.26Å; F46-E215 WeakPolarHBondContact CD2-OE2 3.48Å
47S94.3Very high92.2Very high6 Ų642.2 Ų42.24%0.04223%0.232CC..Hα-helixtrans-63.6-41.3177-55.10000112.2F44 Y45 L50 F51 E215F44-S47 PolarHBondContact O-N 3.38Å; Y45-S47 VanDerWaalsContact C-N 3.34Å; S47-L50 PolarHBondContact O-N 3.2Å; S47-F51 WeakPolarHBondContact O-CB 3.43Å; S47-F51 PolarHBondContact O-N 3.38Å; S47-E215 VanDerWaalsContact CB-OE1 3.23Å; S47-E215 WeakPolarHBondContact CB-OE1 3.25Å; S47-E215 PolarHBondContact N-OE1 2.97Å; S47-E215 PolarHBondContact OG-OE1 3.04Å
48L93.9Very high93Very high2 Ų239.5 Ų39.51%0.0121%0.209CC..Hα-helixtrans-61.4-43.8174.6-178.461.8000112I30 F42 F44 Y45 F46 F51 Q52 M233 F236I30-L48 HydrophobicContact CD1-CD1 4.19Å; I30-L48 HydrophobicContact CG2-CD2 4.15Å; F42-L48 HydrophobicContact CE1-CB 3.81Å; F42-L48 HydrophobicContact CE1-CD2 3.93Å; F42-L48 HydrophobicContact CE1-CG 4.36Å; F42-L48 HydrophobicContact CZ-CB 3.9Å; F44-L48 PolarHBondContact O-N 2.71Å; Y45-L48 PolarHBondContact O-N 3.23Å; F46-L48 PolarHBondContact O-N 2.99Å; L48-F51 PolarHBondContact O-N 2.84Å; L48-Q52 WeakPolarHBondContact O-CB 3.27Å; L48-Q52 PolarHBondContact O-N 2.95Å; L48-M233 HydrophobicContact CD1-CE 3.89Å; L48-M233 HydrophobicContact CD1-CG 3.91Å; L48-M233 HydrophobicContact CD1-SD 4.44Å; L48-F236 HydrophobicContact CD1-CD1 3.74Å; L48-F236 HydrophobicContact CD1-CE1 3.67Å; L48-F236 HydrophobicContact CD1-CZ 4.47Å; L48-F236 HydrophobicContact CD2-CE1 4.27Å; L48-F236 HydrophobicContact CD2-CZ 4.31Å; L48-F236 HydrophobicContact CG-CD1 4.37Å; L48-F236 HydrophobicContact CG-CE1 3.79Å; L48-F236 HydrophobicContact CG-CZ 4.27Å
49L95Very high93.8Very high0 Ų039.9 Ų39.90%019%0.194CC..Hα-helixtrans-66.5-40.2177.8-71.1174.7000112.1Y45 F46 Q52 C53 I87 M90 Y91 L206Y45-L49 WeakPolarHBondContact O-CB 3.48Å; Y45-L49 WeakPolarHBondContact O-CG 3.42Å; Y45-L49 PolarHBondContact O-N 3.46Å; F46-L49 PolarHBondContact O-N 3.06Å; L49-Q52 WeakPolarHBondContact O-CB 3.4Å; L49-Q52 PolarHBondContact O-N 3.05Å; L49-C53 WeakPolarHBondContact O-CB 3.43Å; L49-C53 PolarHBondContact O-N 3.29Å; L49-C53 PolarHBondContact O-SG 3.33Å; L49-C53 VanDerWaalsContact O-SG 3.42Å; L49-I87 HydrophobicContact CB-CD1 4.07Å; L49-I87 HydrophobicContact CD1-CD1 4.1Å; L49-I87 HydrophobicContact CD2-CD1 4.41Å; L49-I87 HydrophobicContact CG-CD1 4.43Å; L49-M90 HydrophobicContact CD2-CB 4.3Å; L49-M90 HydrophobicContact CD2-CG 3.55Å; L49-M90 HydrophobicContact CD2-SD 3.34Å; L49-M90 WeakPolarHBondContact CD2-SD 3.2Å; L49-Y91 HydrophobicContact CD1-CD2 4.17Å; L49-L206 HydrophobicContact CB-CD1 4.22Å; L49-L206 HydrophobicContact CB-CD2 4.4Å
50L96.4Very high94.3Very high39 Ų3934.7 Ų34.720%0.20417%0.169CC..Hα-helixtrans-61.5-47.8175.1178.268.1000110.6F46 S47 Q52 C53 M54 I203 L206 V207 I210F46-L50 WeakPolarHBondContact O-CB 3.49Å; F46-L50 PolarHBondContact O-N 2.86Å; S47-L50 PolarHBondContact O-N 3.2Å; L50-Q52 VanDerWaalsContact C-N 3.28Å; L50-Q52 PolarHBondContact O-N 3.47Å; L50-C53 PolarHBondContact O-N 3.38Å; L50-M54 HydrophobicContact CD1-CG 4.29Å; L50-M54 HydrophobicContact CG-CG 4.39Å; L50-M54 WeakPolarHBondContact O-CB 3.15Å; L50-M54 VanDerWaalsContact O-CG 3.25Å; L50-M54 WeakPolarHBondContact O-CG 3.09Å; L50-M54 PolarHBondContact O-N 2.87Å; L50-I203 HydrophobicContact CD1-CB 4.42Å; L50-I203 HydrophobicContact CD1-CG1 4.29Å; L50-I203 HydrophobicContact CD1-CG2 4.02Å; L50-L206 HydrophobicContact CB-CD1 4.17Å; L50-L206 HydrophobicContact CD1-CB 4.11Å; L50-L206 HydrophobicContact CD1-CD1 4.38Å; L50-V207 HydrophobicContact CD1-CG2 3.99Å; L50-I210 HydrophobicContact CB-CD1 3.51Å; L50-I210 HydrophobicContact CD2-CD1 3.58Å; L50-I210 HydrophobicContact CG-CD1 4.05Å
51F95.7Very high94.8Very high47 Ų4735 Ų3521%0.20617%0.172CC..Hα-helixtrans-56.6-44.7177-174.3-94.9000111.6S47 L48 M54 I55 F230 M233S47-F51 WeakPolarHBondContact O-CB 3.43Å; S47-F51 PolarHBondContact O-N 3.38Å; L48-F51 PolarHBondContact O-N 2.84Å; F51-M54 PolarHBondContact O-N 3.44Å; F51-I55 HydrophobicContact CD1-CD1 3.8Å; F51-I55 HydrophobicContact CE1-CD1 3.22Å; F51-I55 HydrophobicContact CE1-CG1 4.4Å; F51-I55 HydrophobicContact CE2-CD1 4.45Å; F51-I55 HydrophobicContact CZ-CD1 3.62Å; F51-I55 PolarHBondContact O-N 3.4Å; F51-F230 AromaticContact CE2-CE2 3.98Å; F51-F230 HydrophobicContact CE2-CE2 3.98Å; F51-F230 HydrophobicContact CZ-CE2 4.27Å; F51-M233 HydrophobicContact CB-CE 3.75Å; F51-M233 HydrophobicContact CD1-CB 4.09Å; F51-M233 HydrophobicContact CD1-CE 3.93Å; F51-M233 HydrophobicContact CD2-CE 4.22Å; F51-M233 HydrophobicContact CE1-CB 3.89Å; F51-M233 VanDerWaalsContact CE1-O 3.26Å; F51-M233 WeakPolarHBondContact CE1-O 3.39Å; F51-M233 HydrophobicContact CG-CE 3.7Å; F51-M233 HydrophobicContact CZ-CB 4.46Å
52Q96.3Very high95.2Very high0 Ų034.2 Ų34.20%017%0.168CC..Hα-helixtrans-60.4-51.3175.7-165.4-169.1-19.300112.1Y23 L48 L49 L50 M54 I55 N56 F236 S240Y23-Q52 PolarHBondContact OH-NE2 3.46Å; Y23-Q52 PolarHBondContact OH-OE1 2.92Å; L48-Q52 WeakPolarHBondContact O-CB 3.27Å; L48-Q52 PolarHBondContact O-N 2.95Å; L49-Q52 WeakPolarHBondContact O-CB 3.4Å; L49-Q52 PolarHBondContact O-N 3.05Å; L50-Q52 VanDerWaalsContact C-N 3.28Å; L50-Q52 PolarHBondContact O-N 3.47Å; Q52-M54 VanDerWaalsContact C-N 3.31Å; Q52-M54 PolarHBondContact O-N 2.93Å; Q52-I55 PolarHBondContact O-N 3.48Å; Q52-N56 PolarHBondContact O-N 2.95Å; Q52-N56 PolarHBondContact O-ND2 3.25Å; Q52-F236 HydrophobicContact CB-CE1 3.89Å; Q52-F236 HydrophobicContact CG-CD1 4.47Å; Q52-F236 HydrophobicContact CG-CE1 3.87Å; Q52-F236 HydrophobicContact CG-CZ 4.45Å; Q52-S240 WeakPolarHBondContact CG-OG 3.2Å; Q52-S240 PolarHBondContact NE2-OG 3.2Å
53C97.4Very high95.6Very high0 Ų034.5 Ų34.50%017%0.17CC..Hα-helixtrans-63-36.5-179.3-73.40000112.4L49 L50 N56 F57 I203L49-C53 WeakPolarHBondContact O-CB 3.43Å; L49-C53 PolarHBondContact O-N 3.29Å; L49-C53 PolarHBondContact O-SG 3.33Å; L49-C53 VanDerWaalsContact O-SG 3.42Å; L50-C53 PolarHBondContact O-N 3.38Å; C53-N56 PolarHBondContact O-N 2.96Å; C53-F57 VanDerWaalsContact O-CB 3.28Å; C53-F57 WeakPolarHBondContact O-CB 3.23Å; C53-F57 PolarHBondContact O-N 3.08Å; C53-I203 HydrophobicContact CB-CD1 4.4Å; C53-I203 HydrophobicContact CB-CG1 3.79Å
54M97.7Very high95.9Very high80 Ų8031.9 Ų31.939%0.39416%0.156SC..Hα-helixtrans-61.6-47.1174.9-73.1-64.5-66.300111.7L50 F51 Q52 F57 I58 I203L50-M54 HydrophobicContact CD1-CG 4.29Å; L50-M54 HydrophobicContact CG-CG 4.39Å; L50-M54 WeakPolarHBondContact O-CB 3.15Å; L50-M54 VanDerWaalsContact O-CG 3.25Å; L50-M54 WeakPolarHBondContact O-CG 3.09Å; L50-M54 PolarHBondContact O-N 2.87Å; F51-M54 PolarHBondContact O-N 3.44Å; Q52-M54 VanDerWaalsContact C-N 3.31Å; Q52-M54 PolarHBondContact O-N 2.93Å; M54-F57 PolarHBondContact O-N 2.72Å; M54-I58 VanDerWaalsContact O-CG1 3.32Å; M54-I58 WeakPolarHBondContact O-CG1 3.01Å; M54-I58 PolarHBondContact O-N 2.92Å; M54-I203 HydrophobicContact CG-CD1 4.3Å; M54-I203 HydrophobicContact CG-CG1 4.36Å; M54-I203 HydrophobicContact SD-CD1 3.52Å; M54-I203 VanDerWaalsContact SD-CD1 3.52Å; M54-I203 HydrophobicContact SD-CG1 3.89Å; M54-I203 HydrophobicContact SD-CG2 3.95Å
55I97.6Very high96.1Very high24 Ų2440.2 Ų40.212%0.12319%0.187CC..Hα-helixtrans-62.8-45.7177.1-68.9171.7000110.5F51 Q52 F57 I58 F59 L238 A241F51-I55 HydrophobicContact CD1-CD1 3.8Å; F51-I55 HydrophobicContact CE1-CD1 3.22Å; F51-I55 HydrophobicContact CE1-CG1 4.4Å; F51-I55 HydrophobicContact CE2-CD1 4.45Å; F51-I55 HydrophobicContact CZ-CD1 3.62Å; F51-I55 PolarHBondContact O-N 3.4Å; Q52-I55 PolarHBondContact O-N 3.48Å; I55-F57 VanDerWaalsContact C-N 3.32Å; I55-F57 PolarHBondContact O-N 3.1Å; I55-I58 PolarHBondContact O-N 2.98Å; I55-F59 HydrophobicContact CG2-CD2 3.85Å; I55-F59 HydrophobicContact CG2-CE2 4.03Å; I55-F59 WeakPolarHBondContact O-CB 3.49Å; I55-F59 WeakPolarHBondContact O-CD2 3.44Å; I55-F59 PolarHBondContact O-N 3.13Å; I55-L238 HydrophobicContact CG2-CD2 4.43Å; I55-A241 HydrophobicContact CG2-CB 4.12Å
56N97.7Very high96.3Very high0 Ų046.2 Ų46.20%021%0.213CC..Hα-helixtrans-61.4-40.8178.4-65.6-33.3000112.2Q52 C53 F59 S60 M195 N199 S240 A241 Q244Q52-N56 PolarHBondContact O-N 2.95Å; Q52-N56 PolarHBondContact O-ND2 3.25Å; C53-N56 PolarHBondContact O-N 2.96Å; N56-F59 PolarHBondContact O-N 3.4Å; N56-S60 WeakPolarHBondContact O-CB 3.31Å; N56-S60 PolarHBondContact O-N 2.9Å; N56-S60 PolarHBondContact O-OG 3.45Å; N56-M195 HydrophobicContact CB-CE 4.13Å; N56-M195 WeakPolarHBondContact O-CE 3.26Å; N56-N199 HydrophobicContact CB-CB 4.27Å; N56-N199 VanDerWaalsContact CB-CG 3.41Å; N56-N199 VanDerWaalsContact CB-OD1 3.25Å; N56-N199 WeakPolarHBondContact CB-OD1 3.37Å; N56-N199 PolarHBondContact ND2-OD1 3.4Å; N56-S240 PolarHBondContact ND2-OG 3.49Å; N56-S240 PolarHBondContact OD1-OG 3.39Å; N56-A241 WeakPolarHBondContact OD1-CA 3.28Å; N56-A241 VanDerWaalsContact OD1-CB 3.31Å; N56-A241 WeakPolarHBondContact OD1-CB 3.46Å; N56-A241 PolarHBondContact OD1-N 3.34Å; N56-Q244 PolarHBondContact ND2-NE2 2.92Å
57F97.9Very high96.3Very high39 Ų3951.9 Ų51.917%0.17123%0.234CC..Hα-helixtrans-62.6-48.3175.9178.4-111.2000111.3C53 M54 I55 F59 S60 L61 M196 N199 L200 I203C53-F57 VanDerWaalsContact O-CB 3.28Å; C53-F57 WeakPolarHBondContact O-CB 3.23Å; C53-F57 PolarHBondContact O-N 3.08Å; M54-F57 PolarHBondContact O-N 2.72Å; I55-F57 VanDerWaalsContact C-N 3.32Å; I55-F57 PolarHBondContact O-N 3.1Å; F57-F59 PolarHBondContact O-N 3Å; F57-S60 PolarHBondContact O-N 2.97Å; F57-S60 VanDerWaalsContact O-N 3.14Å; F57-S60 PolarHBondContact O-OG 2.74Å; F57-L61 HydrophobicContact CD1-CD1 4.11Å; F57-L61 HydrophobicContact CE1-CD1 3.6Å; F57-L61 HydrophobicContact CE1-CG 4.33Å; F57-L61 HydrophobicContact CE2-CD1 4.49Å; F57-L61 HydrophobicContact CE2-CD2 4.43Å; F57-L61 HydrophobicContact CE2-CG 4.4Å; F57-L61 HydrophobicContact CZ-CD1 3.81Å; F57-L61 HydrophobicContact CZ-CD2 4.23Å; F57-L61 HydrophobicContact CZ-CG 4.17Å; F57-L61 WeakPolarHBondContact O-CG 3.29Å; F57-L61 PolarHBondContact O-N 3.44Å; F57-M196 HydrophobicContact CD2-CG 3.84Å; F57-M196 HydrophobicContact CE2-CG 3.51Å; F57-M196 HydrophobicContact CE2-SD 4.38Å; F57-N199 HydrophobicContact CB-CB 4.08Å; F57-L200 HydrophobicContact CD2-CB 3.9Å; F57-L200 HydrophobicContact CD2-CD1 4.48Å; F57-L200 HydrophobicContact CE1-CD1 4.49Å; F57-L200 HydrophobicContact CE2-CB 3.73Å; F57-L200 HydrophobicContact CE2-CD1 3.89Å; F57-L200 HydrophobicContact CE2-CD2 4.29Å; F57-L200 HydrophobicContact CE2-CG 4.18Å; F57-L200 HydrophobicContact CZ-CD1 3.9Å; F57-I203 HydrophobicContact CB-CD1 3.76Å; F57-I203 HydrophobicContact CD1-CD1 4.36Å; F57-I203 HydrophobicContact CG-CD1 4.09Å
58I97.6Very high96.3Very high83 Ų8356.9 Ų56.943%0.42627%0.266SS..Hα-helixtrans-59.5-45.7176.7-67.3165.3000111.1M54 I55 S60 L61 I62M54-I58 VanDerWaalsContact O-CG1 3.32Å; M54-I58 WeakPolarHBondContact O-CG1 3.01Å; M54-I58 PolarHBondContact O-N 2.92Å; I55-I58 PolarHBondContact O-N 2.98Å; I58-S60 VanDerWaalsContact C-N 3.29Å; I58-S60 PolarHBondContact O-N 2.92Å; I58-L61 WeakPolarHBondContact O-CB 3.33Å; I58-L61 PolarHBondContact O-N 3.43Å; I58-L61 VanDerWaalsContact O-N 3.17Å; I58-I62 HydrophobicContact CG2-CD1 3.94Å; I58-I62 WeakPolarHBondContact O-CG1 3.27Å; I58-I62 PolarHBondContact O-N 2.64Å
59F97Very high96.2Very high65 Ų6559.4 Ų59.429%0.28528%0.278SS..Hα-helixtrans-61.7-37.6177-95.3-105.2000112.5I55 N56 F57 I62 A63 M195 L238 A241I55-F59 HydrophobicContact CG2-CD2 3.85Å; I55-F59 HydrophobicContact CG2-CE2 4.03Å; I55-F59 WeakPolarHBondContact O-CB 3.49Å; I55-F59 WeakPolarHBondContact O-CD2 3.44Å; I55-F59 PolarHBondContact O-N 3.13Å; N56-F59 PolarHBondContact O-N 3.4Å; F57-F59 PolarHBondContact O-N 3Å; F59-I62 PolarHBondContact O-N 3.01Å; F59-A63 WeakPolarHBondContact O-CB 3.48Å; F59-A63 PolarHBondContact O-N 3.42Å; F59-M195 HydrophobicContact CB-CE 4.35Å; F59-L238 HydrophobicContact CE2-CD2 3.57Å; F59-L238 HydrophobicContact CZ-CD2 3.6Å; F59-A241 HydrophobicContact CB-CB 3.88Å; F59-A241 HydrophobicContact CD1-CB 3.93Å; F59-A241 HydrophobicContact CD2-CB 3.94Å; F59-A241 HydrophobicContact CE1-CB 4.48Å; F59-A241 HydrophobicContact CE2-CB 4.48Å; F59-A241 HydrophobicContact CG-CB 3.63Å
60S97Very high95.8Very high0 Ų064.2 Ų64.20%031%0.311CS..Hα-helixtrans-66.7-36.2175.873.60000112.5N56 F57 I58 A63 L64 M196N56-S60 WeakPolarHBondContact O-CB 3.31Å; N56-S60 PolarHBondContact O-N 2.9Å; N56-S60 PolarHBondContact O-OG 3.45Å; F57-S60 PolarHBondContact O-N 2.97Å; F57-S60 VanDerWaalsContact O-N 3.14Å; F57-S60 PolarHBondContact O-OG 2.74Å; I58-S60 VanDerWaalsContact C-N 3.29Å; I58-S60 PolarHBondContact O-N 2.92Å; S60-A63 PolarHBondContact O-N 2.87Å; S60-L64 WeakPolarHBondContact O-CB 3.31Å; S60-L64 VanDerWaalsContact O-CG 3.32Å; S60-L64 WeakPolarHBondContact O-CG 3.46Å; S60-L64 PolarHBondContact O-N 3.49Å; S60-M196 WeakPolarHBondContact OG-CA 3.28Å; S60-M196 VanDerWaalsContact OG-CB 3.24Å; S60-M196 WeakPolarHBondContact OG-CB 3.27Å; S60-M196 WeakPolarHBondContact OG-CG 3.47Å
61L96.7Very high95Very high76 Ų7666.3 Ų66.340%0.39833%0.33SS..Hα-helixtrans-65.6-44173.5-68.5174.4000111.6F57 I58 L64 R65 M196F57-L61 HydrophobicContact CD1-CD1 4.11Å; F57-L61 HydrophobicContact CE1-CD1 3.6Å; F57-L61 HydrophobicContact CE1-CG 4.33Å; F57-L61 HydrophobicContact CE2-CD1 4.49Å; F57-L61 HydrophobicContact CE2-CD2 4.43Å; F57-L61 HydrophobicContact CE2-CG 4.4Å; F57-L61 HydrophobicContact CZ-CD1 3.81Å; F57-L61 HydrophobicContact CZ-CD2 4.23Å; F57-L61 HydrophobicContact CZ-CG 4.17Å; F57-L61 WeakPolarHBondContact O-CG 3.29Å; F57-L61 PolarHBondContact O-N 3.44Å; I58-L61 WeakPolarHBondContact O-CB 3.33Å; I58-L61 PolarHBondContact O-N 3.43Å; I58-L61 VanDerWaalsContact O-N 3.17Å; L61-L64 PolarHBondContact O-N 3.1Å; L61-R65 PolarHBondContact O-N 3.25Å; L61-M196 HydrophobicContact CD2-CG 4.27Å; L61-M196 HydrophobicContact CD2-SD 3.6Å; L61-M196 VanDerWaalsContact CD2-SD 3.6Å
62I96.9Very high94.5Very high83 Ų8365.5 Ų65.543%0.42633%0.328SS..Hα-helixtrans-61.1-46.8175.2-65167.6000109.8I58 F59 L64 R65 F66I58-I62 HydrophobicContact CG2-CD1 3.94Å; I58-I62 WeakPolarHBondContact O-CG1 3.27Å; I58-I62 PolarHBondContact O-N 2.64Å; F59-I62 PolarHBondContact O-N 3.01Å; I62-L64 PolarHBondContact O-N 3.17Å; I62-R65 WeakPolarHBondContact O-CB 3.28Å; I62-R65 PolarHBondContact O-N 3.08Å; I62-R65 VanDerWaalsContact O-N 3.15Å; I62-F66 HydrophobicContact CG2-CD2 4.01Å; I62-F66 HydrophobicContact CG2-CE2 3.82Å; I62-F66 VanDerWaalsContact O-CD2 3.23Å; I62-F66 WeakPolarHBondContact O-CD2 3.48Å; I62-F66 PolarHBondContact O-N 3.4Å
63A96.3Very high93.7Very high7 Ų770 Ų706%0.05836%0.358CS..Hα-helixtrans-61.7-43.9178.300000112.1F59 S60 R65 F66 W67 Y192F59-A63 WeakPolarHBondContact O-CB 3.48Å; F59-A63 PolarHBondContact O-N 3.42Å; S60-A63 PolarHBondContact O-N 2.87Å; A63-R65 PolarHBondContact O-N 3.49Å; A63-F66 PolarHBondContact O-N 3.45Å; A63-F66 VanDerWaalsContact O-N 3.16Å; A63-W67 HydrophobicContact CB-CE3 4.48Å; A63-W67 PolarHBondContact O-N 3.38Å; A63-Y192 HydrophobicContact CB-CD1 3.51Å; A63-Y192 HydrophobicContact CB-CD2 4.46Å; A63-Y192 HydrophobicContact CB-CE1 3.82Å; A63-Y192 HydrophobicContact CB-CG 3.87Å
64L95.8Very high93.2Very high29 Ų2974.6 Ų74.615%0.15239%0.39CS..Hα-helixtrans-64.2-28175.6-78.6166000112.9S60 L61 I62 W67 P68 E69 M196S60-L64 WeakPolarHBondContact O-CB 3.31Å; S60-L64 VanDerWaalsContact O-CG 3.32Å; S60-L64 WeakPolarHBondContact O-CG 3.46Å; S60-L64 PolarHBondContact O-N 3.49Å; L61-L64 PolarHBondContact O-N 3.1Å; I62-L64 PolarHBondContact O-N 3.17Å; L64-W67 CarbonylContact O-C 3.44Å; L64-P68 VanDerWaalsContact O-CA 3.31Å; L64-P68 WeakPolarHBondContact O-CA 2.99Å; L64-E69 HydrophobicContact CD2-CB 3.85Å; L64-E69 HydrophobicContact CD2-CG 4.29Å; L64-M196 HydrophobicContact CD1-CB 3.94Å; L64-M196 HydrophobicContact CD1-CE 4.19Å; L64-M196 HydrophobicContact CD1-CG 4.22Å; L64-M196 HydrophobicContact CD1-SD 3.46Å; L64-M196 WeakPolarHBondContact CD1-SD 3.31Å
65R95.5Very high92.9Very high208 Ų20871 Ų7179%0.78537%0.372SS*.Hα-helixtrans-67.6-37.9174-17959.1178.6-171.41.8112.1L61 I62 A63L61-R65 PolarHBondContact O-N 3.25Å; I62-R65 WeakPolarHBondContact O-CB 3.28Å; I62-R65 PolarHBondContact O-N 3.08Å; I62-R65 VanDerWaalsContact O-N 3.15Å; A63-R65 PolarHBondContact O-N 3.49Å
66F95.3Very high92.6Very high147 Ų14772.7 Ų72.765%0.64538%0.379SS*.Hα-helixtrans-85.9-35178.8-73.3-72.7000113.3I62 A63 P68I62-F66 HydrophobicContact CG2-CD2 4.01Å; I62-F66 HydrophobicContact CG2-CE2 3.82Å; I62-F66 VanDerWaalsContact O-CD2 3.23Å; I62-F66 WeakPolarHBondContact O-CD2 3.48Å; I62-F66 PolarHBondContact O-N 3.4Å; A63-F66 PolarHBondContact O-N 3.45Å; A63-F66 VanDerWaalsContact O-N 3.16Å; F66-P68 WeakPolarHBondContact O-CD 3.28Å
67W94.5Very high92.5Very high155 Ų15579.3 Ų79.359%0.58741%0.405SS*.SBendtrans-125.181.4178-61.6-76.6000109.6A63 L64 E69 Y192A63-W67 HydrophobicContact CB-CE3 4.48Å; A63-W67 PolarHBondContact O-N 3.38Å; L64-W67 CarbonylContact O-C 3.44Å; W67-E69 PolarHBondContact O-N 3.49Å; W67-Y192 HydrophobicContact CB-CD2 4.13Å; W67-Y192 HydrophobicContact CB-CE2 3.73Å; W67-Y192 HydrophobicContact CD2-CE2 4.38Å; W67-Y192 HydrophobicContact CE3-CE2 4.27Å; W67-Y192 HydrophobicContact CG-CE2 4.19Å
68P93.1Very high92.4Very high111 Ų11178.2 Ų78.272%0.72140%0.401SS*.  trans-58.7127.2178.6-24.434.7000111.4L64 F66L64-P68 VanDerWaalsContact O-CA 3.31Å; L64-P68 WeakPolarHBondContact O-CA 2.99Å; F66-P68 WeakPolarHBondContact O-CD 3.28Å
69E93.2Very high92.3Very high54 Ų5474.3 Ų74.325%0.25238%0.38SS..  trans-118.1153.1173.9-67.5179.1152.300109L64 W67 S71 G190 S191 Y192 T193L64-E69 HydrophobicContact CD2-CB 3.85Å; L64-E69 HydrophobicContact CD2-CG 4.29Å; W67-E69 PolarHBondContact O-N 3.49Å; E69-S71 PolarHBondContact O-N 3.26Å; E69-G190 WeakPolarHBondContact OE1-CA 3.22Å; E69-G190 WeakPolarHBondContact OE2-CA 3.32Å; E69-S191 PolarHBondContact OE1-N 2.82Å; E69-S191 PolarHBondContact OE2-N 2.94Å; E69-Y192 HydrophobicContact CG-CD2 4.27Å; E69-Y192 WeakPolarHBondContact OE1-CD2 3.27Å; E69-Y192 WeakPolarHBondContact OE2-CA 3.43Å; E69-Y192 WeakPolarHBondContact OE2-CB 3.37Å; E69-Y192 PolarHBondContact OE2-N 3.33Å; E69-T193 VanDerWaalsContact CB-OG1 3.3Å; E69-T193 WeakPolarHBondContact CB-OG1 2.99Å; E69-T193 PolarHBondContact OE2-N 3.49Å; E69-T193 PolarHBondContact OE2-OG1 2.88Å
70S85.2Confident92.3Very high101 Ų10171.8 Ų71.871%0.70637%0.371SS*.  trans-67.9128179.6-55.70000111.5
71S80.3Confident92.3Very high84 Ų8475.8 Ų75.859%0.58739%0.391SS*.  trans-75.2143.8167.7-62.70000110.5E69E69-S71 PolarHBondContact O-N 3.26Å
72V84.9Confident92.4Very high29 Ų2972.1 Ų72.118%0.17637%0.372CS..  trans-127.573.7179.8-74.20000110.8S74 L75 F79 V189V72-S74 PolarHBondContact O-N 3.24Å; V72-L75 HydrophobicContact CB-CD1 4.16Å; V72-L75 HydrophobicContact CB-CG 4.42Å; V72-L75 HydrophobicContact CG2-CB 4.44Å; V72-L75 HydrophobicContact CG2-CD1 3.93Å; V72-L75 HydrophobicContact CG2-CG 4.43Å; V72-L75 PolarHBondContact O-N 3.5Å; V72-F79 HydrophobicContact CG2-CE2 3.87Å; V72-F79 HydrophobicContact CG2-CZ 3.82Å; V72-V189 HydrophobicContact CG2-CG2 3.79Å
73P81Confident92.4Very high95 Ų9568.2 Ų68.262%0.61735%0.352SS*.G310 helixtrans-59.1-24.7-174.7-23.633.8000114.2L75 E76P73-L75 PolarHBondContact O-N 3.07Å; P73-E76 WeakPolarHBondContact O-CG 3.47Å; P73-E76 PolarHBondContact O-N 2.85Å
74S85.7Confident92.4Very high96 Ų9672.6 Ų72.667%0.67137%0.37SS*.G310 helixtrans-63.9-10.4176.956.10000114.1V72V72-S74 PolarHBondContact O-N 3.24Å
75L91.2Very high92.5Very high5 Ų571.3 Ų71.33%0.02636%0.364CS..G310 helixtrans-110.310.4-177.8-56.5-179.9000113.7V72 P73 Y77 K78 F79 L184 Y187 V189V72-L75 HydrophobicContact CB-CD1 4.16Å; V72-L75 HydrophobicContact CB-CG 4.42Å; V72-L75 HydrophobicContact CG2-CB 4.44Å; V72-L75 HydrophobicContact CG2-CD1 3.93Å; V72-L75 HydrophobicContact CG2-CG 4.43Å; V72-L75 PolarHBondContact O-N 3.5Å; P73-L75 PolarHBondContact O-N 3.07Å; L75-Y77 VanDerWaalsContact C-N 3.25Å; L75-Y77 PolarHBondContact O-N 3.47Å; L75-K78 HydrophobicContact CD2-CD 4.18Å; L75-K78 WeakPolarHBondContact O-CA 3.47Å; L75-K78 WeakPolarHBondContact O-CB 3.48Å; L75-K78 PolarHBondContact O-N 2.91Å; L75-F79 HydrophobicContact CB-CD2 4.43Å; L75-F79 HydrophobicContact CB-CE2 4.07Å; L75-F79 WeakPolarHBondContact O-CD2 3.35Å; L75-F79 PolarHBondContact O-N 2.87Å; L75-L184 HydrophobicContact CB-CD2 4.02Å; L75-L184 HydrophobicContact CD1-CD2 4.01Å; L75-Y187 VanDerWaalsContact CD1-CB 3.46Å; L75-Y187 HydrophobicContact CD1-CD1 3.85Å; L75-Y187 HydrophobicContact CD1-CD2 3.75Å; L75-Y187 HydrophobicContact CD1-CE2 4.47Å; L75-Y187 HydrophobicContact CD1-CG 3.4Å; L75-Y187 VanDerWaalsContact CD1-CG 3.4Å; L75-Y187 HydrophobicContact CD2-CD1 4.08Å; L75-Y187 HydrophobicContact CD2-CD2 4.25Å; L75-Y187 HydrophobicContact CD2-CE1 3.94Å; L75-Y187 HydrophobicContact CD2-CE2 4.16Å; L75-Y187 HydrophobicContact CD2-CG 4.22Å; L75-Y187 HydrophobicContact CG-CD1 4.48Å; L75-Y187 HydrophobicContact CG-CG 4.42Å; L75-V189 HydrophobicContact CD1-CG2 4.18Å
76E91.9Very high92.6Very high60 Ų6062.6 Ų62.628%0.2833%0.331SS..Hα-helixtrans-51.9-40.9-178.9-78.5-51.9141.800113.5P73 K78 F79 S80 H197 W201P73-E76 WeakPolarHBondContact O-CG 3.47Å; P73-E76 PolarHBondContact O-N 2.85Å; E76-K78 VanDerWaalsContact C-N 3.29Å; E76-K78 PolarHBondContact O-N 3.42Å; E76-F79 PolarHBondContact O-N 3.46Å; E76-S80 WeakPolarHBondContact O-CB 3.49Å; E76-S80 PolarHBondContact O-N 3.48Å; E76-H197 IonicContact OE1-CD2 3.55Å; E76-H197 PolarHBondContact OE1-CD2 3.44Å; E76-H197 IonicContact OE1-NE2 3.14Å; E76-H197 PolarHBondContact OE1-NE2 3Å; E76-H197 VanDerWaalsContact OE1-NE2 3.12Å; E76-H197 IonicContact OE2-CD2 2.7Å; E76-W201 PolarHBondContact OE2-NE1 3.2Å
77Y94.8Very high92.7Very high139 Ų13955.9 Ų55.955%0.54530%0.302SS..Hα-helixtrans-62.3-35.7177.578-85.9000112.6L75 S80 I81L75-Y77 VanDerWaalsContact C-N 3.25Å; L75-Y77 PolarHBondContact O-N 3.47Å; Y77-S80 WeakPolarHBondContact O-CB 3.35Å; Y77-S80 PolarHBondContact O-N 3.38Å; Y77-I81 HydrophobicContact CD2-CD1 4.28Å; Y77-I81 VanDerWaalsContact O-CG1 3.31Å; Y77-I81 WeakPolarHBondContact O-CG1 3.43Å; Y77-I81 PolarHBondContact O-N 3.39Å
78K95.7Very high92.8Very high16 Ų1650.4 Ų50.47%0.0729%0.285CS..Hα-helixtrans-70.2-42.1176-63.9-169.1-171.61780110.2L75 E76 S80 I81 C82 V180 E183 L184 Y187L75-K78 HydrophobicContact CD2-CD 4.18Å; L75-K78 WeakPolarHBondContact O-CA 3.47Å; L75-K78 WeakPolarHBondContact O-CB 3.48Å; L75-K78 PolarHBondContact O-N 2.91Å; E76-K78 VanDerWaalsContact C-N 3.29Å; E76-K78 PolarHBondContact O-N 3.42Å; K78-S80 VanDerWaalsContact C-N 3.28Å; K78-S80 PolarHBondContact O-N 2.57Å; K78-I81 PolarHBondContact O-N 2.87Å; K78-C82 WeakPolarHBondContact O-CB 3.4Å; K78-C82 PolarHBondContact O-N 3.26Å; K78-V180 HydrophobicContact CB-CG1 4.13Å; K78-V180 WeakPolarHBondContact O-CG1 3.34Å; K78-E183 HydrophobicContact CD-CG 4.06Å; K78-E183 IonicContact NZ-OE1 3.56Å; K78-E183 PolarHBondContact NZ-OE1 3.39Å; K78-L184 HydrophobicContact CB-CD2 3.71Å; K78-L184 HydrophobicContact CB-CG 4.14Å; K78-L184 HydrophobicContact CD-CD2 4.18Å; K78-Y187 PolarHBondContact NZ-OH 3.12Å
79F96.4Very high93Very high0 Ų045.1 Ų45.10%025%0.251CS..Hα-helixtrans-60.9-39.7173.6-67.8-52.7000112.1V72 L75 E76 C82 G83 L184 V189 L194 H197V72-F79 HydrophobicContact CG2-CE2 3.87Å; V72-F79 HydrophobicContact CG2-CZ 3.82Å; L75-F79 HydrophobicContact CB-CD2 4.43Å; L75-F79 HydrophobicContact CB-CE2 4.07Å; L75-F79 WeakPolarHBondContact O-CD2 3.35Å; L75-F79 PolarHBondContact O-N 2.87Å; E76-F79 PolarHBondContact O-N 3.46Å; F79-C82 WeakPolarHBondContact O-CB 3.31Å; F79-C82 PolarHBondContact O-N 2.8Å; F79-G83 PolarHBondContact O-N 2.97Å; F79-L184 HydrophobicContact CD1-CD1 3.69Å; F79-L184 HydrophobicContact CD1-CD2 4Å; F79-L184 HydrophobicContact CE1-CD1 3.79Å; F79-L184 HydrophobicContact CE1-CD2 3.68Å; F79-L184 HydrophobicContact CE1-CG 4.31Å; F79-L184 HydrophobicContact CZ-CD2 3.99Å; F79-V189 HydrophobicContact CE1-CG1 3.94Å; F79-V189 HydrophobicContact CZ-CG1 3.74Å; F79-V189 HydrophobicContact CZ-CG2 4.14Å; F79-L194 HydrophobicContact CD1-CD1 4.09Å; F79-L194 HydrophobicContact CE1-CD1 3.78Å; F79-H197 HydrophobicContact CB-CB 3.82Å; F79-H197 HydrophobicContact CD1-CB 3.7Å; F79-H197 HydrophobicContact CD2-CB 3.9Å; F79-H197 AromaticContact CD2-CD2 3.64Å; F79-H197 AromaticContact CD2-CG 3.73Å; F79-H197 HydrophobicContact CE1-CB 4.2Å; F79-H197 HydrophobicContact CE2-CB 4.39Å; F79-H197 AromaticContact CE2-CD2 3.96Å; F79-H197 AromaticContact CE2-CG 3.93Å; F79-H197 HydrophobicContact CG-CB 3.54Å; F79-H197 AromaticContact CG-CG 3.93Å
80S97Very high93Very high13 Ų1344 Ų449%0.09125%0.247CC..Hα-helixtrans-61.7-50.4177.5-166.50000112.2E76 Y77 K78 C82 G83 F84 W201 Y205E76-S80 WeakPolarHBondContact O-CB 3.49Å; E76-S80 PolarHBondContact O-N 3.48Å; Y77-S80 WeakPolarHBondContact O-CB 3.35Å; Y77-S80 PolarHBondContact O-N 3.38Å; K78-S80 VanDerWaalsContact C-N 3.28Å; K78-S80 PolarHBondContact O-N 2.57Å; S80-C82 VanDerWaalsContact C-N 3.29Å; S80-C82 PolarHBondContact O-N 3.3Å; S80-G83 PolarHBondContact O-N 3.07Å; S80-F84 WeakPolarHBondContact O-CB 3.3Å; S80-F84 PolarHBondContact O-N 3.28Å; S80-W201 WeakPolarHBondContact OG-CZ3 3.43Å; S80-Y205 WeakPolarHBondContact O-CE2 3.47Å; S80-Y205 PolarHBondContact OG-OH 2.94Å
81I97.4Very high93.5Very high83 Ų8342.4 Ų42.443%0.42623%0.225SC..Hα-helixtrans-61.5-40.4175.2-63.9164.1000110.9Y77 K78 S85 V180Y77-I81 HydrophobicContact CD2-CD1 4.28Å; Y77-I81 VanDerWaalsContact O-CG1 3.31Å; Y77-I81 WeakPolarHBondContact O-CG1 3.43Å; Y77-I81 PolarHBondContact O-N 3.39Å; K78-I81 PolarHBondContact O-N 2.87Å; I81-S85 WeakPolarHBondContact O-CB 3.31Å; I81-S85 PolarHBondContact O-N 3.43Å; I81-S85 PolarHBondContact O-OG 3.42Å; I81-V180 HydrophobicContact CG2-CG2 4.08Å
82C97.1Very high94.1Very high0 Ų039 Ų390%020%0.201CC..Hα-helixtrans-65.3-43.7178.4-164.80000112K78 F79 S80 S85 Y86 V180 L184K78-C82 WeakPolarHBondContact O-CB 3.4Å; K78-C82 PolarHBondContact O-N 3.26Å; F79-C82 WeakPolarHBondContact O-CB 3.31Å; F79-C82 PolarHBondContact O-N 2.8Å; S80-C82 VanDerWaalsContact C-N 3.29Å; S80-C82 PolarHBondContact O-N 3.3Å; C82-S85 PolarHBondContact O-OG 2.86Å; C82-Y86 WeakPolarHBondContact O-CB 3.2Å; C82-Y86 PolarHBondContact O-N 2.94Å; C82-V180 HydrophobicContact CB-CB 4.25Å; C82-V180 HydrophobicContact CB-CG1 3.77Å; C82-L184 HydrophobicContact CB-CD1 4.41Å
83G97.3Very high94.5Very high0 Ų038.3 Ų38.30%020%0.198CC..Hα-helixtrans-64.5-44.6176.600000111.7F79 S80 Y86 I87 S202F79-G83 PolarHBondContact O-N 2.97Å; S80-G83 PolarHBondContact O-N 3.07Å; G83-Y86 PolarHBondContact O-N 2.97Å; G83-I87 WeakPolarHBondContact O-CG2 3.4Å; G83-I87 PolarHBondContact O-N 3.14Å; G83-S202 PolarHBondContact O-OG 3.16Å
84F98Very high94.9Very high99 Ų9934.3 Ų34.343%0.43417%0.171SC..Hα-helixtrans-59.2-51.7175.9178.5-100.3000112.4S80 Y86 I87 T88 Y205S80-F84 WeakPolarHBondContact O-CB 3.3Å; S80-F84 PolarHBondContact O-N 3.28Å; F84-Y86 VanDerWaalsContact C-N 3.32Å; F84-Y86 PolarHBondContact O-N 3.49Å; F84-I87 WeakPolarHBondContact O-CG2 3.38Å; F84-T88 VanDerWaalsContact O-CB 3.27Å; F84-T88 WeakPolarHBondContact O-CB 3.44Å; F84-T88 PolarHBondContact O-N 3.17Å; F84-T88 PolarHBondContact O-OG1 3.11Å; F84-Y205 HydrophobicContact CB-CD2 3.95Å; F84-Y205 HydrophobicContact CB-CE2 3.61Å; F84-Y205 HydrophobicContact CD2-CD1 4.15Å; F84-Y205 HydrophobicContact CD2-CD2 4.27Å; F84-Y205 HydrophobicContact CD2-CE1 4.23Å; F84-Y205 HydrophobicContact CD2-CE2 4.39Å; F84-Y205 HydrophobicContact CD2-CG 4.18Å; F84-Y205 HydrophobicContact CG-CE2 4.49Å
85S97.6Very high95Very high2 Ų230.2 Ų30.21%0.01414%0.142CC..Hα-helixtrans-62.9-40.3178.854.20000111.8I81 C82 A89 T177I81-S85 WeakPolarHBondContact O-CB 3.31Å; I81-S85 PolarHBondContact O-N 3.43Å; I81-S85 PolarHBondContact O-OG 3.42Å; C82-S85 PolarHBondContact O-OG 2.86Å; S85-A89 WeakPolarHBondContact O-CB 3.42Å; S85-A89 PolarHBondContact O-N 3.19Å; S85-T177 VanDerWaalsContact C-OG1 3.31Å; S85-T177 VanDerWaalsContact CB-OG1 3.32Å; S85-T177 WeakPolarHBondContact CB-OG1 3.25Å; S85-T177 PolarHBondContact OG-OG1 2.96Å
86Y97Very high94.9Very high25 Ų2530 Ų3010%0.09814%0.141CC..Hα-helixtrans-62-50.4178.6170.9-107.1000112.4C82 G83 F84 A89 M90 T177 M198 Q244C82-Y86 WeakPolarHBondContact O-CB 3.2Å; C82-Y86 PolarHBondContact O-N 2.94Å; G83-Y86 PolarHBondContact O-N 2.97Å; F84-Y86 VanDerWaalsContact C-N 3.32Å; F84-Y86 PolarHBondContact O-N 3.49Å; Y86-A89 PolarHBondContact O-N 3.45Å; Y86-M90 HydrophobicContact CE1-CE 4.37Å; Y86-M90 HydrophobicContact CE2-CE 3.92Å; Y86-M90 PolarHBondContact O-N 3.18Å; Y86-M90 WeakPolarHBondContact OH-CE 3.39Å; Y86-T177 WeakPolarHBondContact CA-OG1 3.34Å; Y86-T177 HydrophobicContact CD2-CG2 4.47Å; Y86-T177 PolarHBondContact N-OG1 3.44Å; Y86-T177 VanDerWaalsContact N-OG1 3.14Å; Y86-M198 VanDerWaalsContact CB-CE 3.47Å; Y86-M198 HydrophobicContact CD1-CE 4.03Å; Y86-M198 HydrophobicContact CD2-CE 3.68Å; Y86-M198 HydrophobicContact CE2-CE 4.4Å; Y86-M198 HydrophobicContact CG-CE 3.44Å; Y86-M198 VanDerWaalsContact CG-CE 3.44Å; Y86-Q244 PolarHBondContact OH-NE2 2.86Å
87I96.9Very high94.5Very high7 Ų729.2 Ų29.24%0.03614%0.138CC..Hα-helixtrans-71.4-38.8-176.7-16752.7000112L49 G83 F84 A89 M90 Y91 L206L49-I87 HydrophobicContact CB-CD1 4.07Å; L49-I87 HydrophobicContact CD1-CD1 4.1Å; L49-I87 HydrophobicContact CD2-CD1 4.41Å; L49-I87 HydrophobicContact CG-CD1 4.43Å; G83-I87 WeakPolarHBondContact O-CG2 3.4Å; G83-I87 PolarHBondContact O-N 3.14Å; F84-I87 WeakPolarHBondContact O-CG2 3.38Å; I87-A89 VanDerWaalsContact C-N 3.34Å; I87-A89 PolarHBondContact O-N 3.25Å; I87-M90 PolarHBondContact O-N 2.9Å; I87-Y91 WeakPolarHBondContact O-CB 3.48Å; I87-Y91 PolarHBondContact O-N 2.83Å; I87-L206 HydrophobicContact CD1-CD1 3.74Å; I87-L206 HydrophobicContact CD1-CD2 4.12Å; I87-L206 HydrophobicContact CD1-CG 4.15Å; I87-L206 HydrophobicContact CG1-CD1 3.8Å; I87-L206 HydrophobicContact CG1-CD2 3.72Å; I87-L206 HydrophobicContact CG1-CG 3.67Å
88T96.6Very high93.9Very high39 Ų3927.1 Ų27.124%0.23913%0.132CC..Hα-helixtrans-66.8-37.9177-50.50000110.7F84 Y91 T92 L173F84-T88 VanDerWaalsContact O-CB 3.27Å; F84-T88 WeakPolarHBondContact O-CB 3.44Å; F84-T88 PolarHBondContact O-N 3.17Å; F84-T88 PolarHBondContact O-OG1 3.11Å; T88-Y91 PolarHBondContact O-N 3.34Å; T88-T92 HydrophobicContact CG2-CG2 4.35Å; T88-T92 WeakPolarHBondContact O-CB 3.29Å; T88-T92 WeakPolarHBondContact O-CG2 3.41Å; T88-T92 PolarHBondContact O-N 3.11Å; T88-T92 PolarHBondContact O-OG1 3.25Å; T88-L173 HydrophobicContact CG2-CD1 3.51Å
89A97.1Very high93.4Very high1 Ų132.6 Ų32.61%0.00815%0.153CC..Hα-helixtrans-60.9-45.5172.400000111.2S85 Y86 I87 T92 S93 S170 L173S85-A89 WeakPolarHBondContact O-CB 3.42Å; S85-A89 PolarHBondContact O-N 3.19Å; Y86-A89 PolarHBondContact O-N 3.45Å; I87-A89 VanDerWaalsContact C-N 3.34Å; I87-A89 PolarHBondContact O-N 3.25Å; A89-T92 WeakPolarHBondContact CA-OG1 3.37Å; A89-T92 PolarHBondContact O-OG1 2.95Å; A89-T92 VanDerWaalsContact O-OG1 3.08Å; A89-S93 WeakPolarHBondContact O-CB 3.33Å; A89-S93 PolarHBondContact O-N 2.89Å; A89-S170 PolarHBondContact O-OG 3.26Å; A89-L173 HydrophobicContact CB-CB 3.67Å
90M94.6Very high92.7Very high31 Ų3133 Ų3315%0.15316%0.156CC..Hα-helixtrans-65.5-43.5-179.7-165.5173.7-75.800111.8L49 Y86 I87 S93 N94L49-M90 HydrophobicContact CD2-CB 4.3Å; L49-M90 HydrophobicContact CD2-CG 3.55Å; L49-M90 HydrophobicContact CD2-SD 3.34Å; L49-M90 WeakPolarHBondContact CD2-SD 3.2Å; Y86-M90 HydrophobicContact CE1-CE 4.37Å; Y86-M90 HydrophobicContact CE2-CE 3.92Å; Y86-M90 PolarHBondContact O-N 3.18Å; Y86-M90 WeakPolarHBondContact OH-CE 3.39Å; I87-M90 PolarHBondContact O-N 2.9Å; M90-S93 PolarHBondContact O-N 2.69Å; M90-N94 WeakPolarHBondContact O-CB 3.38Å; M90-N94 VanDerWaalsContact O-CG 3.31Å; M90-N94 PolarHBondContact O-N 3.02Å
91Y94.3Very high91.9Very high67 Ų6734.2 Ų34.226%0.26316%0.164SC..Hα-helixtrans-61.1-55.8175.1176.1-99.9000112.1F46 L49 I87 T88 S93 N94 T95F46-Y91 AromaticContact CD1-CD2 3.6Å; F46-Y91 HydrophobicContact CD1-CD2 3.6Å; F46-Y91 AromaticContact CD1-CE2 3.67Å; F46-Y91 HydrophobicContact CD1-CE2 3.67Å; F46-Y91 HydrophobicContact CD1-CG 4.37Å; F46-Y91 AromaticContact CD2-CE2 3.99Å; F46-Y91 HydrophobicContact CD2-CE2 3.99Å; F46-Y91 HydrophobicContact CE1-CD1 4.14Å; F46-Y91 AromaticContact CE1-CD2 3.28Å; F46-Y91 HydrophobicContact CE1-CD2 3.28Å; F46-Y91 HydrophobicContact CE1-CE1 4.09Å; F46-Y91 AromaticContact CE1-CE2 3.21Å; F46-Y91 HydrophobicContact CE1-CE2 3.21Å; F46-Y91 AromaticContact CE1-CG 3.76Å; F46-Y91 HydrophobicContact CE1-CG 3.76Å; F46-Y91 AromaticContact CE1-CZ 3.63Å; F46-Y91 HydrophobicContact CE2-CD2 4.45Å; F46-Y91 AromaticContact CE2-CE2 3.57Å; F46-Y91 HydrophobicContact CE2-CE2 3.57Å; F46-Y91 AromaticContact CE2-CZ 3.73Å; F46-Y91 HydrophobicContact CG-CD2 4.31Å; F46-Y91 HydrophobicContact CG-CE2 4.04Å; F46-Y91 HydrophobicContact CZ-CD1 4.35Å; F46-Y91 AromaticContact CZ-CD2 3.78Å; F46-Y91 HydrophobicContact CZ-CD2 3.78Å; F46-Y91 AromaticContact CZ-CE1 3.83Å; F46-Y91 HydrophobicContact CZ-CE1 3.83Å; F46-Y91 AromaticContact CZ-CE2 3.16Å; F46-Y91 HydrophobicContact CZ-CE2 3.16Å; F46-Y91 HydrophobicContact CZ-CG 4.32Å; F46-Y91 AromaticContact CZ-CZ 3.18Å; F46-Y91 WeakPolarHBondContact CZ-OH 3.07Å; L49-Y91 HydrophobicContact CD1-CD2 4.17Å; I87-Y91 WeakPolarHBondContact O-CB 3.48Å; I87-Y91 PolarHBondContact O-N 2.83Å; T88-Y91 PolarHBondContact O-N 3.34Å; Y91-S93 PolarHBondContact O-N 2.7Å; Y91-N94 PolarHBondContact O-N 3.27Å; Y91-T95 WeakPolarHBondContact O-CB 3.22Å; Y91-T95 PolarHBondContact O-N 3.44Å; Y91-T95 PolarHBondContact O-OG1 2.96Å; Y91-T95 VanDerWaalsContact O-OG1 3.1Å
92T93.9Very high90.8Very high11 Ų1135.1 Ų35.17%0.06716%0.163CC..Hα-helixtrans-59.8-34.9179.550.90000112.1T88 A89 S96 L166 S170T88-T92 HydrophobicContact CG2-CG2 4.35Å; T88-T92 WeakPolarHBondContact O-CB 3.29Å; T88-T92 WeakPolarHBondContact O-CG2 3.41Å; T88-T92 PolarHBondContact O-N 3.11Å; T88-T92 PolarHBondContact O-OG1 3.25Å; A89-T92 WeakPolarHBondContact CA-OG1 3.37Å; A89-T92 PolarHBondContact O-OG1 2.95Å; A89-T92 VanDerWaalsContact O-OG1 3.08Å; T92-S96 WeakPolarHBondContact O-CB 3.34Å; T92-S96 PolarHBondContact O-N 3.37Å; T92-L166 HydrophobicContact CG2-CD2 4.18Å; T92-S170 WeakPolarHBondContact OG1-CA 3.25Å; T92-S170 WeakPolarHBondContact OG1-CB 3.44Å; T92-S170 PolarHBondContact OG1-OG 3.37Å
93S92.7Very high89.8Confident16 Ų1636.9 Ų36.911%0.11217%0.174CC..Hα-helixtrans-62-53.4172-165.20000110.4A89 M90 Y91 T95 S96 Q105 K109 S170A89-S93 WeakPolarHBondContact O-CB 3.33Å; A89-S93 PolarHBondContact O-N 2.89Å; M90-S93 PolarHBondContact O-N 2.69Å; Y91-S93 PolarHBondContact O-N 2.7Å; S93-T95 PolarHBondContact O-N 2.88Å; S93-S96 PolarHBondContact O-N 3.5Å; S93-S96 PolarHBondContact O-OG 3.31Å; S93-Q105 PolarHBondContact O-NE2 3.22Å; S93-Q105 PolarHBondContact OG-NE2 3.34Å; S93-K109 WeakPolarHBondContact OG-CE 3.36Å; S93-S170 WeakPolarHBondContact CB-OG 3.33Å; S93-S170 PolarHBondContact N-OG 2.71Å
94N89.2Confident89.1Confident10 Ų1038.9 Ų38.95%0.05319%0.187CC..Hα-helixtrans-65.2-41.2-176.7-70.5-13000111.8Q27 Y45 M90 Y91 S96 L97Q27-N94 PolarHBondContact NE2-OD1 3Å; Y45-N94 HydrophobicContact CD1-CB 3.89Å; Y45-N94 HydrophobicContact CE1-CB 4.2Å; M90-N94 WeakPolarHBondContact O-CB 3.38Å; M90-N94 VanDerWaalsContact O-CG 3.31Å; M90-N94 PolarHBondContact O-N 3.02Å; Y91-N94 PolarHBondContact O-N 3.27Å; N94-S96 VanDerWaalsContact C-N 3.3Å; N94-S96 PolarHBondContact O-N 2.84Å; N94-L97 WeakPolarHBondContact O-CB 3.45Å; N94-L97 PolarHBondContact O-N 2.86Å
95T87.9Confident88.5Confident11 Ų1134.7 Ų34.77%0.06717%0.168CC..Hα-helixtrans-65.2-31.7176.4-57.20000112.4Y91 S93 L97 K98 Y99 L166Y91-T95 WeakPolarHBondContact O-CB 3.22Å; Y91-T95 PolarHBondContact O-N 3.44Å; Y91-T95 PolarHBondContact O-OG1 2.96Å; Y91-T95 VanDerWaalsContact O-OG1 3.1Å; S93-T95 PolarHBondContact O-N 2.88Å; T95-L97 PolarHBondContact O-N 3.49Å; T95-K98 WeakPolarHBondContact O-CB 3.43Å; T95-K98 PolarHBondContact O-N 3.08Å; T95-K98 VanDerWaalsContact O-N 3.1Å; T95-Y99 HydrophobicContact CG2-CE2 4.17Å; T95-Y99 WeakPolarHBondContact O-CD2 3.34Å; T95-L166 HydrophobicContact CG2-CD1 3.85Å
96S89Confident87.8Confident0 Ų034.9 Ų34.90%017%0.169CC..Hα-helixtrans-59.2-29.2176.170.80000112.7T92 S93 N94 K98 Y99 V100 Q105T92-S96 WeakPolarHBondContact O-CB 3.34Å; T92-S96 PolarHBondContact O-N 3.37Å; S93-S96 PolarHBondContact O-N 3.5Å; S93-S96 PolarHBondContact O-OG 3.31Å; N94-S96 VanDerWaalsContact C-N 3.3Å; N94-S96 PolarHBondContact O-N 2.84Å; S96-K98 PolarHBondContact O-N 3.13Å; S96-K98 VanDerWaalsContact O-N 3.11Å; S96-Y99 PolarHBondContact O-N 3.42Å; S96-V100 WeakPolarHBondContact O-CG2 3.47Å; S96-V100 PolarHBondContact O-N 3.03Å; S96-Q105 PolarHBondContact OG-NE2 3.04Å
97L84.6Confident87.2Confident44 Ų4435.3 Ų35.323%0.2317%0.173CC..THydrogen-bonded Turntrans-63.6-16.1177.8-73.6166.6000114.2N94 T95 Y99 V100 Y102 Q105N94-L97 WeakPolarHBondContact O-CB 3.45Å; N94-L97 PolarHBondContact O-N 2.86Å; T95-L97 PolarHBondContact O-N 3.49Å; L97-Y99 VanDerWaalsContact C-N 3.32Å; L97-V100 CarbonylContact C-O 3.58Å; L97-Y102 HydrophobicContact CD2-CD2 3.79Å; L97-Y102 HydrophobicContact CD2-CG 4.38Å; L97-Q105 HydrophobicContact CD2-CB 3.93Å; L97-Q105 HydrophobicContact CD2-CG 4.17Å; L97-Q105 VanDerWaalsContact CD2-OE1 3.3Å; L97-Q105 HydrophobicContact CG-CG 4.47Å
98K82.5Confident86.8Confident95 Ų9535.5 Ų35.541%0.41318%0.177SC..THydrogen-bonded Turntrans-73.4-27172.3-62.8-176.1176.3-171.50112.5D43 T95 S96D43-K98 WeakPolarHBondContact OD1-CE 3.21Å; D43-K98 IonicContact OD1-NZ 3.35Å; D43-K98 PolarHBondContact OD1-NZ 2.88Å; D43-K98 IonicContact OD2-NZ 2.71Å; D43-K98 PolarHBondContact OD2-NZ 3.49Å; T95-K98 WeakPolarHBondContact O-CB 3.43Å; T95-K98 PolarHBondContact O-N 3.08Å; T95-K98 VanDerWaalsContact O-N 3.1Å; S96-K98 PolarHBondContact O-N 3.13Å; S96-K98 VanDerWaalsContact O-N 3.11Å
99Y84Confident86.6Confident131 Ų13134.3 Ų34.351%0.51417%0.168SC..THydrogen-bonded Turntrans-113.3-29.9-170.4-58.8-78.7000112.7T95 S96 L97 F162 G163 L166T95-Y99 HydrophobicContact CG2-CE2 4.17Å; T95-Y99 WeakPolarHBondContact O-CD2 3.34Å; S96-Y99 PolarHBondContact O-N 3.42Å; L97-Y99 VanDerWaalsContact C-N 3.32Å; Y99-F162 HydrophobicContact CD1-CD1 4.3Å; Y99-F162 AromaticContact CD2-CD1 3.93Å; Y99-F162 HydrophobicContact CD2-CD1 3.93Å; Y99-F162 HydrophobicContact CD2-CE1 4.44Å; Y99-F162 AromaticContact CE1-CD1 3.96Å; Y99-F162 HydrophobicContact CE1-CD1 3.96Å; Y99-F162 AromaticContact CE2-CD1 3.56Å; Y99-F162 HydrophobicContact CE2-CD1 3.56Å; Y99-F162 AromaticContact CE2-CE1 3.75Å; Y99-F162 HydrophobicContact CE2-CE1 3.75Å; Y99-F162 HydrophobicContact CG-CD1 4.28Å; Y99-F162 AromaticContact CZ-CD1 3.57Å; Y99-F162 AromaticContact CZ-CE1 3.87Å; Y99-G163 VanDerWaalsContact CB-CA 3.45Å; Y99-L166 HydrophobicContact CD2-CD1 3.95Å; Y99-L166 HydrophobicContact CE2-CD1 4.01Å
100V81.4Confident86.2Confident8 Ų834.3 Ų34.35%0.04817%0.169CC..SBendtrans-114.6146.7174.9-50.50000110.3S96 L97 T104 Q105 E164S96-V100 WeakPolarHBondContact O-CG2 3.47Å; S96-V100 PolarHBondContact O-N 3.03Å; L97-V100 CarbonylContact C-O 3.58Å; V100-T104 HydrophobicContact CB-CG2 4.16Å; V100-Q105 HydrophobicContact CG2-CB 3.86Å; V100-Q105 HydrophobicContact CG2-CG 4.37Å; V100-E164 HydrophobicContact CG1-CG 4.46Å
101S80Confident86.2Confident38 Ų3836.3 Ų36.327%0.26618%0.179SC..  trans-62.4151.4174.474.40000111.1P103 T104 Q105S101-P103 VanDerWaalsContact C-N 3.34Å; S101-T104 PolarHBondContact O-N 3.15Å; S101-T104 VanDerWaalsContact O-N 3.09Å; S101-T104 WeakPolarHBondContact OG-CB 3.17Å; S101-T104 PolarHBondContact OG-N 2.9Å; S101-T104 PolarHBondContact OG-OG1 2.98Å; S101-Q105 PolarHBondContact O-N 3.33Å
102Y74.7Confident86.3Confident103 Ų10335.4 Ų35.440%0.40418%0.177SC..Hα-helixtrans-54.1-43.5177.4178.9-95.3000113L97 T104 Q105 V106L97-Y102 HydrophobicContact CD2-CD2 3.79Å; L97-Y102 HydrophobicContact CD2-CG 4.38Å; Y102-T104 PolarHBondContact O-N 3.28Å; Y102-Q105 PolarHBondContact O-N 3.02Å; Y102-V106 HydrophobicContact CD1-CG2 4.14Å; Y102-V106 HydrophobicContact CE1-CG2 3.76Å; Y102-V106 HydrophobicContact CE2-CG2 4.31Å; Y102-V106 VanDerWaalsContact O-CG2 3.3Å; Y102-V106 WeakPolarHBondContact O-CG2 3.47Å; Y102-V106 PolarHBondContact O-N 3.02Å
103P75.8Confident86.4Confident36 Ų3634.9 Ų34.923%0.23417%0.173CC..Hα-helixtrans-58.6-45.7172.7-25.836.2000113.7S101 Q105 V106 I107S101-P103 VanDerWaalsContact C-N 3.34Å; P103-Q105 VanDerWaalsContact C-N 3.33Å; P103-Q105 PolarHBondContact O-N 2.95Å; P103-V106 WeakPolarHBondContact O-CB 3.22Å; P103-V106 PolarHBondContact O-N 2.87Å; P103-V106 VanDerWaalsContact O-N 3.12Å; P103-I107 WeakPolarHBondContact O-CG1 3.35Å; P103-I107 PolarHBondContact O-N 2.98Å
104T82.5Confident86.6Confident43 Ų4336.5 Ų36.526%0.26418%0.18SC..Hα-helixtrans-61-42.3177.4-61.80000111.5V100 S101 Y102 V106 I107 G108V100-T104 HydrophobicContact CB-CG2 4.16Å; S101-T104 PolarHBondContact O-N 3.15Å; S101-T104 VanDerWaalsContact O-N 3.09Å; S101-T104 WeakPolarHBondContact OG-CB 3.17Å; S101-T104 PolarHBondContact OG-N 2.9Å; S101-T104 PolarHBondContact OG-OG1 2.98Å; Y102-T104 PolarHBondContact O-N 3.28Å; T104-V106 VanDerWaalsContact C-N 3.33Å; T104-V106 PolarHBondContact O-N 2.97Å; T104-I107 PolarHBondContact O-N 3.35Å; T104-G108 PolarHBondContact O-N 2.67Å
105Q85.3Confident86.9Confident10 Ų1036.8 Ų36.85%0.04718%0.183CC..Hα-helixtrans-61.6-41.5174.4-163.4-14936.600111.9S93 S96 L97 V100 S101 Y102 P103 G108 K109 L167S93-Q105 PolarHBondContact O-NE2 3.22Å; S93-Q105 PolarHBondContact OG-NE2 3.34Å; S96-Q105 PolarHBondContact OG-NE2 3.04Å; L97-Q105 HydrophobicContact CD2-CB 3.93Å; L97-Q105 HydrophobicContact CD2-CG 4.17Å; L97-Q105 VanDerWaalsContact CD2-OE1 3.3Å; L97-Q105 HydrophobicContact CG-CG 4.47Å; V100-Q105 HydrophobicContact CG2-CB 3.86Å; V100-Q105 HydrophobicContact CG2-CG 4.37Å; S101-Q105 PolarHBondContact O-N 3.33Å; Y102-Q105 PolarHBondContact O-N 3.02Å; P103-Q105 VanDerWaalsContact C-N 3.33Å; P103-Q105 PolarHBondContact O-N 2.95Å; Q105-G108 PolarHBondContact O-N 3.45Å; Q105-K109 VanDerWaalsContact O-CB 3.31Å; Q105-K109 WeakPolarHBondContact O-CB 3.49Å; Q105-K109 WeakPolarHBondContact O-CG 3.46Å; Q105-K109 PolarHBondContact O-N 3.27Å; Q105-L167 HydrophobicContact CG-CD1 3.91Å
106V83.1Confident87.4Confident7 Ų736.4 Ų36.44%0.04218%0.18CC..Hα-helixtrans-63.5-42.7177.6166.70000111.1Y102 P103 T104 K109 S110 M147 K267Y102-V106 HydrophobicContact CD1-CG2 4.14Å; Y102-V106 HydrophobicContact CE1-CG2 3.76Å; Y102-V106 HydrophobicContact CE2-CG2 4.31Å; Y102-V106 VanDerWaalsContact O-CG2 3.3Å; Y102-V106 WeakPolarHBondContact O-CG2 3.47Å; Y102-V106 PolarHBondContact O-N 3.02Å; P103-V106 WeakPolarHBondContact O-CB 3.22Å; P103-V106 PolarHBondContact O-N 2.87Å; P103-V106 VanDerWaalsContact O-N 3.12Å; T104-V106 VanDerWaalsContact C-N 3.33Å; T104-V106 PolarHBondContact O-N 2.97Å; V106-K109 PolarHBondContact O-N 3.25Å; V106-S110 PolarHBondContact O-N 2.67Å; V106-M147 HydrophobicContact CG1-CE 3.85Å; V106-M147 HydrophobicContact CG1-CG 4.24Å; V106-M147 HydrophobicContact CG1-SD 3.97Å; V106-K267 HydrophobicContact CG1-CB 4.47Å; V106-K267 HydrophobicContact CG1-CD 4.09Å; V106-K267 HydrophobicContact CG2-CD 4.45Å
107I85.4Confident87.7Confident33 Ų3336.7 Ų36.717%0.16918%0.182CC..Hα-helixtrans-60.4-53.1173.7-66.1161.8000110.2P103 T104 K109 S110 A144 M147P103-I107 WeakPolarHBondContact O-CG1 3.35Å; P103-I107 PolarHBondContact O-N 2.98Å; T104-I107 PolarHBondContact O-N 3.35Å; I107-K109 VanDerWaalsContact C-N 3.28Å; I107-K109 PolarHBondContact O-N 2.98Å; I107-S110 WeakPolarHBondContact O-CB 3.43Å; I107-S110 PolarHBondContact O-N 3.01Å; I107-S110 PolarHBondContact O-OG 2.83Å; I107-A144 HydrophobicContact CG2-CB 4.4Å; I107-M147 HydrophobicContact CD1-CB 4.17Å; I107-M147 HydrophobicContact CG1-CB 3.37Å; I107-M147 HydrophobicContact CG1-CG 4.45Å
108G88.8Confident88.3Confident12 Ų1238.8 Ų38.812%0.12419%0.193CC..Hα-helixtrans-61.8-38.2-179.800000112.1T104 Q105 S110 I111 L171T104-G108 PolarHBondContact O-N 2.67Å; Q105-G108 PolarHBondContact O-N 3.45Å; G108-S110 PolarHBondContact O-N 2.88Å; G108-I111 WeakPolarHBondContact O-CB 3.36Å; G108-I111 PolarHBondContact O-N 3.5Å; G108-L171 WeakPolarHBondContact O-CD1 3.48Å
109K91.2Very high89Confident13 Ų1335.9 Ų35.96%0.05718%0.182CC..Hα-helixtrans-67.3-17.6174.1-76.3-59.1-168.1179.70114.3S93 Q105 V106 I107 I111 K112 L167 S170 L171 D174S93-K109 WeakPolarHBondContact OG-CE 3.36Å; Q105-K109 VanDerWaalsContact O-CB 3.31Å; Q105-K109 WeakPolarHBondContact O-CB 3.49Å; Q105-K109 WeakPolarHBondContact O-CG 3.46Å; Q105-K109 PolarHBondContact O-N 3.27Å; V106-K109 PolarHBondContact O-N 3.25Å; I107-K109 VanDerWaalsContact C-N 3.28Å; I107-K109 PolarHBondContact O-N 2.98Å; K109-I111 PolarHBondContact O-N 3.19Å; K109-K112 WeakPolarHBondContact O-CB 3.47Å; K109-K112 PolarHBondContact O-N 2.88Å; K109-L167 HydrophobicContact CD-CD1 4.17Å; K109-L167 HydrophobicContact CG-CD1 4.03Å; K109-S170 PolarHBondContact NZ-OG 3.46Å; K109-L171 HydrophobicContact CD-CD2 3.91Å; K109-D174 IonicContact NZ-OD2 2.84Å; K109-D174 PolarHBondContact NZ-OD2 3.16Å
110S90.4Very high89.6Confident2 Ų229.7 Ų29.71%0.01416%0.157CC..Hα-helixtrans-72.3-16.4175.878.80000113.3V106 I107 G108 K112 P113 S140 A144V106-S110 PolarHBondContact O-N 2.67Å; I107-S110 WeakPolarHBondContact O-CB 3.43Å; I107-S110 PolarHBondContact O-N 3.01Å; I107-S110 PolarHBondContact O-OG 2.83Å; G108-S110 PolarHBondContact O-N 2.88Å; S110-K112 VanDerWaalsContact C-N 3.28Å; S110-P113 VanDerWaalsContact O-CD 3.3Å; S110-P113 WeakPolarHBondContact O-CD 3.1Å; S110-S140 WeakPolarHBondContact O-CB 3.33Å; S110-S140 PolarHBondContact O-OG 3.13Å; S110-A144 PolarHBondContact OG-N 3.32Å
111I93Very high90.4Very high72 Ų7231.4 Ų31.437%0.36917%0.168SC..THydrogen-bonded Turntrans-77.4-16.6174.5-62.1172.8000111.3G108 K109 P113 I114 P115G108-I111 WeakPolarHBondContact O-CB 3.36Å; G108-I111 PolarHBondContact O-N 3.5Å; K109-I111 PolarHBondContact O-N 3.19Å; I111-P113 VanDerWaalsContact C-N 3.31Å; I111-P113 WeakPolarHBondContact O-CD 3.41Å; I111-I114 HydrophobicContact CG2-CB 4.44Å; I111-I114 HydrophobicContact CG2-CD1 4.38Å; I111-I114 WeakPolarHBondContact O-CB 3.45Å; I111-I114 PolarHBondContact O-N 3.46Å; I111-P115 WeakPolarHBondContact O-CD 3.18Å
112K96Very high91.1Very high49 Ų4935.5 Ų35.521%0.21319%0.186CC..THydrogen-bonded Turntrans-42.2-41.5-177-174.4-175.4167.3144.70115.9K109 S110 I114 P115 V116 L171 D174 S260K109-K112 WeakPolarHBondContact O-CB 3.47Å; K109-K112 PolarHBondContact O-N 2.88Å; S110-K112 VanDerWaalsContact C-N 3.28Å; K112-I114 PolarHBondContact O-N 3.21Å; K112-P115 WeakPolarHBondContact O-CD 3.43Å; K112-V116 HydrophobicContact CG-CG2 4.09Å; K112-V116 VanDerWaalsContact O-CG2 3.29Å; K112-V116 WeakPolarHBondContact O-CG2 3.45Å; K112-V116 PolarHBondContact O-N 3.02Å; K112-V116 VanDerWaalsContact O-N 3.13Å; K112-L171 HydrophobicContact CB-CD2 3.76Å; K112-L171 HydrophobicContact CG-CD2 4.35Å; K112-D174 HydrophobicContact CD-CB 4.29Å; K112-D174 WeakPolarHBondContact CD-OD2 3.39Å; K112-D174 HydrophobicContact CG-CB 4.13Å; K112-D174 IonicContact NZ-OD1 2.79Å; K112-D174 PolarHBondContact NZ-OD1 2.91Å; K112-D174 IonicContact NZ-OD2 3.32Å; K112-D174 PolarHBondContact NZ-OD2 3.38Å; K112-S260 WeakPolarHBondContact CG-OG 3.36Å
113P96.5Very high92.1Very high0 Ų034.6 Ų34.60%019%0.187CC..Hα-helixtrans-55.7-31.6176.6-26.736.1000114.7S110 I111 M117 V136 S140 L257 S260 I261 T264S110-P113 VanDerWaalsContact O-CD 3.3Å; S110-P113 WeakPolarHBondContact O-CD 3.1Å; I111-P113 VanDerWaalsContact C-N 3.31Å; I111-P113 WeakPolarHBondContact O-CD 3.41Å; P113-M117 WeakPolarHBondContact O-CB 3.41Å; P113-M117 PolarHBondContact O-N 3.29Å; P113-V136 HydrophobicContact CB-CG1 3.58Å; P113-S140 WeakPolarHBondContact CD-OG 3.36Å; P113-L257 HydrophobicContact CB-CD1 4.38Å; P113-L257 WeakPolarHBondContact O-CD1 3.48Å; P113-S260 WeakPolarHBondContact CA-OG 3.44Å; P113-I261 HydrophobicContact CB-CG1 4.21Å; P113-I261 HydrophobicContact CG-CG1 4.43Å; P113-T264 HydrophobicContact CG-CG2 4.36Å
114I96.4Very high93Very high49 Ų4932.9 Ų32.925%0.25118%0.176SC..Hα-helixtrans-71.5-56-178.1-62.5171.3000111.2I111 K112 V116 M117 L118 V136 T137I111-I114 HydrophobicContact CG2-CB 4.44Å; I111-I114 HydrophobicContact CG2-CD1 4.38Å; I111-I114 WeakPolarHBondContact O-CB 3.45Å; I111-I114 PolarHBondContact O-N 3.46Å; K112-I114 PolarHBondContact O-N 3.21Å; I114-V116 VanDerWaalsContact C-N 3.29Å; I114-V116 PolarHBondContact O-N 3.42Å; I114-M117 WeakPolarHBondContact O-CB 3.47Å; I114-M117 PolarHBondContact O-N 3.42Å; I114-M117 VanDerWaalsContact O-N 3.16Å; I114-L118 HydrophobicContact CG2-CD1 4.08Å; I114-L118 HydrophobicContact CG2-CG 4.49Å; I114-L118 WeakPolarHBondContact O-CG 2.88Å; I114-L118 PolarHBondContact O-N 2.96Å; I114-V136 HydrophobicContact CG1-CG1 4.49Å; I114-T137 HydrophobicContact CD1-CG2 4.49Å
115P96.5Very high93.5Very high17 Ų1741 Ų4111%0.1120%0.202CC..Hα-helixtrans-55.1-42.7172.2-28.535.7000113I111 K112 M117 L118 L119 L171I111-P115 WeakPolarHBondContact O-CD 3.18Å; K112-P115 WeakPolarHBondContact O-CD 3.43Å; P115-M117 VanDerWaalsContact C-N 3.34Å; P115-M117 PolarHBondContact O-N 3.45Å; P115-L118 PolarHBondContact O-N 3.4Å; P115-L119 WeakPolarHBondContact O-CB 3.44Å; P115-L119 WeakPolarHBondContact O-CD2 3.49Å; P115-L119 PolarHBondContact O-N 2.85Å; P115-L171 HydrophobicContact CG-CB 4.37Å
116V97.4Very high93.9Very high3 Ų345 Ų452%0.01822%0.217CC..Hα-helixtrans-58.5-46.7176.9171.90000111K112 I114 S120 P256 L257K112-V116 HydrophobicContact CG-CG2 4.09Å; K112-V116 VanDerWaalsContact O-CG2 3.29Å; K112-V116 WeakPolarHBondContact O-CG2 3.45Å; K112-V116 PolarHBondContact O-N 3.02Å; K112-V116 VanDerWaalsContact O-N 3.13Å; I114-V116 VanDerWaalsContact C-N 3.29Å; I114-V116 PolarHBondContact O-N 3.42Å; V116-S120 VanDerWaalsContact O-CB 3.28Å; V116-S120 WeakPolarHBondContact O-CB 3.3Å; V116-S120 PolarHBondContact O-N 3.38Å; V116-S120 PolarHBondContact O-OG 3.39Å; V116-P256 HydrophobicContact CG1-CB 4.37Å; V116-L257 HydrophobicContact CG1-CB 4.38Å
117M97.1Very high94.3Very high5 Ų554.8 Ų54.83%0.02525%0.253CS..Hα-helixtrans-59.9-50.5176179.5-179.9-76.300112.1P113 I114 P115 L119 S120 V121 Y128 K132 Y133 V136 L257P113-M117 WeakPolarHBondContact O-CB 3.41Å; P113-M117 PolarHBondContact O-N 3.29Å; I114-M117 WeakPolarHBondContact O-CB 3.47Å; I114-M117 PolarHBondContact O-N 3.42Å; I114-M117 VanDerWaalsContact O-N 3.16Å; P115-M117 VanDerWaalsContact C-N 3.34Å; P115-M117 PolarHBondContact O-N 3.45Å; M117-L119 PolarHBondContact O-N 3.42Å; M117-S120 PolarHBondContact O-N 2.96Å; M117-V121 VanDerWaalsContact O-CG2 3.26Å; M117-V121 WeakPolarHBondContact O-CG2 3.47Å; M117-V121 PolarHBondContact O-N 2.98Å; M117-Y128 HydrophobicContact CG-CD2 4.02Å; M117-Y128 HydrophobicContact CG-CE2 4.07Å; M117-K132 HydrophobicContact CE-CG 3.68Å; M117-Y133 HydrophobicContact CG-CD1 4.25Å; M117-Y133 HydrophobicContact CG-CE1 4Å; M117-Y133 HydrophobicContact SD-CD1 3.23Å; M117-Y133 WeakPolarHBondContact SD-CD1 3.02Å; M117-Y133 HydrophobicContact SD-CE1 3.56Å; M117-Y133 VanDerWaalsContact SD-CE1 3.56Å; M117-Y133 HydrophobicContact SD-CG 3.8Å; M117-V136 HydrophobicContact CE-CB 3.51Å; M117-V136 HydrophobicContact CE-CG1 3.87Å; M117-V136 HydrophobicContact CE-CG2 3.33Å; M117-L257 HydrophobicContact CB-CD1 3.96Å; M117-L257 HydrophobicContact CB-CD2 4.35Å; M117-L257 HydrophobicContact CE-CD1 4.21Å; M117-L257 HydrophobicContact CE-CD2 3.47Å; M117-L257 VanDerWaalsContact CE-CD2 3.47Å; M117-L257 HydrophobicContact CE-CG 4.46Å; M117-L257 HydrophobicContact CG-CD2 4.36Å
118L97.2Very high94.6Very high89 Ų8954.4 Ų54.447%0.46625%0.25SC..Hα-helixtrans-61.2-46.3-177.2-69.1175.2000111.4I114 P115 V121 L122I114-L118 HydrophobicContact CG2-CD1 4.08Å; I114-L118 HydrophobicContact CG2-CG 4.49Å; I114-L118 WeakPolarHBondContact O-CG 2.88Å; I114-L118 PolarHBondContact O-N 2.96Å; P115-L118 PolarHBondContact O-N 3.4Å; L118-V121 WeakPolarHBondContact O-CB 3.44Å; L118-V121 PolarHBondContact O-N 3.41Å; L118-V121 VanDerWaalsContact O-N 3.15Å; L118-L122 WeakPolarHBondContact O-CG 3.27Å; L118-L122 PolarHBondContact O-N 2.72Å
119L97.1Very high94.9Very high34 Ų3455.4 Ų55.418%0.17825%0.254CS..Hα-helixtrans-73.3-29.5-179.2-80.3-60.7000112P115 M117 V121 L122 L123 G175P115-L119 WeakPolarHBondContact O-CB 3.44Å; P115-L119 WeakPolarHBondContact O-CD2 3.49Å; P115-L119 PolarHBondContact O-N 2.85Å; M117-L119 PolarHBondContact O-N 3.42Å; L119-V121 VanDerWaalsContact C-N 3.32Å; L119-L122 PolarHBondContact O-N 3.36Å; L119-L123 HydrophobicContact CB-CD1 4.46Å; L119-L123 HydrophobicContact CD1-CD1 4.25Å; L119-L123 HydrophobicContact CD1-CG 4.37Å; L119-L123 VanDerWaalsContact O-CB 3.27Å; L119-L123 WeakPolarHBondContact O-CB 3.19Å; L119-L123 WeakPolarHBondContact O-CG 3.39Å; L119-L123 PolarHBondContact O-N 3.05Å; L119-G175 VanDerWaalsContact CB-C 3.47Å; L119-G175 WeakPolarHBondContact CB-O 3.48Å
120S96.2Very high94.9Very high0 Ų061.3 Ų61.30%029%0.286CS..Hα-helixtrans-64.7-34.3167.4-66.30000112.7V116 M117 A124 R125 R126 G178V116-S120 VanDerWaalsContact O-CB 3.28Å; V116-S120 WeakPolarHBondContact O-CB 3.3Å; V116-S120 PolarHBondContact O-N 3.38Å; V116-S120 PolarHBondContact O-OG 3.39Å; M117-S120 PolarHBondContact O-N 2.96Å; S120-A124 CarbonylContact O-C 3.53Å; S120-A124 WeakPolarHBondContact O-CB 3.34Å; S120-A124 PolarHBondContact O-N 3.48Å; S120-R125 PolarHBondContact O-N 3.07Å; S120-R126 WeakPolarHBondContact O-CB 3.31Å; S120-R126 PolarHBondContact O-N 3.17Å; S120-G178 PolarHBondContact OG-O 2.82Å
121V96.7Very high95.1Very high45 Ų4566.1 Ų66.127%0.27331%0.308SS..Hα-helixtrans-69.9-43.7174175.80000110.8M117 L118 L119 R125 R126 Y128 Y133M117-V121 VanDerWaalsContact O-CG2 3.26Å; M117-V121 WeakPolarHBondContact O-CG2 3.47Å; M117-V121 PolarHBondContact O-N 2.98Å; L118-V121 WeakPolarHBondContact O-CB 3.44Å; L118-V121 PolarHBondContact O-N 3.41Å; L118-V121 VanDerWaalsContact O-N 3.15Å; L119-V121 VanDerWaalsContact C-N 3.32Å; V121-R125 WeakPolarHBondContact O-CA 3.22Å; V121-R125 PolarHBondContact O-N 3.32Å; V121-R126 WeakPolarHBondContact CG2-O 3.48Å; V121-Y128 HydrophobicContact CG2-CD2 3.6Å; V121-Y128 HydrophobicContact CG2-CE2 3.82Å; V121-Y133 HydrophobicContact CG2-CE1 4.39Å; V121-Y133 WeakPolarHBondContact CG2-OH 3.12Å
122L96.5Very high95.1Very high124 Ų12463.4 Ų63.465%0.64929%0.293SS*.Hα-helixtrans-75.1-51.6-176.4-65.9175.1000112.8L118 L119L118-L122 WeakPolarHBondContact O-CG 3.27Å; L118-L122 PolarHBondContact O-N 2.72Å; L119-L122 PolarHBondContact O-N 3.36Å
123L95.1Very high95.1Very high83 Ų8364.2 Ų64.244%0.43530%0.296SS..Hα-helixtrans-80.9-47.9-173.7-61.1177.3000112.2L119 V176 V180L119-L123 HydrophobicContact CB-CD1 4.46Å; L119-L123 HydrophobicContact CD1-CD1 4.25Å; L119-L123 HydrophobicContact CD1-CG 4.37Å; L119-L123 VanDerWaalsContact O-CB 3.27Å; L119-L123 WeakPolarHBondContact O-CB 3.19Å; L119-L123 WeakPolarHBondContact O-CG 3.39Å; L119-L123 PolarHBondContact O-N 3.05Å; L123-V176 HydrophobicContact CD1-CG1 4.3Å; L123-V180 HydrophobicContact CD1-CG2 4.46Å
124A93.9Very high95.1Very high0 Ų069.5 Ų69.50%032%0.322CS..SBendtrans-91.73-179.200000113.2S120 R126 G179 E182 E183 K186S120-A124 CarbonylContact O-C 3.53Å; S120-A124 WeakPolarHBondContact O-CB 3.34Å; S120-A124 PolarHBondContact O-N 3.48Å; A124-R126 PolarHBondContact O-N 3.09Å; A124-G179 WeakPolarHBondContact CB-O 3.31Å; A124-E182 HydrophobicContact CB-CB 3.83Å; A124-E182 HydrophobicContact CB-CG 3.77Å; A124-E183 HydrophobicContact CB-CB 3.91Å; A124-K186 WeakPolarHBondContact O-CE 3.45Å; A124-K186 PolarHBondContact O-NZ 3.21Å
125R94.3Very high95.1Very high213 Ų21368.1 Ų68.180%0.80432%0.315SS*.  trans50.631.1-176.7-59.4-176.8-179.6-178.80.1112.5S120 V121S120-R125 PolarHBondContact O-N 3.07Å; V121-R125 WeakPolarHBondContact O-CA 3.22Å; V121-R125 PolarHBondContact O-N 3.32Å
126R92.1Very high95Very high96 Ų9667.3 Ų67.336%0.36231%0.309SS..  trans-72.9129.6-178-176.761.6-176.2-154.511.2109.1S120 V121 A124 Y128 E182S120-R126 WeakPolarHBondContact O-CB 3.31Å; S120-R126 PolarHBondContact O-N 3.17Å; V121-R126 WeakPolarHBondContact CG2-O 3.48Å; A124-R126 PolarHBondContact O-N 3.09Å; R126-Y128 HydrophobicContact CB-CE2 4.08Å; R126-Y128 HydrophobicContact CG-CD1 4.41Å; R126-Y128 HydrophobicContact CG-CD2 4.29Å; R126-Y128 HydrophobicContact CG-CE1 3.8Å; R126-Y128 HydrophobicContact CG-CE2 3.66Å; R126-Y128 WeakPolarHBondContact CG-OH 3.5Å; R126-E182 HydrophobicContact CB-CG 4.1Å; R126-E182 VanDerWaalsContact CD-OE1 3.26Å; R126-E182 WeakPolarHBondContact CD-OE1 3.48Å; R126-E182 HydrophobicContact CG-CG 4.23Å; R126-E182 IonicContact CZ-OE1 2.71Å; R126-E182 IonicContact NE-OE1 3.26Å; R126-E182 IonicContact NH1-OE1 3.12Å; R126-E182 PolarHBondContact NH1-OE1 3.18Å; R126-E182 VanDerWaalsContact NH1-OE1 3.11Å
127R92.5Very high94.9Very high212 Ų21270.5 Ų70.580%0.833%0.329SS*.  trans-97.4122.4174.7-65.1-171.2179.8-171.40.1110.3T306R127-T306 PolarHBondContact O-OG1 3.19Å
128Y92.2Very high94.9Very high24 Ų2472.4 Ų72.49%0.09434%0.338CS..  trans-107.1146.5171.1-60.2-73.9000109.9M117 V121 R126 K132 L257M117-Y128 HydrophobicContact CG-CD2 4.02Å; M117-Y128 HydrophobicContact CG-CE2 4.07Å; V121-Y128 HydrophobicContact CG2-CD2 3.6Å; V121-Y128 HydrophobicContact CG2-CE2 3.82Å; R126-Y128 HydrophobicContact CB-CE2 4.08Å; R126-Y128 HydrophobicContact CG-CD1 4.41Å; R126-Y128 HydrophobicContact CG-CD2 4.29Å; R126-Y128 HydrophobicContact CG-CE1 3.8Å; R126-Y128 HydrophobicContact CG-CE2 3.66Å; R126-Y128 WeakPolarHBondContact CG-OH 3.5Å; Y128-K132 HydrophobicContact CD1-CD 3.8Å; Y128-K132 HydrophobicContact CD1-CG 4.2Å; Y128-K132 HydrophobicContact CG-CD 4.45Å; Y128-K132 HydrophobicContact CG-CG 4.4Å; Y128-L257 HydrophobicContact CD1-CD2 4.33Å; Y128-L257 HydrophobicContact CE1-CD2 3.77Å; Y128-L257 HydrophobicContact CE2-CD2 4.42Å
129P93.5Very high94.7Very high34 Ų3468.1 Ų68.122%0.22132%0.316CS..  trans-66149.8171.129.1-33.9000110.2Q131 K132 Y133P129-Q131 PolarHBondContact O-N 3.2Å; P129-Q131 VanDerWaalsContact O-N 3.14Å; P129-K132 HydrophobicContact CG-CB 3.98Å; P129-K132 VanDerWaalsContact O-CB 3.23Å; P129-K132 WeakPolarHBondContact O-CB 3.33Å; P129-K132 PolarHBondContact O-N 2.72Å; P129-Y133 WeakPolarHBondContact O-CD2 3.48Å
130L92.6Very high94.6Very high137 Ų13766.6 Ų66.672%0.71731%0.308SS*.Hα-helixtrans-54.6-37.3-177.2-70.8176.1000112.7K132 Y133 I134L130-K132 PolarHBondContact O-N 3.05Å; L130-Y133 WeakPolarHBondContact O-CB 3.3Å; L130-Y133 PolarHBondContact O-N 3.22Å; L130-Y133 VanDerWaalsContact O-N 3.13Å; L130-I134 PolarHBondContact O-N 3.37Å
131Q93.8Very high94.5Very high102 Ų10272.4 Ų72.448%0.47733%0.334SS..Hα-helixtrans-57-36.4177.4-62.182.1-1.500112.2P129 Y133 I134 F135P129-Q131 PolarHBondContact O-N 3.2Å; P129-Q131 VanDerWaalsContact O-N 3.14Å; Q131-Y133 VanDerWaalsContact C-N 3.34Å; Q131-Y133 PolarHBondContact O-N 3.47Å; Q131-I134 WeakPolarHBondContact O-CB 3.32Å; Q131-I134 PolarHBondContact O-N 2.71Å; Q131-F135 HydrophobicContact CB-CD2 4.4Å; Q131-F135 HydrophobicContact CB-CE2 3.62Å; Q131-F135 HydrophobicContact CB-CZ 3.78Å; Q131-F135 WeakPolarHBondContact O-CD2 3.29Å; Q131-F135 WeakPolarHBondContact O-CE2 3.26Å; Q131-F135 WeakPolarHBondContact O-CG 3.43Å; Q131-F135 PolarHBondContact O-N 3.44Å
132K94.2Very high94.3Very high16 Ų1670.2 Ų70.27%0.0732%0.321CS..Hα-helixtrans-63.3-38.6178.8-178.1130.6-173.9124.50112.4M117 Y128 P129 L130 I134 F135 V136 L257 D300 G304M117-K132 HydrophobicContact CE-CG 3.68Å; Y128-K132 HydrophobicContact CD1-CD 3.8Å; Y128-K132 HydrophobicContact CD1-CG 4.2Å; Y128-K132 HydrophobicContact CG-CD 4.45Å; Y128-K132 HydrophobicContact CG-CG 4.4Å; P129-K132 HydrophobicContact CG-CB 3.98Å; P129-K132 VanDerWaalsContact O-CB 3.23Å; P129-K132 WeakPolarHBondContact O-CB 3.33Å; P129-K132 PolarHBondContact O-N 2.72Å; L130-K132 PolarHBondContact O-N 3.05Å; K132-I134 VanDerWaalsContact C-N 3.31Å; K132-I134 PolarHBondContact O-N 3.22Å; K132-F135 PolarHBondContact O-N 3.33Å; K132-V136 HydrophobicContact CG-CG2 4.43Å; K132-V136 WeakPolarHBondContact O-CB 3.47Å; K132-V136 WeakPolarHBondContact O-CG2 3.46Å; K132-V136 PolarHBondContact O-N 3.01Å; K132-L257 VanDerWaalsContact CE-CD2 3.47Å; K132-D300 IonicContact NZ-OD1 3.03Å; K132-D300 PolarHBondContact NZ-OD1 2.83Å; K132-D300 IonicContact NZ-OD2 3.11Å; K132-D300 PolarHBondContact NZ-OD2 3.47Å; K132-G304 WeakPolarHBondContact CD-O 3.37Å
133Y96Very high94.1Very high66 Ų6664.4 Ų64.426%0.25929%0.29SS..Hα-helixtrans-62.8-41.6176.4-65.7-94.1000110.9M117 V121 P129 L130 Q131 T137M117-Y133 HydrophobicContact CG-CD1 4.25Å; M117-Y133 HydrophobicContact CG-CE1 4Å; M117-Y133 HydrophobicContact SD-CD1 3.23Å; M117-Y133 WeakPolarHBondContact SD-CD1 3.02Å; M117-Y133 HydrophobicContact SD-CE1 3.56Å; M117-Y133 VanDerWaalsContact SD-CE1 3.56Å; M117-Y133 HydrophobicContact SD-CG 3.8Å; V121-Y133 HydrophobicContact CG2-CE1 4.39Å; V121-Y133 WeakPolarHBondContact CG2-OH 3.12Å; P129-Y133 WeakPolarHBondContact O-CD2 3.48Å; L130-Y133 WeakPolarHBondContact O-CB 3.3Å; L130-Y133 PolarHBondContact O-N 3.22Å; L130-Y133 VanDerWaalsContact O-N 3.13Å; Q131-Y133 VanDerWaalsContact C-N 3.34Å; Q131-Y133 PolarHBondContact O-N 3.47Å; Y133-T137 WeakPolarHBondContact O-CB 3.49Å; Y133-T137 PolarHBondContact O-N 2.88Å; Y133-T137 PolarHBondContact O-OG1 2.91Å
134I96.3Very high93.8Very high110 Ų11061.3 Ų61.356%0.56428%0.277SS*.Hα-helixtrans-63.1-49.9177.5-60.2172.5000110.2L130 Q131 K132 V136 T137 M138L130-I134 PolarHBondContact O-N 3.37Å; Q131-I134 WeakPolarHBondContact O-CB 3.32Å; Q131-I134 PolarHBondContact O-N 2.71Å; K132-I134 VanDerWaalsContact C-N 3.31Å; K132-I134 PolarHBondContact O-N 3.22Å; I134-V136 PolarHBondContact O-N 3.44Å; I134-T137 PolarHBondContact O-N 2.8Å; I134-M138 VanDerWaalsContact O-CB 3.32Å; I134-M138 WeakPolarHBondContact O-CB 3.42Å; I134-M138 PolarHBondContact O-N 3.41Å
135F95.5Very high93.6Very high20 Ų2063.1 Ų63.19%0.08829%0.286CS..Hα-helixtrans-66-40.1-177.1-53.3-33.6000112.9Q131 K132 M138 I139 L299 D300Q131-F135 HydrophobicContact CB-CD2 4.4Å; Q131-F135 HydrophobicContact CB-CE2 3.62Å; Q131-F135 HydrophobicContact CB-CZ 3.78Å; Q131-F135 WeakPolarHBondContact O-CD2 3.29Å; Q131-F135 WeakPolarHBondContact O-CE2 3.26Å; Q131-F135 WeakPolarHBondContact O-CG 3.43Å; Q131-F135 PolarHBondContact O-N 3.44Å; K132-F135 PolarHBondContact O-N 3.33Å; F135-M138 WeakPolarHBondContact O-CB 3.36Å; F135-M138 PolarHBondContact O-N 3.48Å; F135-I139 VanDerWaalsContact O-CG1 3.27Å; F135-I139 WeakPolarHBondContact O-CG1 3.42Å; F135-I139 PolarHBondContact O-N 2.91Å; F135-L299 HydrophobicContact CD1-CB 3.54Å; F135-L299 HydrophobicContact CD1-CD1 4.01Å; F135-L299 HydrophobicContact CD1-CG 4.4Å; F135-L299 HydrophobicContact CD2-CB 4.09Å; F135-L299 HydrophobicContact CE1-CB 3.47Å; F135-L299 VanDerWaalsContact CE1-CB 3.47Å; F135-L299 HydrophobicContact CE1-CD1 3.75Å; F135-L299 HydrophobicContact CE1-CD2 4.47Å; F135-L299 HydrophobicContact CE1-CG 4.09Å; F135-L299 HydrophobicContact CE2-CB 4Å; F135-L299 WeakPolarHBondContact CE2-O 3.32Å; F135-L299 HydrophobicContact CG-CB 3.87Å; F135-L299 HydrophobicContact CZ-CB 3.69Å; F135-L299 HydrophobicContact CZ-CG 4.49Å; F135-D300 HydrophobicContact CB-CB 3.96Å; F135-D300 HydrophobicContact CD2-CB 4.24Å; F135-D300 HydrophobicContact CG-CB 4.48Å
136V95.3Very high93.3Very high0 Ų053 Ų530%025%0.248CC..Hα-helixtrans-67.6-39.8177172.10000111.5P113 I114 M117 K132 I134 M138 I139 S140 L257 I261P113-V136 HydrophobicContact CB-CG1 3.58Å; I114-V136 HydrophobicContact CG1-CG1 4.49Å; M117-V136 HydrophobicContact CE-CB 3.51Å; M117-V136 HydrophobicContact CE-CG1 3.87Å; M117-V136 HydrophobicContact CE-CG2 3.33Å; K132-V136 HydrophobicContact CG-CG2 4.43Å; K132-V136 WeakPolarHBondContact O-CB 3.47Å; K132-V136 WeakPolarHBondContact O-CG2 3.46Å; K132-V136 PolarHBondContact O-N 3.01Å; I134-V136 PolarHBondContact O-N 3.44Å; V136-M138 VanDerWaalsContact C-N 3.33Å; V136-M138 PolarHBondContact O-N 2.74Å; V136-I139 PolarHBondContact O-N 2.95Å; V136-S140 PolarHBondContact O-N 3.16Å; V136-L257 HydrophobicContact CG1-CD1 4.29Å; V136-L257 HydrophobicContact CG2-CD1 4.4Å; V136-L257 HydrophobicContact CG2-CD2 4.5Å; V136-I261 HydrophobicContact CG2-CD1 3.81Å
137T95.4Very high92.9Very high71 Ų7149 Ų4944%0.43623%0.234SC..Hα-helixtrans-62.5-42.7174-55.50000111I114 Y133 I134 I139 S140 F141I114-T137 HydrophobicContact CD1-CG2 4.49Å; Y133-T137 WeakPolarHBondContact O-CB 3.49Å; Y133-T137 PolarHBondContact O-N 2.88Å; Y133-T137 PolarHBondContact O-OG1 2.91Å; I134-T137 PolarHBondContact O-N 2.8Å; T137-I139 PolarHBondContact O-N 3.36Å; T137-S140 PolarHBondContact O-N 3.34Å; T137-F141 WeakPolarHBondContact O-CB 3.29Å; T137-F141 PolarHBondContact O-N 3.18Å
138M95.5Very high92.2Very high44 Ų4445 Ų4522%0.21722%0.222CC..Hα-helixtrans-60-43.4176.1-173.8-177.9-176.200112.3I134 F135 V136 G142 L292I134-M138 VanDerWaalsContact O-CB 3.32Å; I134-M138 WeakPolarHBondContact O-CB 3.42Å; I134-M138 PolarHBondContact O-N 3.41Å; F135-M138 WeakPolarHBondContact O-CB 3.36Å; F135-M138 PolarHBondContact O-N 3.48Å; V136-M138 VanDerWaalsContact C-N 3.33Å; V136-M138 PolarHBondContact O-N 2.74Å; M138-G142 PolarHBondContact O-N 2.91Å; M138-L292 HydrophobicContact CE-CB 4.46Å; M138-L292 HydrophobicContact CE-CD2 3.71Å; M138-L292 HydrophobicContact CG-CB 4.31Å; M138-L292 HydrophobicContact CG-CD2 4.09Å
139I95Very high90.9Very high0 Ų046.5 Ų46.50%023%0.232CC..Hα-helixtrans-64.1-51.9175.6-65.8161.3000110.5F135 V136 T137 F141 G142 V143 I261 T265 L297F135-I139 VanDerWaalsContact O-CG1 3.27Å; F135-I139 WeakPolarHBondContact O-CG1 3.42Å; F135-I139 PolarHBondContact O-N 2.91Å; V136-I139 PolarHBondContact O-N 2.95Å; T137-I139 PolarHBondContact O-N 3.36Å; I139-F141 VanDerWaalsContact C-N 3.34Å; I139-F141 PolarHBondContact O-N 2.93Å; I139-G142 PolarHBondContact O-N 3.35Å; I139-V143 WeakPolarHBondContact O-CG2 3.33Å; I139-V143 PolarHBondContact O-N 3.36Å; I139-I261 HydrophobicContact CD1-CG2 4.13Å; I139-T265 HydrophobicContact CG2-CG2 4.14Å; I139-L297 HydrophobicContact CD1-CD2 3.73Å; I139-L297 HydrophobicContact CD1-CG 4.15Å; I139-L297 HydrophobicContact CG1-CD2 4.31Å; I139-L297 HydrophobicContact CG1-CG 4.27Å
140S93.9Very high89.3Confident2 Ų251.1 Ų51.11%0.01425%0.245CC..Hα-helixtrans-61-42.7-178.5-79.70000112.4S110 P113 V136 T137 A144S110-S140 WeakPolarHBondContact O-CB 3.33Å; S110-S140 PolarHBondContact O-OG 3.13Å; P113-S140 WeakPolarHBondContact CD-OG 3.36Å; V136-S140 PolarHBondContact O-N 3.16Å; T137-S140 PolarHBondContact O-N 3.34Å; S140-A144 WeakPolarHBondContact O-CB 3.2Å; S140-A144 PolarHBondContact O-N 3.48Å
141F93.3Very high87.5Confident121 Ų12147 Ų4753%0.53122%0.222SC..Hα-helixtrans-66.4-44.4176.1-178.1-110.6000111.8T137 I139 V143 A144 L145 L292T137-F141 WeakPolarHBondContact O-CB 3.29Å; T137-F141 PolarHBondContact O-N 3.18Å; I139-F141 VanDerWaalsContact C-N 3.34Å; I139-F141 PolarHBondContact O-N 2.93Å; F141-V143 PolarHBondContact O-N 3.25Å; F141-A144 PolarHBondContact O-N 2.75Å; F141-L145 HydrophobicContact CE1-CD1 3.75Å; F141-L145 HydrophobicContact CZ-CD1 3.79Å; F141-L145 VanDerWaalsContact O-CB 3.31Å; F141-L145 WeakPolarHBondContact O-CB 3.15Å; F141-L145 PolarHBondContact O-N 3.15Å; F141-L292 HydrophobicContact CD1-CD1 3.84Å; F141-L292 HydrophobicContact CE1-CD1 4.02Å
142G93.8Very high85.5Confident0 Ų045.6 Ų45.60%022%0.224CC..Hα-helixtrans-59.3-43.1177.100000112.8M138 I139 L145 F146 G289M138-G142 PolarHBondContact O-N 2.91Å; I139-G142 PolarHBondContact O-N 3.35Å; G142-L145 PolarHBondContact O-N 2.95Å; G142-F146 VanDerWaalsContact O-CB 3.3Å; G142-F146 WeakPolarHBondContact O-CB 3.44Å; G142-F146 PolarHBondContact O-N 2.83Å; G142-G289 WeakPolarHBondContact O-CA 3.36Å
143V91.6Very high83.3Confident1 Ų151 Ų511%0.00626%0.258CS..Hα-helixtrans-66.7-41.7175.2179.90000111.5I139 F141 F146 M147 T264 F268 I293I139-V143 WeakPolarHBondContact O-CG2 3.33Å; I139-V143 PolarHBondContact O-N 3.36Å; F141-V143 PolarHBondContact O-N 3.25Å; V143-F146 PolarHBondContact O-N 3.27Å; V143-M147 HydrophobicContact CG1-CE 4.46Å; V143-M147 HydrophobicContact CG1-CG 4.3Å; V143-M147 WeakPolarHBondContact O-CB 3.19Å; V143-M147 VanDerWaalsContact O-CG 3.22Å; V143-M147 WeakPolarHBondContact O-CG 3.48Å; V143-M147 PolarHBondContact O-N 2.91Å; V143-T264 HydrophobicContact CB-CG2 4.27Å; V143-T264 HydrophobicContact CG1-CG2 4.19Å; V143-T264 HydrophobicContact CG2-CG2 4.04Å; V143-F268 HydrophobicContact CG1-CB 4.25Å; V143-F268 HydrophobicContact CG2-CB 4.04Å; V143-I293 HydrophobicContact CB-CD1 4.36Å; V143-I293 HydrophobicContact CG2-CD1 3.62Å; V143-I293 HydrophobicContact CG2-CG1 3.76Å
144A89.8Confident81.1Confident19 Ų1958.2 Ų58.216%0.15729%0.285CS..Hα-helixtrans-61.4-46.517700000111.4I107 S110 S140 F141 F146 M147 F148I107-A144 HydrophobicContact CG2-CB 4.4Å; S110-A144 PolarHBondContact OG-N 3.32Å; S140-A144 WeakPolarHBondContact O-CB 3.2Å; S140-A144 PolarHBondContact O-N 3.48Å; F141-A144 PolarHBondContact O-N 2.75Å; A144-F146 PolarHBondContact O-N 2.88Å; A144-M147 PolarHBondContact O-N 3.34Å; A144-F148 WeakPolarHBondContact O-CB 3.48Å; A144-F148 PolarHBondContact O-N 2.93Å
145L89.8Confident79Confident37 Ų3758.1 Ų58.119%0.19429%0.286CS..Hα-helixtrans-63.8-40.3179.6-168.2155.8000111.9F141 G142 M147 N149 C285 I288F141-L145 HydrophobicContact CE1-CD1 3.75Å; F141-L145 HydrophobicContact CZ-CD1 3.79Å; F141-L145 VanDerWaalsContact O-CB 3.31Å; F141-L145 WeakPolarHBondContact O-CB 3.15Å; F141-L145 PolarHBondContact O-N 3.15Å; G142-L145 PolarHBondContact O-N 2.95Å; L145-M147 VanDerWaalsContact C-N 3.34Å; L145-M147 PolarHBondContact O-N 3.28Å; L145-N149 PolarHBondContact O-ND2 2.95Å; L145-C285 HydrophobicContact CD2-CB 3.86Å; L145-C285 WeakPolarHBondContact CD2-O 3.4Å; L145-I288 HydrophobicContact CD1-CG2 4.45Å; L145-I288 HydrophobicContact CD2-CB 4.41Å
146F87.9Confident76.6Confident1 Ų162.4 Ų62.40%0.00432%0.318CS..Hα-helixtrans-60.5-42.7174.7-176.8-84.9000112.3G142 V143 A144 F268 V271 L272 I275 M282 Q286 T290G142-F146 VanDerWaalsContact O-CB 3.3Å; G142-F146 WeakPolarHBondContact O-CB 3.44Å; G142-F146 PolarHBondContact O-N 2.83Å; V143-F146 PolarHBondContact O-N 3.27Å; A144-F146 PolarHBondContact O-N 2.88Å; F146-F268 AromaticContact CD1-CD2 3.95Å; F146-F268 HydrophobicContact CD1-CD2 3.95Å; F146-F268 HydrophobicContact CD1-CE2 4.42Å; F146-F268 AromaticContact CD2-CD2 3.95Å; F146-F268 HydrophobicContact CD2-CD2 3.95Å; F146-F268 AromaticContact CD2-CE2 3.63Å; F146-F268 HydrophobicContact CD2-CE2 3.63Å; F146-F268 HydrophobicContact CE1-CD2 4.08Å; F146-F268 HydrophobicContact CE1-CE2 4.39Å; F146-F268 HydrophobicContact CE2-CD2 4.05Å; F146-F268 AromaticContact CE2-CE2 3.57Å; F146-F268 HydrophobicContact CE2-CE2 3.57Å; F146-F268 AromaticContact CG-CD2 3.9Å; F146-F268 HydrophobicContact CG-CD2 3.9Å; F146-F268 HydrophobicContact CG-CE2 4.07Å; F146-F268 HydrophobicContact CZ-CD2 4.13Å; F146-F268 AromaticContact CZ-CE2 3.99Å; F146-F268 HydrophobicContact CZ-CE2 3.99Å; F146-V271 HydrophobicContact CE1-CB 4.1Å; F146-V271 HydrophobicContact CE1-CG1 3.72Å; F146-V271 HydrophobicContact CZ-CG1 4.49Å; F146-L272 HydrophobicContact CE2-CD1 4.28Å; F146-L272 HydrophobicContact CZ-CB 4.3Å; F146-L272 HydrophobicContact CZ-CD1 4.22Å; F146-I275 HydrophobicContact CE1-CD1 4.39Å; F146-I275 HydrophobicContact CZ-CD1 3.99Å; F146-M282 HydrophobicContact CD2-CE 4.42Å; F146-M282 HydrophobicContact CE2-CE 3.48Å; F146-M282 VanDerWaalsContact CE2-CE 3.48Å; F146-M282 HydrophobicContact CZ-CE 4.21Å; F146-Q286 HydrophobicContact CD2-CB 3.89Å; F146-Q286 HydrophobicContact CD2-CG 4.02Å; F146-Q286 WeakPolarHBondContact CD2-O 3.23Å; F146-Q286 HydrophobicContact CE2-CB 3.98Å; F146-Q286 HydrophobicContact CE2-CG 4.18Å; F146-Q286 HydrophobicContact CG-CG 4.31Å; F146-Q286 WeakPolarHBondContact O-CG 3.43Å; F146-T290 WeakPolarHBondContact CD2-OG1 3.43Å; F146-T290 WeakPolarHBondContact CE2-OG1 3.38Å
147M82.7Confident74.3Confident13 Ų1367.3 Ų67.36%0.06436%0.359CS..Hα-helixtrans-80.4-29.4-177-66.1-67.9-176.600112.9V106 I107 V143 A144 L145 N149 W150 K267 V271V106-M147 HydrophobicContact CG1-CE 3.85Å; V106-M147 HydrophobicContact CG1-CG 4.24Å; V106-M147 HydrophobicContact CG1-SD 3.97Å; I107-M147 HydrophobicContact CD1-CB 4.17Å; I107-M147 HydrophobicContact CG1-CB 3.37Å; I107-M147 HydrophobicContact CG1-CG 4.45Å; V143-M147 HydrophobicContact CG1-CE 4.46Å; V143-M147 HydrophobicContact CG1-CG 4.3Å; V143-M147 WeakPolarHBondContact O-CB 3.19Å; V143-M147 VanDerWaalsContact O-CG 3.22Å; V143-M147 WeakPolarHBondContact O-CG 3.48Å; V143-M147 PolarHBondContact O-N 2.91Å; A144-M147 PolarHBondContact O-N 3.34Å; L145-M147 VanDerWaalsContact C-N 3.34Å; L145-M147 PolarHBondContact O-N 3.28Å; M147-N149 PolarHBondContact O-N 2.86Å; M147-W150 PolarHBondContact O-N 3.45Å; M147-K267 HydrophobicContact CE-CB 4.41Å; M147-K267 WeakPolarHBondContact CE-O 3.4Å; M147-V271 HydrophobicContact CE-CB 4.03Å; M147-V271 HydrophobicContact CE-CG2 3.64Å; M147-V271 HydrophobicContact SD-CB 4.31Å; M147-V271 HydrophobicContact SD-CG1 4.39Å; M147-V271 HydrophobicContact SD-CG2 3.9Å
148F79Confident72.4Confident127 Ų12769.1 Ų69.156%0.55737%0.374SS*.Hα-helixtrans-59-42.6-176.9-172.8-100.1000113.1A144 W150 H151 S152A144-F148 WeakPolarHBondContact O-CB 3.48Å; A144-F148 PolarHBondContact O-N 2.93Å; F148-W150 PolarHBondContact O-N 3.42Å; F148-H151 PolarHBondContact O-N 3.14Å; F148-S152 PolarHBondContact O-OG 2.88Å
149N65Low70.8Confident56 Ų5677.3 Ų77.330%0.29940%0.404SS..THydrogen-bonded Turntrans-75.8-6.6-176.4-76.7-94.5000114.3L145 M147 H151 C285L145-N149 PolarHBondContact O-ND2 2.95Å; M147-N149 PolarHBondContact O-N 2.86Å; N149-H151 VanDerWaalsContact C-N 3.32Å; N149-C285 HydrophobicContact CB-CB 4.27Å; N149-C285 VanDerWaalsContact CG-CB 3.43Å; N149-C285 WeakPolarHBondContact ND2-CB 3.37Å; N149-C285 PolarHBondContact ND2-SG 2.89Å; N149-C285 PolarHBondContact OD1-SG 3.11Å
150W58.5Low69.7Low130 Ų13083.7 Ų83.749%0.49243%0.432SS..THydrogen-bonded Turntrans-74.4-23.2174.7-172.8-99000112.5M147 F148 I275M147-W150 PolarHBondContact O-N 3.45Å; F148-W150 PolarHBondContact O-N 3.42Å; W150-I275 HydrophobicContact CZ3-CD1 4.41Å; W150-I275 HydrophobicContact CZ3-CG1 4.22Å
151H55.9Low69.3Low50 Ų5084.9 Ų84.923%0.23145%0.445CS..THydrogen-bonded Turntrans-120.3-1.7-170.3-160.567.2000115.6F148 N149 T153 D155F148-H151 PolarHBondContact O-N 3.14Å; N149-H151 VanDerWaalsContact C-N 3.32Å; H151-T153 PolarHBondContact O-N 3.41Å; H151-D155 IonicContact CD2-OD2 3.58Å; H151-D155 PolarHBondContact CD2-OD2 3.37Å; H151-D155 IonicContact CE1-OD2 3.31Å; H151-D155 IonicContact NE2-OD1 3.25Å; H151-D155 PolarHBondContact NE2-OD1 3.46Å; H151-D155 IonicContact NE2-OD2 3.79Å; H151-D155 PolarHBondContact NE2-OD2 3.42Å
152S51Low69Low74 Ų7485 Ų8552%0.51745%0.445SS..THydrogen-bonded Turntrans-67.217.1-177.5-56.50000115.7F148F148-S152 PolarHBondContact O-OG 2.88Å
153T47.5Very low68.8Low130 Ų13085 Ų8580%0.79845%0.446SS*.THydrogen-bonded Turntrans-110.7-3.6177.950.90000116H151H151-T153 PolarHBondContact O-N 3.41Å
154R49.9Very low68.7Low217 Ų21787.4 Ų87.482%0.81946%0.457SS*.THydrogen-bonded Turntrans-144.3-2.7179.9-73.7-165.3175.9173.9-1.1121.1
155D51.7Low68.8Low108 Ų10889.5 Ų89.558%0.57847%0.47SS*.  trans-100.7105.9178.5-76.9-0.7000112.5H151H151-D155 IonicContact CD2-OD2 3.58Å; H151-D155 PolarHBondContact CD2-OD2 3.37Å; H151-D155 IonicContact CE1-OD2 3.31Å; H151-D155 IonicContact NE2-OD1 3.25Å; H151-D155 PolarHBondContact NE2-OD1 3.46Å; H151-D155 IonicContact NE2-OD2 3.79Å; H151-D155 PolarHBondContact NE2-OD2 3.42Å
156S45.7Very low69Low110 Ų11088.8 Ų88.877%0.76947%0.466SS*.  trans-48.1145.8162-56.10000110.6S158S156-S158 VanDerWaalsContact C-N 3.34Å; S156-S158 PolarHBondContact O-N 2.88Å
157A48.4Very low69.3Low103 Ų10389.3 Ų89.385%0.85147%0.469SS*.  trans-47.690.7178.600000112.5
158S54.9Low69.8Low109 Ų10992.5 Ų92.576%0.76249%0.485SS*.  trans-82.6125.3173.9-120.60000107.9S156S156-S158 VanDerWaalsContact C-N 3.34Å; S156-S158 PolarHBondContact O-N 2.88Å
159Y60.9Low70.6Confident216 Ų21688.8 Ų88.885%0.84748%0.475SS*.  trans-56.9146.1169.6-66.6-87.2000109.7G161Y159-G161 PolarHBondContact O-N 3.23Å
160F73.3Confident72.2Confident133 Ų13386.1 Ų86.158%0.58346%0.461SS*.SBendtrans-49.3111.4172.2-177.9-97.2000109.8E164 C165 I168F160-E164 HydrophobicContact CD2-CB 3.59Å; F160-E164 HydrophobicContact CD2-CG 4.12Å; F160-E164 HydrophobicContact CE2-CB 3.43Å; F160-E164 VanDerWaalsContact CE2-CB 3.43Å; F160-E164 HydrophobicContact CE2-CG 4.37Å; F160-E164 HydrophobicContact CG-CB 4.37Å; F160-E164 HydrophobicContact CZ-CB 4.1Å; F160-C165 WeakPolarHBondContact CE1-SG 3.32Å; F160-I168 HydrophobicContact CE2-CD1 3.71Å; F160-I168 HydrophobicContact CZ-CD1 3.71Å
161G84.1Confident73.9Confident28 Ų2880.6 Ų80.629%0.28944%0.441SS..  trans-108.8-174.2-17000000112.9Y159 G163 E164 C165Y159-G161 PolarHBondContact O-N 3.23Å; G161-G163 PolarHBondContact O-N 3.29Å; G161-E164 VanDerWaalsContact CA-OE2 3.26Å; G161-E164 WeakPolarHBondContact CA-OE2 3.12Å; G161-E164 PolarHBondContact N-OE2 3Å; G161-E164 PolarHBondContact O-N 3.18Å; G161-C165 PolarHBondContact O-N 2.83Å
162F88.6Confident75.9Confident122 Ų12282.7 Ų82.754%0.53545%0.453SS..Hα-helixtrans-61.6-30.9177.4-175.2-110.5000112.4Y99 C165 L166Y99-F162 HydrophobicContact CD1-CD1 4.3Å; Y99-F162 AromaticContact CD2-CD1 3.93Å; Y99-F162 HydrophobicContact CD2-CD1 3.93Å; Y99-F162 HydrophobicContact CD2-CE1 4.44Å; Y99-F162 AromaticContact CE1-CD1 3.96Å; Y99-F162 HydrophobicContact CE1-CD1 3.96Å; Y99-F162 AromaticContact CE2-CD1 3.56Å; Y99-F162 HydrophobicContact CE2-CD1 3.56Å; Y99-F162 AromaticContact CE2-CE1 3.75Å; Y99-F162 HydrophobicContact CE2-CE1 3.75Å; Y99-F162 HydrophobicContact CG-CD1 4.28Å; Y99-F162 AromaticContact CZ-CD1 3.57Å; Y99-F162 AromaticContact CZ-CE1 3.87Å; F162-C165 WeakPolarHBondContact O-CB 3.47Å; F162-C165 PolarHBondContact O-N 2.76Å; F162-L166 HydrophobicContact CD1-CD1 3.82Å; F162-L166 HydrophobicContact CD1-CG 4.26Å; F162-L166 HydrophobicContact CE1-CD1 3.52Å; F162-L166 HydrophobicContact CE1-CD2 4.34Å; F162-L166 HydrophobicContact CE1-CG 3.98Å; F162-L166 HydrophobicContact CZ-CD1 4.18Å; F162-L166 HydrophobicContact CZ-CD2 4.17Å; F162-L166 HydrophobicContact CZ-CG 4.19Å; F162-L166 WeakPolarHBondContact O-CG 3.38Å; F162-L166 PolarHBondContact O-N 2.64Å
163G87.6Confident78.1Confident1 Ų180.5 Ų80.51%0.0144%0.436CS..Hα-helixtrans-65.7-43.2178.700000114.1Y99 G161 L166 L167Y99-G163 VanDerWaalsContact CB-CA 3.45Å; G161-G163 PolarHBondContact O-N 3.29Å; G163-L166 PolarHBondContact O-N 3.42Å; G163-L167 WeakPolarHBondContact O-CB 3.47Å; G163-L167 PolarHBondContact O-N 2.89Å
164E89.7Confident80.5Confident51 Ų5175.1 Ų75.124%0.23840%0.402CS..Hα-helixtrans-67.4-39.4176.3-66.875.1-16800111.4V100 F160 G161 L166 L167 I168V100-E164 HydrophobicContact CG1-CG 4.46Å; F160-E164 HydrophobicContact CD2-CB 3.59Å; F160-E164 HydrophobicContact CD2-CG 4.12Å; F160-E164 HydrophobicContact CE2-CB 3.43Å; F160-E164 VanDerWaalsContact CE2-CB 3.43Å; F160-E164 HydrophobicContact CE2-CG 4.37Å; F160-E164 HydrophobicContact CG-CB 4.37Å; F160-E164 HydrophobicContact CZ-CB 4.1Å; G161-E164 VanDerWaalsContact CA-OE2 3.26Å; G161-E164 WeakPolarHBondContact CA-OE2 3.12Å; G161-E164 PolarHBondContact N-OE2 3Å; G161-E164 PolarHBondContact O-N 3.18Å; E164-L166 PolarHBondContact O-N 3.03Å; E164-L167 PolarHBondContact O-N 2.89Å; E164-I168 WeakPolarHBondContact O-CG1 3.25Å; E164-I168 PolarHBondContact O-N 3.31Å
165C93.4Very high82.8Confident63 Ų6364.8 Ų64.843%0.42636%0.363SS..Hα-helixtrans-57-47.6170.9-74.50000111.9F160 G161 F162 L167 I168 S169F160-C165 WeakPolarHBondContact CE1-SG 3.32Å; G161-C165 PolarHBondContact O-N 2.83Å; F162-C165 WeakPolarHBondContact O-CB 3.47Å; F162-C165 PolarHBondContact O-N 2.76Å; C165-L167 VanDerWaalsContact C-N 3.3Å; C165-L167 PolarHBondContact O-N 3.39Å; C165-I168 PolarHBondContact O-N 2.92Å; C165-S169 WeakPolarHBondContact O-CB 3.49Å; C165-S169 PolarHBondContact O-N 3.29Å
166L93.4Very high85Confident22 Ų2261.7 Ų61.712%0.11535%0.348CS..Hα-helixtrans-61.4-39.5176.2-74.4176.1000111.7T92 T95 Y99 F162 G163 E164 S169 S170T92-L166 HydrophobicContact CG2-CD2 4.18Å; T95-L166 HydrophobicContact CG2-CD1 3.85Å; Y99-L166 HydrophobicContact CD2-CD1 3.95Å; Y99-L166 HydrophobicContact CE2-CD1 4.01Å; F162-L166 HydrophobicContact CD1-CD1 3.82Å; F162-L166 HydrophobicContact CD1-CG 4.26Å; F162-L166 HydrophobicContact CE1-CD1 3.52Å; F162-L166 HydrophobicContact CE1-CD2 4.34Å; F162-L166 HydrophobicContact CE1-CG 3.98Å; F162-L166 HydrophobicContact CZ-CD1 4.18Å; F162-L166 HydrophobicContact CZ-CD2 4.17Å; F162-L166 HydrophobicContact CZ-CG 4.19Å; F162-L166 WeakPolarHBondContact O-CG 3.38Å; F162-L166 PolarHBondContact O-N 2.64Å; G163-L166 PolarHBondContact O-N 3.42Å; E164-L166 PolarHBondContact O-N 3.03Å; L166-S169 PolarHBondContact O-N 3.46Å; L166-S170 VanDerWaalsContact O-CB 3.27Å; L166-S170 WeakPolarHBondContact O-CB 3.27Å; L166-S170 PolarHBondContact O-N 3.15Å
167L93.1Very high87.5Confident12 Ų1256.7 Ų56.76%0.06331%0.313CS..Hα-helixtrans-67-43.2179.2-17157000112Q105 K109 G163 E164 C165 S170 L171Q105-L167 HydrophobicContact CG-CD1 3.91Å; K109-L167 HydrophobicContact CD-CD1 4.17Å; K109-L167 HydrophobicContact CG-CD1 4.03Å; G163-L167 WeakPolarHBondContact O-CB 3.47Å; G163-L167 PolarHBondContact O-N 2.89Å; E164-L167 PolarHBondContact O-N 2.89Å; C165-L167 VanDerWaalsContact C-N 3.3Å; C165-L167 PolarHBondContact O-N 3.39Å; L167-S170 WeakPolarHBondContact O-CB 3.21Å; L167-S170 PolarHBondContact O-N 3.28Å; L167-L171 VanDerWaalsContact O-CG 3.3Å; L167-L171 WeakPolarHBondContact O-CG 3.5Å; L167-L171 PolarHBondContact O-N 3.46Å
168I95Very high89.8Confident80 Ų8052 Ų5241%0.4127%0.274SS..Hα-helixtrans-63.6-45.4174.4-69.8166.8000110.6F160 E164 C165 S170 L171 L172F160-I168 HydrophobicContact CE2-CD1 3.71Å; F160-I168 HydrophobicContact CZ-CD1 3.71Å; E164-I168 WeakPolarHBondContact O-CG1 3.25Å; E164-I168 PolarHBondContact O-N 3.31Å; C165-I168 PolarHBondContact O-N 2.92Å; I168-S170 VanDerWaalsContact C-N 3.29Å; I168-S170 PolarHBondContact O-N 3.39Å; I168-L171 WeakPolarHBondContact O-CB 3.34Å; I168-L171 PolarHBondContact O-N 3.06Å; I168-L171 VanDerWaalsContact O-N 3.13Å; I168-L172 HydrophobicContact CG2-CD1 4.13Å; I168-L172 HydrophobicContact CG2-CG 4.45Å; I168-L172 WeakPolarHBondContact O-CG 3.45Å; I168-L172 PolarHBondContact O-N 2.91Å
169S96.1Very high91.8Very high49 Ų4946.8 Ų46.834%0.34324%0.238SC..Hα-helixtrans-56.4-46.1175-176.60000111.1C165 L166 L171 L172 L173C165-S169 WeakPolarHBondContact O-CB 3.49Å; C165-S169 PolarHBondContact O-N 3.29Å; L166-S169 PolarHBondContact O-N 3.46Å; S169-L171 VanDerWaalsContact C-N 3.32Å; S169-L171 PolarHBondContact O-N 3.05Å; S169-L172 PolarHBondContact O-N 3.42Å; S169-L173 WeakPolarHBondContact O-CB 2.98Å; S169-L173 VanDerWaalsContact O-CG 3.28Å; S169-L173 WeakPolarHBondContact O-CG 3.38Å; S169-L173 PolarHBondContact O-N 2.89Å
170S96.8Very high93.5Very high0 Ų037.2 Ų37.20%020%0.202CC..Hα-helixtrans-61-38.5176.9-169.30000112.9A89 T92 S93 K109 L166 L167 I168 D174A89-S170 PolarHBondContact O-OG 3.26Å; T92-S170 WeakPolarHBondContact OG1-CA 3.25Å; T92-S170 WeakPolarHBondContact OG1-CB 3.44Å; T92-S170 PolarHBondContact OG1-OG 3.37Å; S93-S170 WeakPolarHBondContact CB-OG 3.33Å; S93-S170 PolarHBondContact N-OG 2.71Å; K109-S170 PolarHBondContact NZ-OG 3.46Å; L166-S170 VanDerWaalsContact O-CB 3.27Å; L166-S170 WeakPolarHBondContact O-CB 3.27Å; L166-S170 PolarHBondContact O-N 3.15Å; L167-S170 WeakPolarHBondContact O-CB 3.21Å; L167-S170 PolarHBondContact O-N 3.28Å; I168-S170 VanDerWaalsContact C-N 3.29Å; I168-S170 PolarHBondContact O-N 3.39Å; S170-D174 WeakPolarHBondContact O-CB 3.31Å; S170-D174 PolarHBondContact O-N 3Å
171L95.8Very high94.6Very high15 Ų1531.6 Ų31.68%0.07918%0.177CC..Hα-helixtrans-69.6-38.9176.5-73.5170.2000112.9G108 K109 K112 P115 L167 I168 S169 G175G108-L171 WeakPolarHBondContact O-CD1 3.48Å; K109-L171 HydrophobicContact CD-CD2 3.91Å; K112-L171 HydrophobicContact CB-CD2 3.76Å; K112-L171 HydrophobicContact CG-CD2 4.35Å; P115-L171 HydrophobicContact CG-CB 4.37Å; L167-L171 VanDerWaalsContact O-CG 3.3Å; L167-L171 WeakPolarHBondContact O-CG 3.5Å; L167-L171 PolarHBondContact O-N 3.46Å; I168-L171 WeakPolarHBondContact O-CB 3.34Å; I168-L171 PolarHBondContact O-N 3.06Å; I168-L171 VanDerWaalsContact O-N 3.13Å; S169-L171 VanDerWaalsContact C-N 3.32Å; S169-L171 PolarHBondContact O-N 3.05Å; L171-G175 PolarHBondContact O-N 3.44Å
172L97.5Very high95.2Very high93 Ų9330.5 Ų30.549%0.48717%0.165SC..Hα-helixtrans-65.7-43.7174.9-70173.3000110.8I168 S169 G175 V176I168-L172 HydrophobicContact CG2-CD1 4.13Å; I168-L172 HydrophobicContact CG2-CG 4.45Å; I168-L172 WeakPolarHBondContact O-CG 3.45Å; I168-L172 PolarHBondContact O-N 2.91Å; S169-L172 PolarHBondContact O-N 3.42Å; L172-G175 CarbonylContact O-C 3.22Å; L172-G175 WeakPolarHBondContact O-CA 3.1Å; L172-G175 PolarHBondContact O-N 2.81Å; L172-G175 VanDerWaalsContact O-N 3.08Å; L172-V176 WeakPolarHBondContact O-CG2 3.35Å; L172-V176 PolarHBondContact O-N 2.89Å
173L97.8Very high95.5Very high28 Ų2826.4 Ų26.415%0.14715%0.147CC..Hα-helixtrans-65-42.9176.2-69.8165.1000111.9T88 A89 S169 G175 V176 T177T88-L173 HydrophobicContact CG2-CD1 3.51Å; A89-L173 HydrophobicContact CB-CB 3.67Å; S169-L173 WeakPolarHBondContact O-CB 2.98Å; S169-L173 VanDerWaalsContact O-CG 3.28Å; S169-L173 WeakPolarHBondContact O-CG 3.38Å; S169-L173 PolarHBondContact O-N 2.89Å; L173-G175 PolarHBondContact O-N 3.34Å; L173-V176 PolarHBondContact O-N 3.07Å; L173-V176 VanDerWaalsContact O-N 3.13Å; L173-T177 PolarHBondContact O-N 2.96Å; L173-T177 PolarHBondContact O-OG1 3.32Å; L173-T177 VanDerWaalsContact O-OG1 3.04Å
174D97.6Very high95.8Very high18 Ų1826.3 Ų26.310%0.09615%0.147CC..Hα-helixtrans-54.9-40.1169.3-89.5-40.8000111.2K109 K112 S170 G178K109-D174 IonicContact NZ-OD2 2.84Å; K109-D174 PolarHBondContact NZ-OD2 3.16Å; K112-D174 HydrophobicContact CD-CB 4.29Å; K112-D174 WeakPolarHBondContact CD-OD2 3.39Å; K112-D174 HydrophobicContact CG-CB 4.13Å; K112-D174 IonicContact NZ-OD1 2.79Å; K112-D174 PolarHBondContact NZ-OD1 2.91Å; K112-D174 IonicContact NZ-OD2 3.32Å; K112-D174 PolarHBondContact NZ-OD2 3.38Å; S170-D174 WeakPolarHBondContact O-CB 3.31Å; S170-D174 PolarHBondContact O-N 3Å; D174-G178 PolarHBondContact O-N 3.28Å
175G97.7Very high96Very high0 Ų026.2 Ų26.20%015%0.145CC..Hα-helixtrans-62.2-48174.300000112.7L119 L171 L172 L173 G178 G179L119-G175 VanDerWaalsContact CB-C 3.47Å; L119-G175 WeakPolarHBondContact CB-O 3.48Å; L171-G175 PolarHBondContact O-N 3.44Å; L172-G175 CarbonylContact O-C 3.22Å; L172-G175 WeakPolarHBondContact O-CA 3.1Å; L172-G175 PolarHBondContact O-N 2.81Å; L172-G175 VanDerWaalsContact O-N 3.08Å; L173-G175 PolarHBondContact O-N 3.34Å; G175-G178 PolarHBondContact O-N 3.39Å; G175-G179 PolarHBondContact O-N 3.01Å
176V98.1Very high95.9Very high42 Ų4228.5 Ų28.526%0.25515%0.148SC..Hα-helixtrans-59.6-47.2175.3173.40000110.6L123 L172 L173 G178 G179 V180L123-V176 HydrophobicContact CD1-CG1 4.3Å; L172-V176 WeakPolarHBondContact O-CG2 3.35Å; L172-V176 PolarHBondContact O-N 2.89Å; L173-V176 PolarHBondContact O-N 3.07Å; L173-V176 VanDerWaalsContact O-N 3.13Å; V176-G178 VanDerWaalsContact C-N 3.34Å; V176-G178 PolarHBondContact O-N 2.94Å; V176-G179 PolarHBondContact O-N 3.24Å; V176-G179 VanDerWaalsContact O-N 3.16Å; V176-V180 HydrophobicContact CG1-CG2 4.33Å; V176-V180 WeakPolarHBondContact O-CG2 3.39Å; V176-V180 PolarHBondContact O-N 3.27Å
177T97.7Very high95.8Very high6 Ų632.6 Ų32.64%0.03716%0.163CC..Hα-helixtrans-55.5-49.9175.3-57.80000110.7S85 Y86 L173 G179 V180 Q181 M198S85-T177 VanDerWaalsContact C-OG1 3.31Å; S85-T177 VanDerWaalsContact CB-OG1 3.32Å; S85-T177 WeakPolarHBondContact CB-OG1 3.25Å; S85-T177 PolarHBondContact OG-OG1 2.96Å; Y86-T177 WeakPolarHBondContact CA-OG1 3.34Å; Y86-T177 HydrophobicContact CD2-CG2 4.47Å; Y86-T177 PolarHBondContact N-OG1 3.44Å; Y86-T177 VanDerWaalsContact N-OG1 3.14Å; L173-T177 PolarHBondContact O-N 2.96Å; L173-T177 PolarHBondContact O-OG1 3.32Å; L173-T177 VanDerWaalsContact O-OG1 3.04Å; T177-G179 VanDerWaalsContact C-N 3.33Å; T177-G179 PolarHBondContact O-N 3.42Å; T177-V180 PolarHBondContact O-N 2.95Å; T177-Q181 HydrophobicContact CG2-CG 4.38Å; T177-Q181 WeakPolarHBondContact O-CB 3.02Å; T177-Q181 WeakPolarHBondContact O-CG 3.32Å; T177-Q181 PolarHBondContact O-N 3.34Å; T177-M198 HydrophobicContact CG2-CE 3.89Å
178G96.9Very high95.7Very high3 Ų339.2 Ų39.23%0.03120%0.198CC..Hα-helixtrans-63.7-3617800000113.6S120 D174 G175 V176 E182 P256S120-G178 PolarHBondContact OG-O 2.82Å; D174-G178 PolarHBondContact O-N 3.28Å; G175-G178 PolarHBondContact O-N 3.39Å; V176-G178 VanDerWaalsContact C-N 3.34Å; V176-G178 PolarHBondContact O-N 2.94Å; G178-E182 WeakPolarHBondContact O-CB 3.43Å; G178-E182 PolarHBondContact O-N 3.01Å; G178-P256 WeakPolarHBondContact O-CB 3.5Å; G178-P256 WeakPolarHBondContact O-CG 3.25Å
179G96.9Very high95.6Very high0 Ų035.8 Ų35.80%018%0.181CC..Hα-helixtrans-65.1-47.4174.900000112.6A124 G175 V176 T177 E182 E183A124-G179 WeakPolarHBondContact CB-O 3.31Å; G175-G179 PolarHBondContact O-N 3.01Å; V176-G179 PolarHBondContact O-N 3.24Å; V176-G179 VanDerWaalsContact O-N 3.16Å; T177-G179 VanDerWaalsContact C-N 3.33Å; T177-G179 PolarHBondContact O-N 3.42Å; G179-E182 PolarHBondContact O-N 3.38Å; G179-E183 PolarHBondContact O-N 3.21Å; G179-E183 VanDerWaalsContact O-N 3.13Å
180V97.1Very high95.5Very high16 Ų1634.1 Ų34.110%0.09717%0.172CC..Hα-helixtrans-68.5-37.3178.71800000111.5K78 I81 C82 L123 V176 T177 E182 E183 L184K78-V180 HydrophobicContact CB-CG1 4.13Å; K78-V180 WeakPolarHBondContact O-CG1 3.34Å; I81-V180 HydrophobicContact CG2-CG2 4.08Å; C82-V180 HydrophobicContact CB-CB 4.25Å; C82-V180 HydrophobicContact CB-CG1 3.77Å; L123-V180 HydrophobicContact CD1-CG2 4.46Å; V176-V180 HydrophobicContact CG1-CG2 4.33Å; V176-V180 WeakPolarHBondContact O-CG2 3.39Å; V176-V180 PolarHBondContact O-N 3.27Å; T177-V180 PolarHBondContact O-N 2.95Å; V180-E182 VanDerWaalsContact C-N 3.34Å; V180-E182 PolarHBondContact O-N 3.42Å; V180-E183 WeakPolarHBondContact O-CB 3.41Å; V180-E183 PolarHBondContact O-N 3.21Å; V180-L184 HydrophobicContact CG1-CD1 4.07Å; V180-L184 HydrophobicContact CG1-CG 4.4Å; V180-L184 WeakPolarHBondContact O-CG 3.39Å; V180-L184 PolarHBondContact O-N 2.84Å
181Q96.7Very high95.5Very high15 Ų1535 Ų357%0.0718%0.177CC..Hα-helixtrans-62.3-39.4173.8-74.9173.3-18.100112.6T177 E183 L184 K185 M198 I251 P256T177-Q181 HydrophobicContact CG2-CG 4.38Å; T177-Q181 WeakPolarHBondContact O-CB 3.02Å; T177-Q181 WeakPolarHBondContact O-CG 3.32Å; T177-Q181 PolarHBondContact O-N 3.34Å; Q181-E183 VanDerWaalsContact C-N 3.29Å; Q181-E183 PolarHBondContact O-N 2.97Å; Q181-L184 PolarHBondContact O-N 3.15Å; Q181-K185 WeakPolarHBondContact O-CB 3.34Å; Q181-K185 PolarHBondContact O-N 2.84Å; Q181-M198 HydrophobicContact CG-SD 4.27Å; Q181-M198 PolarHBondContact NE2-SD 2.84Å; Q181-I251 HydrophobicContact CB-CG2 4.01Å; Q181-I251 HydrophobicContact CG-CG2 4.38Å; Q181-P256 HydrophobicContact CB-CB 4.22Å; Q181-P256 HydrophobicContact CB-CG 3.43Å; Q181-P256 VanDerWaalsContact CB-CG 3.43Å
182E96.2Very high95.5Very high4 Ų436.5 Ų36.52%0.01918%0.182CC..Hα-helixtrans-67-34.2176.3-177.366.2-160.400111A124 R126 G178 G179 V180 S255 P256A124-E182 HydrophobicContact CB-CB 3.83Å; A124-E182 HydrophobicContact CB-CG 3.77Å; R126-E182 HydrophobicContact CB-CG 4.1Å; R126-E182 VanDerWaalsContact CD-OE1 3.26Å; R126-E182 WeakPolarHBondContact CD-OE1 3.48Å; R126-E182 HydrophobicContact CG-CG 4.23Å; R126-E182 IonicContact CZ-OE1 2.71Å; R126-E182 IonicContact NE-OE1 3.26Å; R126-E182 IonicContact NH1-OE1 3.12Å; R126-E182 PolarHBondContact NH1-OE1 3.18Å; R126-E182 VanDerWaalsContact NH1-OE1 3.11Å; G178-E182 WeakPolarHBondContact O-CB 3.43Å; G178-E182 PolarHBondContact O-N 3.01Å; G179-E182 PolarHBondContact O-N 3.38Å; V180-E182 VanDerWaalsContact C-N 3.34Å; V180-E182 PolarHBondContact O-N 3.42Å; E182-S255 WeakPolarHBondContact OE2-CB 3.39Å; E182-P256 HydrophobicContact CB-CG 4.15Å; E182-P256 WeakPolarHBondContact OE2-CD 3.4Å
183E95Very high95.4Very high36 Ų3632 Ų3217%0.16816%0.159CC..Hα-helixtrans-69.2-45.3173.7-17960.6-158.600111.8K78 A124 G179 V180 Q181 K185 K186 Y187K78-E183 HydrophobicContact CD-CG 4.06Å; K78-E183 IonicContact NZ-OE1 3.56Å; K78-E183 PolarHBondContact NZ-OE1 3.39Å; A124-E183 HydrophobicContact CB-CB 3.91Å; G179-E183 PolarHBondContact O-N 3.21Å; G179-E183 VanDerWaalsContact O-N 3.13Å; V180-E183 WeakPolarHBondContact O-CB 3.41Å; V180-E183 PolarHBondContact O-N 3.21Å; Q181-E183 VanDerWaalsContact C-N 3.29Å; Q181-E183 PolarHBondContact O-N 2.97Å; E183-K185 VanDerWaalsContact C-N 3.26Å; E183-K185 PolarHBondContact O-N 3.13Å; E183-K186 WeakPolarHBondContact O-CB 3.11Å; E183-K186 PolarHBondContact O-N 3.32Å; E183-K186 VanDerWaalsContact O-N 3.16Å; E183-K186 VanDerWaalsContact OE2-CE 3.31Å; E183-K186 WeakPolarHBondContact OE2-CE 3.33Å; E183-K186 IonicContact OE2-NZ 3.54Å; E183-K186 PolarHBondContact OE2-NZ 2.87Å; E183-Y187 WeakPolarHBondContact O-CD2 3.27Å
184L94.7Very high95.3Very high0 Ų030.9 Ų30.90%015%0.153CC..Hα-helixtrans-59.2-37.7175.2-76.3166.1000111.6L75 K78 F79 C82 V180 Q181 K186 Y187 V189 L194L75-L184 HydrophobicContact CB-CD2 4.02Å; L75-L184 HydrophobicContact CD1-CD2 4.01Å; K78-L184 HydrophobicContact CB-CD2 3.71Å; K78-L184 HydrophobicContact CB-CG 4.14Å; K78-L184 HydrophobicContact CD-CD2 4.18Å; F79-L184 HydrophobicContact CD1-CD1 3.69Å; F79-L184 HydrophobicContact CD1-CD2 4Å; F79-L184 HydrophobicContact CE1-CD1 3.79Å; F79-L184 HydrophobicContact CE1-CD2 3.68Å; F79-L184 HydrophobicContact CE1-CG 4.31Å; F79-L184 HydrophobicContact CZ-CD2 3.99Å; C82-L184 HydrophobicContact CB-CD1 4.41Å; V180-L184 HydrophobicContact CG1-CD1 4.07Å; V180-L184 HydrophobicContact CG1-CG 4.4Å; V180-L184 WeakPolarHBondContact O-CG 3.39Å; V180-L184 PolarHBondContact O-N 2.84Å; Q181-L184 PolarHBondContact O-N 3.15Å; L184-K186 PolarHBondContact O-N 3.4Å; L184-K186 VanDerWaalsContact O-N 3.14Å; L184-Y187 PolarHBondContact O-N 3.3Å; L184-V189 HydrophobicContact CB-CG2 4.37Å; L184-V189 HydrophobicContact CD2-CG2 4.42Å; L184-V189 WeakPolarHBondContact O-CG2 3.17Å; L184-L194 HydrophobicContact CD1-CD1 3.8Å
185K92.5Very high95.3Very high49 Ų4930 Ų3021%0.21315%0.148CC..Hα-helixtrans-56.5-30.3176.9179.1173.6175.5154.80113.4Q181 E183 Y187 N188 T252 N253 F254Q181-K185 WeakPolarHBondContact O-CB 3.34Å; Q181-K185 PolarHBondContact O-N 2.84Å; E183-K185 VanDerWaalsContact C-N 3.26Å; E183-K185 PolarHBondContact O-N 3.13Å; K185-Y187 PolarHBondContact O-N 3.41Å; K185-N188 PolarHBondContact O-N 3.19Å; K185-T252 WeakPolarHBondContact CE-O 3.48Å; K185-T252 PolarHBondContact NZ-O 3Å; K185-N253 PolarHBondContact NZ-O 3.46Å; K185-F254 PolarHBondContact NZ-O 3.01Å
186K91.7Very high95.3Very high110 Ų11031.2 Ų31.248%0.47815%0.154SC..THydrogen-bonded Turntrans-62.6-22.6177-62.5177.6-178168.80113.4A124 E183 L184 N188A124-K186 WeakPolarHBondContact O-CE 3.45Å; A124-K186 PolarHBondContact O-NZ 3.21Å; E183-K186 WeakPolarHBondContact O-CB 3.11Å; E183-K186 PolarHBondContact O-N 3.32Å; E183-K186 VanDerWaalsContact O-N 3.16Å; E183-K186 VanDerWaalsContact OE2-CE 3.31Å; E183-K186 WeakPolarHBondContact OE2-CE 3.33Å; E183-K186 IonicContact OE2-NZ 3.54Å; E183-K186 PolarHBondContact OE2-NZ 2.87Å; L184-K186 PolarHBondContact O-N 3.4Å; L184-K186 VanDerWaalsContact O-N 3.14Å; K186-N188 VanDerWaalsContact C-N 3.32Å
187Y91.7Very high95.2Very high108 Ų10829.8 Ų29.842%0.42415%0.145SC..THydrogen-bonded Turntrans-94.713.1178.7-60-95.1000112.3L75 K78 E183 L184 K185 V189L75-Y187 VanDerWaalsContact CD1-CB 3.46Å; L75-Y187 HydrophobicContact CD1-CD1 3.85Å; L75-Y187 HydrophobicContact CD1-CD2 3.75Å; L75-Y187 HydrophobicContact CD1-CE2 4.47Å; L75-Y187 HydrophobicContact CD1-CG 3.4Å; L75-Y187 VanDerWaalsContact CD1-CG 3.4Å; L75-Y187 HydrophobicContact CD2-CD1 4.08Å; L75-Y187 HydrophobicContact CD2-CD2 4.25Å; L75-Y187 HydrophobicContact CD2-CE1 3.94Å; L75-Y187 HydrophobicContact CD2-CE2 4.16Å; L75-Y187 HydrophobicContact CD2-CG 4.22Å; L75-Y187 HydrophobicContact CG-CD1 4.48Å; L75-Y187 HydrophobicContact CG-CG 4.42Å; K78-Y187 PolarHBondContact NZ-OH 3.12Å; E183-Y187 WeakPolarHBondContact O-CD2 3.27Å; L184-Y187 PolarHBondContact O-N 3.3Å; K185-Y187 PolarHBondContact O-N 3.41Å; Y187-V189 PolarHBondContact O-N 3.4Å
188N90.7Very high95.1Very high151 Ų15129.5 Ų29.581%0.80714%0.143SC*.THydrogen-bonded Turntrans53.137.2-179.4-59.8-49.3000113.3K185 K186 G190K185-N188 PolarHBondContact O-N 3.19Å; K186-N188 VanDerWaalsContact C-N 3.32Å; N188-G190 PolarHBondContact O-N 3.02Å
189V93.2Very high95.2Very high9 Ų929.3 Ų29.36%0.05514%0.142CC..  trans-61.1127.5175.4-176.30000109.4V72 L75 F79 L184 Y187 T193 L194 T252V72-V189 HydrophobicContact CG2-CG2 3.79Å; L75-V189 HydrophobicContact CD1-CG2 4.18Å; F79-V189 HydrophobicContact CE1-CG1 3.94Å; F79-V189 HydrophobicContact CZ-CG1 3.74Å; F79-V189 HydrophobicContact CZ-CG2 4.14Å; L184-V189 HydrophobicContact CB-CG2 4.37Å; L184-V189 HydrophobicContact CD2-CG2 4.42Å; L184-V189 WeakPolarHBondContact O-CG2 3.17Å; Y187-V189 PolarHBondContact O-N 3.4Å; V189-T193 HydrophobicContact CG1-CG2 4.06Å; V189-L194 HydrophobicContact CG1-CB 4Å; V189-T252 WeakPolarHBondContact O-CG2 3.37Å
190G94Very high95.2Very high14 Ų1432 Ų3214%0.14416%0.156CC..  trans-63.3161.3177.100000113.4E69 N188 L194E69-G190 WeakPolarHBondContact OE1-CA 3.22Å; E69-G190 WeakPolarHBondContact OE2-CA 3.32Å; N188-G190 PolarHBondContact O-N 3.02Å; G190-L194 VanDerWaalsContact O-CB 3.27Å; G190-L194 WeakPolarHBondContact O-CB 3.39Å; G190-L194 PolarHBondContact O-N 2.9Å
191S95.5Very high95.2Very high17 Ų1734 Ų3412%0.11916%0.161CC..Hα-helixtrans-71.7-41.3-174.2-48.10000111.2E69 M195 F248 T252E69-S191 PolarHBondContact OE1-N 2.82Å; E69-S191 PolarHBondContact OE2-N 2.94Å; S191-M195 WeakPolarHBondContact O-CB 3.41Å; S191-M195 PolarHBondContact O-N 3.34Å; S191-F248 WeakPolarHBondContact O-CB 3.3Å; S191-T252 PolarHBondContact OG-OG1 3.05Å
192Y96.4Very high95.3Very high47 Ų4733.2 Ų33.218%0.18416%0.158CC..Hα-helixtrans-76.7-36.9179.8-50.1-61.1000110.7A63 W67 E69 L194 M195 M196 I245A63-Y192 HydrophobicContact CB-CD1 3.51Å; A63-Y192 HydrophobicContact CB-CD2 4.46Å; A63-Y192 HydrophobicContact CB-CE1 3.82Å; A63-Y192 HydrophobicContact CB-CG 3.87Å; W67-Y192 HydrophobicContact CB-CD2 4.13Å; W67-Y192 HydrophobicContact CB-CE2 3.73Å; W67-Y192 HydrophobicContact CD2-CE2 4.38Å; W67-Y192 HydrophobicContact CE3-CE2 4.27Å; W67-Y192 HydrophobicContact CG-CE2 4.19Å; E69-Y192 HydrophobicContact CG-CD2 4.27Å; E69-Y192 WeakPolarHBondContact OE1-CD2 3.27Å; E69-Y192 WeakPolarHBondContact OE2-CA 3.43Å; E69-Y192 WeakPolarHBondContact OE2-CB 3.37Å; E69-Y192 PolarHBondContact OE2-N 3.33Å; Y192-L194 PolarHBondContact O-N 2.84Å; Y192-M195 PolarHBondContact O-N 3.09Å; Y192-M196 VanDerWaalsContact O-CB 3.29Å; Y192-M196 WeakPolarHBondContact O-CB 3.37Å; Y192-M196 PolarHBondContact O-N 3.43Å; Y192-I245 HydrophobicContact CE1-CG1 4.48Å; Y192-I245 HydrophobicContact CE1-CG2 4.08Å
193T96Very high95.4Very high0 Ų034 Ų340%016%0.162CC..Hα-helixtrans-59.1-46.8171.1-560000110.8E69 V189 M196 H197E69-T193 VanDerWaalsContact CB-OG1 3.3Å; E69-T193 WeakPolarHBondContact CB-OG1 2.99Å; E69-T193 PolarHBondContact OE2-N 3.49Å; E69-T193 PolarHBondContact OE2-OG1 2.88Å; V189-T193 HydrophobicContact CG1-CG2 4.06Å; T193-M196 PolarHBondContact O-N 2.87Å; T193-H197 PolarHBondContact O-N 3.07Å; T193-H197 PolarHBondContact O-ND1 3.4Å
194L96.2Very high95.5Very high3 Ų336.1 Ų36.12%0.01617%0.173CC..Hα-helixtrans-63.9-44.6177.8-178.560.4000111.6F79 L184 V189 G190 Y192 M196 M198 F248 I251 T252F79-L194 HydrophobicContact CD1-CD1 4.09Å; F79-L194 HydrophobicContact CE1-CD1 3.78Å; L184-L194 HydrophobicContact CD1-CD1 3.8Å; V189-L194 HydrophobicContact CG1-CB 4Å; G190-L194 VanDerWaalsContact O-CB 3.27Å; G190-L194 WeakPolarHBondContact O-CB 3.39Å; G190-L194 PolarHBondContact O-N 2.9Å; Y192-L194 PolarHBondContact O-N 2.84Å; L194-M196 VanDerWaalsContact C-N 3.33Å; L194-M196 PolarHBondContact O-N 3.16Å; L194-M198 HydrophobicContact CD1-CG 4.08Å; L194-M198 HydrophobicContact CD1-SD 3.98Å; L194-M198 HydrophobicContact CG-SD 4.19Å; L194-M198 WeakPolarHBondContact O-CB 3.47Å; L194-M198 WeakPolarHBondContact O-CG 3.44Å; L194-M198 PolarHBondContact O-N 3.47Å; L194-F248 HydrophobicContact CB-CD1 4.16Å; L194-F248 HydrophobicContact CD2-CD1 3.71Å; L194-F248 HydrophobicContact CD2-CE1 4.03Å; L194-F248 HydrophobicContact CG-CD1 3.67Å; L194-F248 HydrophobicContact CG-CE1 3.71Å; L194-I251 HydrophobicContact CD2-CG2 3.72Å; L194-T252 HydrophobicContact CD2-CG2 4.24Å
195M96.8Very high95.6Very high0 Ų039.7 Ų39.70%019%0.188CC..Hα-helixtrans-58-44.8175.4-177.3174.2166.400111.8N56 F59 S191 Y192 N199 Q244 I245 F248N56-M195 HydrophobicContact CB-CE 4.13Å; N56-M195 WeakPolarHBondContact O-CE 3.26Å; F59-M195 HydrophobicContact CB-CE 4.35Å; S191-M195 WeakPolarHBondContact O-CB 3.41Å; S191-M195 PolarHBondContact O-N 3.34Å; Y192-M195 PolarHBondContact O-N 3.09Å; M195-N199 PolarHBondContact O-N 3.3Å; M195-N199 VanDerWaalsContact O-N 3.13Å; M195-N199 PolarHBondContact O-ND2 3Å; M195-Q244 HydrophobicContact CE-CB 3.72Å; M195-Q244 HydrophobicContact CG-CB 4.45Å; M195-Q244 HydrophobicContact SD-CB 3.92Å; M195-I245 HydrophobicContact CE-CG1 4.48Å; M195-I245 HydrophobicContact SD-CG1 4.18Å; M195-F248 HydrophobicContact CB-CB 4.37Å; M195-F248 HydrophobicContact CB-CD1 4.44Å; M195-F248 HydrophobicContact CB-CD2 3.4Å; M195-F248 VanDerWaalsContact CB-CD2 3.4Å; M195-F248 HydrophobicContact CB-CE2 3.74Å; M195-F248 HydrophobicContact CB-CG 3.81Å; M195-F248 HydrophobicContact CB-CZ 4.4Å; M195-F248 HydrophobicContact CG-CD2 3.54Å; M195-F248 HydrophobicContact CG-CE2 3.68Å; M195-F248 HydrophobicContact CG-CG 4.42Å; M195-F248 HydrophobicContact SD-CD2 4.09Å
196M97.2Very high95.8Very high26 Ų2637.7 Ų37.713%0.12818%0.179CC..Hα-helixtrans-62.3-55.2-179.9-175.1-169.870.200111.4F57 S60 L61 L64 Y192 T193 L194 M198 N199 L200F57-M196 HydrophobicContact CD2-CG 3.84Å; F57-M196 HydrophobicContact CE2-CG 3.51Å; F57-M196 HydrophobicContact CE2-SD 4.38Å; S60-M196 WeakPolarHBondContact OG-CA 3.28Å; S60-M196 VanDerWaalsContact OG-CB 3.24Å; S60-M196 WeakPolarHBondContact OG-CB 3.27Å; S60-M196 WeakPolarHBondContact OG-CG 3.47Å; L61-M196 HydrophobicContact CD2-CG 4.27Å; L61-M196 HydrophobicContact CD2-SD 3.6Å; L61-M196 VanDerWaalsContact CD2-SD 3.6Å; L64-M196 HydrophobicContact CD1-CB 3.94Å; L64-M196 HydrophobicContact CD1-CE 4.19Å; L64-M196 HydrophobicContact CD1-CG 4.22Å; L64-M196 HydrophobicContact CD1-SD 3.46Å; L64-M196 WeakPolarHBondContact CD1-SD 3.31Å; Y192-M196 VanDerWaalsContact O-CB 3.29Å; Y192-M196 WeakPolarHBondContact O-CB 3.37Å; Y192-M196 PolarHBondContact O-N 3.43Å; T193-M196 PolarHBondContact O-N 2.87Å; L194-M196 VanDerWaalsContact C-N 3.33Å; L194-M196 PolarHBondContact O-N 3.16Å; M196-M198 VanDerWaalsContact C-N 3.34Å; M196-M198 PolarHBondContact O-N 2.91Å; M196-N199 PolarHBondContact O-N 3.42Å; M196-L200 VanDerWaalsContact O-CB 3.28Å; M196-L200 WeakPolarHBondContact O-CB 3.23Å; M196-L200 PolarHBondContact O-N 3.33Å
197H96.5Very high96.1Very high11 Ų1135.7 Ų35.75%0.05118%0.176CC..Hα-helixtrans-65.5-38-176.5-68.582000111.7E76 F79 T193 L200 W201E76-H197 IonicContact OE1-CD2 3.55Å; E76-H197 PolarHBondContact OE1-CD2 3.44Å; E76-H197 IonicContact OE1-NE2 3.14Å; E76-H197 PolarHBondContact OE1-NE2 3Å; E76-H197 VanDerWaalsContact OE1-NE2 3.12Å; E76-H197 IonicContact OE2-CD2 2.7Å; F79-H197 HydrophobicContact CB-CB 3.82Å; F79-H197 HydrophobicContact CD1-CB 3.7Å; F79-H197 HydrophobicContact CD2-CB 3.9Å; F79-H197 AromaticContact CD2-CD2 3.64Å; F79-H197 AromaticContact CD2-CG 3.73Å; F79-H197 HydrophobicContact CE1-CB 4.2Å; F79-H197 HydrophobicContact CE2-CB 4.39Å; F79-H197 AromaticContact CE2-CD2 3.96Å; F79-H197 AromaticContact CE2-CG 3.93Å; F79-H197 HydrophobicContact CG-CB 3.54Å; F79-H197 AromaticContact CG-CG 3.93Å; T193-H197 PolarHBondContact O-N 3.07Å; T193-H197 PolarHBondContact O-ND1 3.4Å; H197-L200 PolarHBondContact O-N 3.02Å; H197-W201 WeakPolarHBondContact O-CB 3.37Å; H197-W201 VanDerWaalsContact O-CD1 3.26Å; H197-W201 PolarHBondContact O-N 3.35Å
198M95.9Very high96.2Very high0 Ų033.4 Ų33.40%017%0.174CC..Hα-helixtrans-63.3-43.7177.4-77.6-16958.400112.5Y86 T177 Q181 L194 M196 S202 F248Y86-M198 VanDerWaalsContact CB-CE 3.47Å; Y86-M198 HydrophobicContact CD1-CE 4.03Å; Y86-M198 HydrophobicContact CD2-CE 3.68Å; Y86-M198 HydrophobicContact CE2-CE 4.4Å; Y86-M198 HydrophobicContact CG-CE 3.44Å; Y86-M198 VanDerWaalsContact CG-CE 3.44Å; T177-M198 HydrophobicContact CG2-CE 3.89Å; Q181-M198 HydrophobicContact CG-SD 4.27Å; Q181-M198 PolarHBondContact NE2-SD 2.84Å; L194-M198 HydrophobicContact CD1-CG 4.08Å; L194-M198 HydrophobicContact CD1-SD 3.98Å; L194-M198 HydrophobicContact CG-SD 4.19Å; L194-M198 WeakPolarHBondContact O-CB 3.47Å; L194-M198 WeakPolarHBondContact O-CG 3.44Å; L194-M198 PolarHBondContact O-N 3.47Å; M196-M198 VanDerWaalsContact C-N 3.34Å; M196-M198 PolarHBondContact O-N 2.91Å; M198-S202 WeakPolarHBondContact O-CB 3.36Å; M198-S202 PolarHBondContact O-N 3.37Å; M198-S202 PolarHBondContact O-OG 3.07Å; M198-F248 HydrophobicContact CB-CZ 4.15Å; M198-F248 HydrophobicContact CE-CE1 4.32Å; M198-F248 HydrophobicContact CE-CZ 4.14Å; M198-F248 HydrophobicContact CG-CE1 4.37Å; M198-F248 HydrophobicContact CG-CZ 4.41Å; M198-F248 HydrophobicContact SD-CE1 3.37Å; M198-F248 WeakPolarHBondContact SD-CE1 3.47Å; M198-F248 HydrophobicContact SD-CZ 3.66Å
199N97.7Very high96.4Very high0 Ų029.1 Ų29.10%015%0.153CC..Hα-helixtrans-73.9-36.2177.7-73.1-79.8000112.1N56 F57 M195 M196 S202 I203 Q244N56-N199 HydrophobicContact CB-CB 4.27Å; N56-N199 VanDerWaalsContact CB-CG 3.41Å; N56-N199 VanDerWaalsContact CB-OD1 3.25Å; N56-N199 WeakPolarHBondContact CB-OD1 3.37Å; N56-N199 PolarHBondContact ND2-OD1 3.4Å; F57-N199 HydrophobicContact CB-CB 4.08Å; M195-N199 PolarHBondContact O-N 3.3Å; M195-N199 VanDerWaalsContact O-N 3.13Å; M195-N199 PolarHBondContact O-ND2 3Å; M196-N199 PolarHBondContact O-N 3.42Å; N199-S202 WeakPolarHBondContact O-CB 3.21Å; N199-S202 PolarHBondContact O-N 3.44Å; N199-I203 WeakPolarHBondContact O-CD1 3.34Å; N199-I203 VanDerWaalsContact O-CG1 3.25Å; N199-I203 WeakPolarHBondContact O-CG1 3.38Å; N199-I203 PolarHBondContact O-N 3.08Å; N199-Q244 PolarHBondContact ND2-OE1 3.16Å
200L97.7Very high96.5Very high56 Ų5629 Ų2929%0.29315%0.152SC..Hα-helixtrans-59.5-52.9175.2179.561.2000111.5F57 M196 H197 S202 I203 I204F57-L200 HydrophobicContact CD2-CB 3.9Å; F57-L200 HydrophobicContact CD2-CD1 4.48Å; F57-L200 HydrophobicContact CE1-CD1 4.49Å; F57-L200 HydrophobicContact CE2-CB 3.73Å; F57-L200 HydrophobicContact CE2-CD1 3.89Å; F57-L200 HydrophobicContact CE2-CD2 4.29Å; F57-L200 HydrophobicContact CE2-CG 4.18Å; F57-L200 HydrophobicContact CZ-CD1 3.9Å; M196-L200 VanDerWaalsContact O-CB 3.28Å; M196-L200 WeakPolarHBondContact O-CB 3.23Å; M196-L200 PolarHBondContact O-N 3.33Å; H197-L200 PolarHBondContact O-N 3.02Å; L200-S202 VanDerWaalsContact C-N 3.28Å; L200-S202 PolarHBondContact O-N 3.03Å; L200-I203 WeakPolarHBondContact O-CB 3.4Å; L200-I203 PolarHBondContact O-N 2.88Å; L200-I203 VanDerWaalsContact O-N 3.15Å; L200-I204 HydrophobicContact CD1-CD1 4.43Å; L200-I204 HydrophobicContact CG-CD1 4.18Å; L200-I204 WeakPolarHBondContact O-CG1 3.47Å; L200-I204 PolarHBondContact O-N 3.24Å
201W97.8Very high96.5Very high57 Ų5732.8 Ų32.822%0.21617%0.173CC..Hα-helixtrans-63.2-36.4177.1-80.4105.9000111.6E76 S80 H197 I203 I204 Y205E76-W201 PolarHBondContact OE2-NE1 3.2Å; S80-W201 WeakPolarHBondContact OG-CZ3 3.43Å; H197-W201 WeakPolarHBondContact O-CB 3.37Å; H197-W201 VanDerWaalsContact O-CD1 3.26Å; H197-W201 PolarHBondContact O-N 3.35Å; W201-I203 VanDerWaalsContact C-N 3.35Å; W201-I203 PolarHBondContact O-N 3.41Å; W201-I204 HydrophobicContact CD2-CD1 4.37Å; W201-I204 HydrophobicContact CE3-CB 4.5Å; W201-I204 HydrophobicContact CE3-CD1 4.11Å; W201-I204 HydrophobicContact CE3-CG2 4.37Å; W201-I204 HydrophobicContact CZ3-CD1 4.43Å; W201-I204 HydrophobicContact CZ3-CG2 4.45Å; W201-I204 PolarHBondContact O-N 3.47Å; W201-Y205 HydrophobicContact CB-CE2 4.33Å; W201-Y205 AromaticContact CE3-CE2 3.96Å; W201-Y205 HydrophobicContact CE3-CE2 3.96Å; W201-Y205 WeakPolarHBondContact O-CD2 3.28Å; W201-Y205 PolarHBondContact O-N 3.48Å
202S97.8Very high96.4Very high0 Ų040.6 Ų40.60%021%0.205CC..Hα-helixtrans-60.4-42.4173.3-59.20000112.2G83 M198 N199 L200 Y205 L206G83-S202 PolarHBondContact O-OG 3.16Å; M198-S202 WeakPolarHBondContact O-CB 3.36Å; M198-S202 PolarHBondContact O-N 3.37Å; M198-S202 PolarHBondContact O-OG 3.07Å; N199-S202 WeakPolarHBondContact O-CB 3.21Å; N199-S202 PolarHBondContact O-N 3.44Å; L200-S202 VanDerWaalsContact C-N 3.28Å; L200-S202 PolarHBondContact O-N 3.03Å; S202-Y205 PolarHBondContact O-N 2.98Å; S202-L206 WeakPolarHBondContact O-CB 3.39Å; S202-L206 WeakPolarHBondContact O-CG 3.39Å; S202-L206 PolarHBondContact O-N 3.37Å
203I97.9Very high96.2Very high20 Ų2041.2 Ų41.210%0.10322%0.216CC..Hα-helixtrans-61.7-47.5174.9-68.2155.4000110.3L50 C53 M54 F57 N199 L200 W201 Y205 L206 V207L50-I203 HydrophobicContact CD1-CB 4.42Å; L50-I203 HydrophobicContact CD1-CG1 4.29Å; L50-I203 HydrophobicContact CD1-CG2 4.02Å; C53-I203 HydrophobicContact CB-CD1 4.4Å; C53-I203 HydrophobicContact CB-CG1 3.79Å; M54-I203 HydrophobicContact CG-CD1 4.3Å; M54-I203 HydrophobicContact CG-CG1 4.36Å; M54-I203 HydrophobicContact SD-CD1 3.52Å; M54-I203 VanDerWaalsContact SD-CD1 3.52Å; M54-I203 HydrophobicContact SD-CG1 3.89Å; M54-I203 HydrophobicContact SD-CG2 3.95Å; F57-I203 HydrophobicContact CB-CD1 3.76Å; F57-I203 HydrophobicContact CD1-CD1 4.36Å; F57-I203 HydrophobicContact CG-CD1 4.09Å; N199-I203 WeakPolarHBondContact O-CD1 3.34Å; N199-I203 VanDerWaalsContact O-CG1 3.25Å; N199-I203 WeakPolarHBondContact O-CG1 3.38Å; N199-I203 PolarHBondContact O-N 3.08Å; L200-I203 WeakPolarHBondContact O-CB 3.4Å; L200-I203 PolarHBondContact O-N 2.88Å; L200-I203 VanDerWaalsContact O-N 3.15Å; W201-I203 VanDerWaalsContact C-N 3.35Å; W201-I203 PolarHBondContact O-N 3.41Å; I203-Y205 PolarHBondContact O-N 2.93Å; I203-L206 PolarHBondContact O-N 3.4Å; I203-L206 VanDerWaalsContact O-N 3.15Å; I203-V207 HydrophobicContact CG2-CG2 4.08Å; I203-V207 WeakPolarHBondContact O-CG2 3.23Å; I203-V207 PolarHBondContact O-N 3.47Å
204I97.9Very high95.9Very high80 Ų8043.2 Ų43.241%0.4124%0.237SC..Hα-helixtrans-56.6-40.1178.8-68.6167.9000111.1L200 W201 P208L200-I204 HydrophobicContact CD1-CD1 4.43Å; L200-I204 HydrophobicContact CG-CD1 4.18Å; L200-I204 WeakPolarHBondContact O-CG1 3.47Å; L200-I204 PolarHBondContact O-N 3.24Å; W201-I204 HydrophobicContact CD2-CD1 4.37Å; W201-I204 HydrophobicContact CE3-CB 4.5Å; W201-I204 HydrophobicContact CE3-CD1 4.11Å; W201-I204 HydrophobicContact CE3-CG2 4.37Å; W201-I204 HydrophobicContact CZ3-CD1 4.43Å; W201-I204 HydrophobicContact CZ3-CG2 4.45Å; W201-I204 PolarHBondContact O-N 3.47Å; I204-P208 WeakPolarHBondContact O-CD 3.46Å
205Y97.3Very high95.7Very high76 Ų7644.2 Ų44.230%0.29824%0.241SC..Hα-helixtrans-76.2-35.7176.9-70.3-57.9000113.7S80 F84 W201 S202 I203 V209S80-Y205 WeakPolarHBondContact O-CE2 3.47Å; S80-Y205 PolarHBondContact OG-OH 2.94Å; F84-Y205 HydrophobicContact CB-CD2 3.95Å; F84-Y205 HydrophobicContact CB-CE2 3.61Å; F84-Y205 HydrophobicContact CD2-CD1 4.15Å; F84-Y205 HydrophobicContact CD2-CD2 4.27Å; F84-Y205 HydrophobicContact CD2-CE1 4.23Å; F84-Y205 HydrophobicContact CD2-CE2 4.39Å; F84-Y205 HydrophobicContact CD2-CG 4.18Å; F84-Y205 HydrophobicContact CG-CE2 4.49Å; W201-Y205 HydrophobicContact CB-CE2 4.33Å; W201-Y205 AromaticContact CE3-CE2 3.96Å; W201-Y205 HydrophobicContact CE3-CE2 3.96Å; W201-Y205 WeakPolarHBondContact O-CD2 3.28Å; W201-Y205 PolarHBondContact O-N 3.48Å; S202-Y205 PolarHBondContact O-N 2.98Å; I203-Y205 PolarHBondContact O-N 2.93Å; Y205-V209 VanDerWaalsContact O-CG2 3.31Å; Y205-V209 WeakPolarHBondContact O-CG2 2.98Å
206L96.7Very high95.5Very high6 Ų647 Ų473%0.03126%0.258CS..Hα-helixtrans-71.6-39.1-178.7-77.6168.2000113.1F46 L49 L50 I87 S202 I203 V209 I210F46-L206 HydrophobicContact CD1-CD2 4.06Å; L49-L206 HydrophobicContact CB-CD1 4.22Å; L49-L206 HydrophobicContact CB-CD2 4.4Å; L50-L206 HydrophobicContact CB-CD1 4.17Å; L50-L206 HydrophobicContact CD1-CB 4.11Å; L50-L206 HydrophobicContact CD1-CD1 4.38Å; I87-L206 HydrophobicContact CD1-CD1 3.74Å; I87-L206 HydrophobicContact CD1-CD2 4.12Å; I87-L206 HydrophobicContact CD1-CG 4.15Å; I87-L206 HydrophobicContact CG1-CD1 3.8Å; I87-L206 HydrophobicContact CG1-CD2 3.72Å; I87-L206 HydrophobicContact CG1-CG 3.67Å; S202-L206 WeakPolarHBondContact O-CB 3.39Å; S202-L206 WeakPolarHBondContact O-CG 3.39Å; S202-L206 PolarHBondContact O-N 3.37Å; I203-L206 PolarHBondContact O-N 3.4Å; I203-L206 VanDerWaalsContact O-N 3.15Å; L206-V209 PolarHBondContact O-N 3.05Å; L206-V209 VanDerWaalsContact O-N 3.17Å; L206-I210 HydrophobicContact CB-CD1 4.11Å; L206-I210 WeakPolarHBondContact O-CB 3.31Å; L206-I210 VanDerWaalsContact O-CG1 3.29Å; L206-I210 WeakPolarHBondContact O-CG1 3.21Å; L206-I210 PolarHBondContact O-N 2.93Å
207V96.6Very high95.3Very high68 Ų6849.1 Ų49.141%0.41228%0.275SS..Hα-helixtrans-57.7-51.6-173.5166.60000111.9L50 I203 V209 I210 V211L50-V207 HydrophobicContact CD1-CG2 3.99Å; I203-V207 HydrophobicContact CG2-CG2 4.08Å; I203-V207 WeakPolarHBondContact O-CG2 3.23Å; I203-V207 PolarHBondContact O-N 3.47Å; V207-V209 PolarHBondContact O-N 2.74Å; V207-I210 PolarHBondContact O-N 2.89Å; V207-V211 VanDerWaalsContact O-CG2 3.31Å; V207-V211 WeakPolarHBondContact O-CG2 3.35Å; V207-V211 PolarHBondContact O-N 3.42Å; V207-V211 VanDerWaalsContact O-N 3.08Å
208P95.7Very high95.1Very high60 Ų6051.2 Ų51.239%0.3929%0.29SS..Hα-helixtrans-60.8-42.9175.6-23.333.7000112.4I204 I210 V211 F212I204-P208 WeakPolarHBondContact O-CD 3.46Å; P208-I210 VanDerWaalsContact C-N 3.32Å; P208-I210 PolarHBondContact O-N 3.23Å; P208-V211 PolarHBondContact O-N 3.03Å; P208-F212 HydrophobicContact CB-CD2 4.2Å; P208-F212 HydrophobicContact CB-CE2 4.11Å; P208-F212 WeakPolarHBondContact O-CB 3.4Å; P208-F212 WeakPolarHBondContact O-CD2 3.41Å; P208-F212 WeakPolarHBondContact O-CG 3.32Å; P208-F212 PolarHBondContact O-N 2.89Å
209V95Very high95.1Very high61 Ų6152.3 Ų52.337%0.3730%0.295SS..Hα-helixtrans-61.2-42.8-178.6174.10000111.2F46 Y205 L206 V207 F212 S213F46-V209 HydrophobicContact CD1-CG1 3.86Å; F46-V209 HydrophobicContact CD2-CG1 4.3Å; F46-V209 HydrophobicContact CE1-CG1 3.49Å; F46-V209 VanDerWaalsContact CE1-CG1 3.49Å; F46-V209 HydrophobicContact CE2-CG1 3.98Å; F46-V209 HydrophobicContact CG-CG1 4.24Å; F46-V209 HydrophobicContact CZ-CG1 3.55Å; Y205-V209 VanDerWaalsContact O-CG2 3.31Å; Y205-V209 WeakPolarHBondContact O-CG2 2.98Å; L206-V209 PolarHBondContact O-N 3.05Å; L206-V209 VanDerWaalsContact O-N 3.17Å; V207-V209 PolarHBondContact O-N 2.74Å; V209-F212 PolarHBondContact O-N 3.13Å; V209-S213 VanDerWaalsContact O-CB 3.23Å; V209-S213 WeakPolarHBondContact O-CB 3.28Å; V209-S213 PolarHBondContact O-N 3.42Å; V209-S213 PolarHBondContact O-OG 3.41Å
210I93.9Very high94.9Very high6 Ų656.6 Ų56.63%0.03132%0.317CS..Hα-helixtrans-65.5-43.5178-70.8163.9000110.8F46 L50 L206 V207 P208 S213 G214 V216F46-I210 HydrophobicContact CB-CD1 4.04Å; F46-I210 HydrophobicContact CB-CG1 3.41Å; F46-I210 VanDerWaalsContact CB-CG1 3.41Å; F46-I210 HydrophobicContact CG-CG1 4.37Å; F46-I210 WeakPolarHBondContact O-CD1 3.26Å; L50-I210 HydrophobicContact CB-CD1 3.51Å; L50-I210 HydrophobicContact CD2-CD1 3.58Å; L50-I210 HydrophobicContact CG-CD1 4.05Å; L206-I210 HydrophobicContact CB-CD1 4.11Å; L206-I210 WeakPolarHBondContact O-CB 3.31Å; L206-I210 VanDerWaalsContact O-CG1 3.29Å; L206-I210 WeakPolarHBondContact O-CG1 3.21Å; L206-I210 PolarHBondContact O-N 2.93Å; V207-I210 PolarHBondContact O-N 2.89Å; P208-I210 VanDerWaalsContact C-N 3.32Å; P208-I210 PolarHBondContact O-N 3.23Å; I210-S213 WeakPolarHBondContact CA-OG 3.49Å; I210-S213 PolarHBondContact O-N 3.14Å; I210-S213 PolarHBondContact O-OG 2.85Å; I210-G214 PolarHBondContact O-N 3.3Å; I210-V216 HydrophobicContact CG2-CG2 3.34Å
211V93.7Very high94.8Very high95 Ų9558.4 Ų58.458%0.57632%0.324SS*.Hα-helixtrans-62.5-46.5176.61730000110.9V207 P208 G214V207-V211 VanDerWaalsContact O-CG2 3.31Å; V207-V211 WeakPolarHBondContact O-CG2 3.35Å; V207-V211 PolarHBondContact O-N 3.42Å; V207-V211 VanDerWaalsContact O-N 3.08Å; P208-V211 PolarHBondContact O-N 3.03Å; V211-G214 PolarHBondContact O-N 2.9Å
212F93.8Very high94.6Very high181 Ų18155.8 Ų55.879%0.79432%0.315SS*.Hα-helixtrans-68.9-33179.1-74.7-59.5000113.5P208 V209 G214P208-F212 HydrophobicContact CB-CD2 4.2Å; P208-F212 HydrophobicContact CB-CE2 4.11Å; P208-F212 WeakPolarHBondContact O-CB 3.4Å; P208-F212 WeakPolarHBondContact O-CD2 3.41Å; P208-F212 WeakPolarHBondContact O-CG 3.32Å; P208-F212 PolarHBondContact O-N 2.89Å; V209-F212 PolarHBondContact O-N 3.13Å; F212-G214 PolarHBondContact O-N 3.24Å
213S91.4Very high94.4Very high59 Ų5957.5 Ų57.541%0.41332%0.323SS..Hα-helixtrans-70-16.6175.869.20000113.3V209 I210 E215V209-S213 VanDerWaalsContact O-CB 3.23Å; V209-S213 WeakPolarHBondContact O-CB 3.28Å; V209-S213 PolarHBondContact O-N 3.42Å; V209-S213 PolarHBondContact O-OG 3.41Å; I210-S213 WeakPolarHBondContact CA-OG 3.49Å; I210-S213 PolarHBondContact O-N 3.14Å; I210-S213 PolarHBondContact O-OG 2.85Å; S213-E215 PolarHBondContact O-N 3.35Å; S213-E215 VanDerWaalsContact OG-CB 3.3Å; S213-E215 WeakPolarHBondContact OG-CB 3.34Å; S213-E215 PolarHBondContact OG-N 3.03Å
214G91.1Very high94.2Very high43 Ų4364.8 Ų64.844%0.44335%0.354SS..THydrogen-bonded Turntrans69.99.8-174.700000114I210 V211 F212 V216 P218I210-G214 PolarHBondContact O-N 3.3Å; V211-G214 PolarHBondContact O-N 2.9Å; F212-G214 PolarHBondContact O-N 3.24Å; G214-V216 VanDerWaalsContact C-N 3.26Å; G214-V216 PolarHBondContact O-N 3.4Å; G214-P218 WeakPolarHBondContact O-CD 3.12Å
215E91.9Very high94Very high23 Ų2366.4 Ų66.411%0.10736%0.355CS..THydrogen-bonded Turntrans-68.3-23.1-173-161.3-171.2113.100113.1F44 F46 S47 S213 S217 P218 F219F44-E215 VanDerWaalsContact CA-CD 3.5Å; F44-E215 WeakPolarHBondContact CA-OE1 3.47Å; F44-E215 HydrophobicContact CB-CG 4.2Å; F44-E215 WeakPolarHBondContact CB-OE1 3.37Å; F44-E215 HydrophobicContact CD1-CG 3.43Å; F44-E215 VanDerWaalsContact CD1-CG 3.43Å; F44-E215 HydrophobicContact CE1-CG 4.26Å; F44-E215 HydrophobicContact CG-CG 4.26Å; F46-E215 WeakPolarHBondContact CD2-OE2 3.48Å; S47-E215 VanDerWaalsContact CB-OE1 3.23Å; S47-E215 WeakPolarHBondContact CB-OE1 3.25Å; S47-E215 PolarHBondContact N-OE1 2.97Å; S47-E215 PolarHBondContact OG-OE1 3.04Å; S213-E215 PolarHBondContact O-N 3.35Å; S213-E215 VanDerWaalsContact OG-CB 3.3Å; S213-E215 WeakPolarHBondContact OG-CB 3.34Å; S213-E215 PolarHBondContact OG-N 3.03Å; E215-S217 PolarHBondContact O-N 2.72Å; E215-P218 WeakPolarHBondContact O-CD 3.39Å; E215-F219 WeakPolarHBondContact O-CB 3.36Å; E215-F219 PolarHBondContact O-N 2.96Å
216V91.9Very high93.8Very high59 Ų5964 Ų6436%0.35835%0.347SS..Hα-helixtrans-56.3-51.2-175.2-174.30000112.4I210 G214 F219 L220I210-V216 HydrophobicContact CG2-CG2 3.34Å; G214-V216 VanDerWaalsContact C-N 3.26Å; G214-V216 PolarHBondContact O-N 3.4Å; V216-F219 PolarHBondContact O-N 3Å; V216-L220 HydrophobicContact CG1-CD1 3.92Å; V216-L220 HydrophobicContact CG1-CG 4.38Å; V216-L220 WeakPolarHBondContact O-CB 3.32Å; V216-L220 VanDerWaalsContact O-CG 3.28Å; V216-L220 WeakPolarHBondContact O-CG 3.28Å; V216-L220 PolarHBondContact O-N 3.38Å
217S92.7Very high93.6Very high70 Ų7068.1 Ų68.149%0.4937%0.373SS..Hα-helixtrans-67.6-51.3-174.8-164.90000111.6E215 F219 L220 E221E215-S217 PolarHBondContact O-N 2.72Å; S217-F219 VanDerWaalsContact C-N 3.29Å; S217-F219 PolarHBondContact O-N 2.94Å; S217-L220 PolarHBondContact O-N 2.83Å; S217-E221 WeakPolarHBondContact O-CG 3.38Å; S217-E221 PolarHBondContact O-N 3.41Å
218P93.9Very high93.3Very high55 Ų5570 Ų7036%0.35738%0.378SS..Hα-helixtrans-57.8-38.2174.5-26.536.7000113.6F44 G214 E215 E221 F222F44-P218 HydrophobicContact CE1-CB 3.64Å; F44-P218 HydrophobicContact CZ-CB 3.88Å; G214-P218 WeakPolarHBondContact O-CD 3.12Å; E215-P218 WeakPolarHBondContact O-CD 3.39Å; P218-E221 PolarHBondContact O-N 3.48Å; P218-F222 WeakPolarHBondContact O-CB 3.18Å; P218-F222 PolarHBondContact O-N 2.8Å
219F94.7Very high93.2Very high24 Ų2467.1 Ų67.111%0.10536%0.359CS..Hα-helixtrans-65-45.5177.2170.4-110.5000112.2F42 F44 E215 V216 S217 E221 F222 I223 M233F42-F219 HydrophobicContact CE2-CD2 4.14Å; F42-F219 AromaticContact CE2-CE2 3.91Å; F42-F219 HydrophobicContact CE2-CE2 3.91Å; F42-F219 HydrophobicContact CZ-CD2 4.43Å; F42-F219 HydrophobicContact CZ-CE2 4.08Å; F44-F219 HydrophobicContact CB-CB 4.21Å; F44-F219 HydrophobicContact CB-CD2 3.56Å; F44-F219 HydrophobicContact CB-CE2 4.35Å; F44-F219 HydrophobicContact CB-CG 4.25Å; F44-F219 HydrophobicContact CD1-CB 4.1Å; F44-F219 HydrophobicContact CD2-CB 4.32Å; F44-F219 AromaticContact CD2-CD2 3.96Å; F44-F219 HydrophobicContact CD2-CD2 3.96Å; F44-F219 HydrophobicContact CG-CB 3.93Å; F44-F219 AromaticContact CG-CD2 3.87Å; F44-F219 HydrophobicContact CG-CD2 3.87Å; F44-F219 HydrophobicContact CG-CG 4.38Å; E215-F219 WeakPolarHBondContact O-CB 3.36Å; E215-F219 PolarHBondContact O-N 2.96Å; V216-F219 PolarHBondContact O-N 3Å; S217-F219 VanDerWaalsContact C-N 3.29Å; S217-F219 PolarHBondContact O-N 2.94Å; F219-E221 VanDerWaalsContact C-N 3.33Å; F219-E221 PolarHBondContact O-N 3.16Å; F219-F222 WeakPolarHBondContact O-CB 3.34Å; F219-F222 PolarHBondContact O-N 2.81Å; F219-I223 HydrophobicContact CD1-CD1 4.09Å; F219-I223 HydrophobicContact CD2-CD1 4.26Å; F219-I223 HydrophobicContact CE1-CD1 3.47Å; F219-I223 VanDerWaalsContact CE1-CD1 3.47Å; F219-I223 HydrophobicContact CE2-CD1 3.67Å; F219-I223 HydrophobicContact CE2-CG1 4.15Å; F219-I223 HydrophobicContact CG-CD1 4.46Å; F219-I223 HydrophobicContact CZ-CD1 3.25Å; F219-I223 HydrophobicContact CZ-CG1 4.22Å; F219-I223 WeakPolarHBondContact O-CG1 3.43Å; F219-I223 PolarHBondContact O-N 2.98Å; F219-M233 HydrophobicContact CE2-CE 4.06Å; F219-M233 HydrophobicContact CE2-SD 4.13Å; F219-M233 HydrophobicContact CZ-CE 3.73Å; F219-M233 HydrophobicContact CZ-SD 4.2Å
220L94.1Very high93.1Very high89 Ų8969.4 Ų69.447%0.46636%0.364SS..Hα-helixtrans-64.5-38.7176.8-71.7175.4000111.8V216 S217 I223 K224V216-L220 HydrophobicContact CG1-CD1 3.92Å; V216-L220 HydrophobicContact CG1-CG 4.38Å; V216-L220 WeakPolarHBondContact O-CB 3.32Å; V216-L220 VanDerWaalsContact O-CG 3.28Å; V216-L220 WeakPolarHBondContact O-CG 3.28Å; V216-L220 PolarHBondContact O-N 3.38Å; S217-L220 PolarHBondContact O-N 2.83Å; L220-I223 PolarHBondContact O-N 3.4Å; L220-K224 VanDerWaalsContact O-CG 3.31Å; L220-K224 WeakPolarHBondContact O-CG 3.48Å; L220-K224 PolarHBondContact O-N 2.84Å
221E94.4Very high93.1Very high95 Ų9575.7 Ų75.744%0.44439%0.388SS..Hα-helixtrans-64.4-41.3173.3-73175.9-162.200112.1S217 P218 F219 K224 R225S217-E221 WeakPolarHBondContact O-CG 3.38Å; S217-E221 PolarHBondContact O-N 3.41Å; P218-E221 PolarHBondContact O-N 3.48Å; F219-E221 VanDerWaalsContact C-N 3.33Å; F219-E221 PolarHBondContact O-N 3.16Å; E221-K224 WeakPolarHBondContact O-CB 3.35Å; E221-K224 PolarHBondContact O-N 3.05Å; E221-R225 WeakPolarHBondContact O-CG 3.45Å; E221-R225 PolarHBondContact O-N 3.24Å; E221-R225 IonicContact OE2-NH1 3.87Å
222F93.8Very high93.2Very high2 Ų271.2 Ų71.21%0.00936%0.361CS..Hα-helixtrans-61.7-45175.7-175-83.2000111.8Y35 E40 F42 F44 P218 F219 K224 R225 H226 I229Y35-F222 HydrophobicContact CD2-CE1 4.37Å; Y35-F222 AromaticContact CD2-CZ 3.66Å; Y35-F222 HydrophobicContact CD2-CZ 3.66Å; Y35-F222 HydrophobicContact CE2-CZ 4.3Å; Y35-F222 HydrophobicContact CG-CE1 4.45Å; Y35-F222 AromaticContact CG-CZ 3.85Å; Y35-F222 HydrophobicContact CG-CZ 3.85Å; E40-F222 HydrophobicContact CB-CE2 3.9Å; F42-F222 HydrophobicContact CD2-CD1 4.3Å; F42-F222 AromaticContact CD2-CE1 3.96Å; F42-F222 HydrophobicContact CD2-CE1 3.96Å; F42-F222 HydrophobicContact CD2-CZ 4.43Å; F44-F222 HydrophobicContact CD2-CB 4.16Å; F44-F222 HydrophobicContact CD2-CD1 4.48Å; F44-F222 HydrophobicContact CD2-CG 4.15Å; F44-F222 HydrophobicContact CE2-CB 3.44Å; F44-F222 VanDerWaalsContact CE2-CB 3.44Å; F44-F222 HydrophobicContact CE2-CD1 4.31Å; F44-F222 AromaticContact CE2-CD2 3.71Å; F44-F222 HydrophobicContact CE2-CD2 3.71Å; F44-F222 AromaticContact CE2-CG 3.55Å; F44-F222 HydrophobicContact CE2-CG 3.55Å; F44-F222 HydrophobicContact CZ-CB 4.18Å; P218-F222 WeakPolarHBondContact O-CB 3.18Å; P218-F222 PolarHBondContact O-N 2.8Å; F219-F222 WeakPolarHBondContact O-CB 3.34Å; F219-F222 PolarHBondContact O-N 2.81Å; F222-K224 VanDerWaalsContact C-N 3.29Å; F222-K224 PolarHBondContact O-N 3.4Å; F222-R225 PolarHBondContact O-N 3.28Å; F222-H226 HydrophobicContact CE1-CB 4.21Å; F222-H226 AromaticContact CE2-CD2 3.75Å; F222-H226 AromaticContact CZ-CD2 3.75Å; F222-H226 PolarHBondContact O-N 2.9Å; F222-I229 HydrophobicContact CD1-CD1 4.24Å; F222-I229 HydrophobicContact CE1-CD1 3.54Å; F222-I229 HydrophobicContact CE1-CG2 4.4Å; F222-I229 HydrophobicContact CZ-CD1 4.45Å
223I93.3Very high93.3Very high35 Ų3562.6 Ų62.618%0.17932%0.324CS..Hα-helixtrans-60-41.7175.1-70.4173000110.9F219 L220 R225 H226 P227 I229F219-I223 HydrophobicContact CD1-CD1 4.09Å; F219-I223 HydrophobicContact CD2-CD1 4.26Å; F219-I223 HydrophobicContact CE1-CD1 3.47Å; F219-I223 VanDerWaalsContact CE1-CD1 3.47Å; F219-I223 HydrophobicContact CE2-CD1 3.67Å; F219-I223 HydrophobicContact CE2-CG1 4.15Å; F219-I223 HydrophobicContact CG-CD1 4.46Å; F219-I223 HydrophobicContact CZ-CD1 3.25Å; F219-I223 HydrophobicContact CZ-CG1 4.22Å; F219-I223 WeakPolarHBondContact O-CG1 3.43Å; F219-I223 PolarHBondContact O-N 2.98Å; L220-I223 PolarHBondContact O-N 3.4Å; I223-R225 VanDerWaalsContact C-N 3.34Å; I223-R225 PolarHBondContact O-N 3.34Å; I223-H226 CarbonylContact O-C 3.54Å; I223-H226 VanDerWaalsContact O-C 3.22Å; I223-H226 PolarHBondContact O-N 3.19Å; I223-P227 VanDerWaalsContact O-CA 3.31Å; I223-P227 WeakPolarHBondContact O-CA 3.35Å; I223-P227 VanDerWaalsContact O-N 3.11Å; I223-I229 HydrophobicContact CG1-CG2 3.99Å
224K93.9Very high93.5Very high173 Ų17361.2 Ų61.275%0.75231%0.314SS*.Hα-helixtrans-62.8-39.1177.3-74.1173.1-177.6178.60112.2L220 E221 F222L220-K224 VanDerWaalsContact O-CG 3.31Å; L220-K224 WeakPolarHBondContact O-CG 3.48Å; L220-K224 PolarHBondContact O-N 2.84Å; E221-K224 WeakPolarHBondContact O-CB 3.35Å; E221-K224 PolarHBondContact O-N 3.05Å; F222-K224 VanDerWaalsContact C-N 3.29Å; F222-K224 PolarHBondContact O-N 3.4Å
225R94.3Very high93.8Very high114 Ų11460.7 Ų60.743%0.4330%0.3SS..Hα-helixtrans-70.9-35.4175.4-69.1-166.4-62.4-90.84.7112.5E40 E221 F222 I223E40-R225 IonicContact OE1-NE 3.62Å; E40-R225 IonicContact OE1-NH2 2.72Å; E40-R225 IonicContact OE2-CZ 2.75Å; E40-R225 IonicContact OE2-NE 3.64Å; E40-R225 PolarHBondContact OE2-NE 3.03Å; E40-R225 IonicContact OE2-NH2 2.68Å; E40-R225 PolarHBondContact OE2-NH2 3.02Å; E221-R225 WeakPolarHBondContact O-CG 3.45Å; E221-R225 PolarHBondContact O-N 3.24Å; E221-R225 IonicContact OE2-NH1 3.87Å; F222-R225 PolarHBondContact O-N 3.28Å; I223-R225 VanDerWaalsContact C-N 3.34Å; I223-R225 PolarHBondContact O-N 3.34Å
226H93.2Very high94Very high27 Ų2759.6 Ų59.613%0.12530%0.295CS..  trans-129.466.9-172.6-58.6-48.6000112.2Y35 F222 I223 H228 I229Y35-H226 HydrophobicContact CD1-CB 4.21Å; F222-H226 HydrophobicContact CE1-CB 4.21Å; F222-H226 AromaticContact CE2-CD2 3.75Å; F222-H226 AromaticContact CZ-CD2 3.75Å; F222-H226 PolarHBondContact O-N 2.9Å; I223-H226 CarbonylContact O-C 3.54Å; I223-H226 VanDerWaalsContact O-C 3.22Å; I223-H226 PolarHBondContact O-N 3.19Å; H226-H228 PolarHBondContact O-N 3.01Å; H226-I229 WeakPolarHBondContact O-CG2 3.28Å; H226-I229 PolarHBondContact O-N 3.23Å
227P91.8Very high94.2Very high91 Ų9156.8 Ų56.859%0.59128%0.278SS*.THydrogen-bonded Turntrans-61.5-23.8-172.123.2-34.6000114.3I223 I229 F230I223-P227 VanDerWaalsContact O-CA 3.31Å; I223-P227 WeakPolarHBondContact O-CA 3.35Å; I223-P227 VanDerWaalsContact O-N 3.11Å; P227-I229 PolarHBondContact O-N 3.21Å; P227-F230 WeakPolarHBondContact O-CB 3.42Å; P227-F230 PolarHBondContact O-N 2.9Å; P227-F230 VanDerWaalsContact O-N 3.11Å
228H91.5Very high94.4Very high108 Ų10857.3 Ų57.350%0.528%0.275SS..Hα-helixtrans-57.5-28.8174.8-176.6-76.5000112.6H226 F230 Y231 D232H226-H228 PolarHBondContact O-N 3.01Å; H228-F230 PolarHBondContact O-N 3.44Å; H228-Y231 WeakPolarHBondContact O-CB 3.34Å; H228-Y231 PolarHBondContact O-N 3.26Å; H228-Y231 VanDerWaalsContact O-N 3.11Å; H228-D232 IonicContact CE1-OD1 2.59Å; H228-D232 IonicContact CE1-OD2 3.56Å; H228-D232 PolarHBondContact CE1-OD2 3.33Å; H228-D232 VanDerWaalsContact CE1-OD2 3.26Å; H228-D232 IonicContact ND1-OD2 3.11Å; H228-D232 PolarHBondContact ND1-OD2 3.05Å; H228-D232 VanDerWaalsContact ND1-OD2 3.14Å; H228-D232 PolarHBondContact O-N 3.13Å
229I92.8Very high94.5Very high0 Ų055.7 Ų55.70%026%0.264CS..Hα-helixtrans-60.7-30179.1-162.7167.6000112.3I30 Y35 F42 F222 I223 H226 P227 Y231 D232 M233I30-I229 HydrophobicContact CG2-CD1 4.24Å; Y35-I229 HydrophobicContact CE1-CB 4.29Å; Y35-I229 HydrophobicContact CE1-CG1 4.47Å; Y35-I229 HydrophobicContact CE2-CD1 4.28Å; F42-I229 HydrophobicContact CB-CD1 4.38Å; F42-I229 HydrophobicContact CD2-CD1 3.15Å; F42-I229 HydrophobicContact CE2-CD1 3.53Å; F42-I229 HydrophobicContact CG-CD1 3.96Å; F222-I229 HydrophobicContact CD1-CD1 4.24Å; F222-I229 HydrophobicContact CE1-CD1 3.54Å; F222-I229 HydrophobicContact CE1-CG2 4.4Å; F222-I229 HydrophobicContact CZ-CD1 4.45Å; I223-I229 HydrophobicContact CG1-CG2 3.99Å; H226-I229 WeakPolarHBondContact O-CG2 3.28Å; H226-I229 PolarHBondContact O-N 3.23Å; P227-I229 PolarHBondContact O-N 3.21Å; I229-Y231 VanDerWaalsContact C-N 3.27Å; I229-Y231 PolarHBondContact O-N 3.48Å; I229-D232 PolarHBondContact O-N 3.41Å; I229-M233 HydrophobicContact CG1-CG 4.12Å; I229-M233 HydrophobicContact CG1-SD 4.21Å; I229-M233 WeakPolarHBondContact O-CB 3.31Å; I229-M233 VanDerWaalsContact O-CG 3.29Å; I229-M233 WeakPolarHBondContact O-CG 3.28Å; I229-M233 PolarHBondContact O-N 3.47Å
230F93.1Very high94.6Very high108 Ų10854.6 Ų54.647%0.47426%0.259SS..Hα-helixtrans-62.6-35.9178.8-173.7-98.2000112.1F51 P227 H228 S234F51-F230 AromaticContact CE2-CE2 3.98Å; F51-F230 HydrophobicContact CE2-CE2 3.98Å; F51-F230 HydrophobicContact CZ-CE2 4.27Å; P227-F230 WeakPolarHBondContact O-CB 3.42Å; P227-F230 PolarHBondContact O-N 2.9Å; P227-F230 VanDerWaalsContact O-N 3.11Å; H228-F230 PolarHBondContact O-N 3.44Å; F230-S234 WeakPolarHBondContact O-CB 3.48Å; F230-S234 PolarHBondContact O-N 3.45Å; F230-S234 PolarHBondContact O-OG 2.85Å
231Y95Very high94.8Very high138 Ų13850.3 Ų50.354%0.54124%0.237SC..Hα-helixtrans-65.2-47.3174.1178.1-99.1000111.4H228 I229 M233 S234 I235H228-Y231 WeakPolarHBondContact O-CB 3.34Å; H228-Y231 PolarHBondContact O-N 3.26Å; H228-Y231 VanDerWaalsContact O-N 3.11Å; I229-Y231 VanDerWaalsContact C-N 3.27Å; I229-Y231 PolarHBondContact O-N 3.48Å; Y231-M233 PolarHBondContact O-N 2.86Å; Y231-S234 WeakPolarHBondContact O-CB 3.47Å; Y231-S234 PolarHBondContact O-N 3.36Å; Y231-I235 HydrophobicContact CD1-CD1 4.05Å; Y231-I235 HydrophobicContact CE1-CD1 3.38Å; Y231-I235 HydrophobicContact CE1-CG1 4.47Å; Y231-I235 HydrophobicContact CE2-CD1 4.08Å; Y231-I235 VanDerWaalsContact CZ-CD1 3.4Å; Y231-I235 PolarHBondContact O-N 3.02Å
232D95.3Very high94.9Very high1 Ų148.9 Ų48.91%0.00524%0.235CC..Hα-helixtrans-62.6-43.1178.4-67-36.6000111.3Y26 K29 I30 H228 I229 S234 I235 F236Y26-D232 HydrophobicContact CD1-CB 4Å; Y26-D232 WeakPolarHBondContact CD1-O 3.09Å; Y26-D232 HydrophobicContact CE1-CB 4.32Å; Y26-D232 WeakPolarHBondContact CE1-OD1 3.49Å; K29-D232 WeakPolarHBondContact CE-OD1 3.39Å; K29-D232 WeakPolarHBondContact CE-OD2 3.37Å; K29-D232 IonicContact NZ-OD1 3.4Å; K29-D232 PolarHBondContact NZ-OD1 3.27Å; K29-D232 IonicContact NZ-OD2 3.9Å; I30-D232 HydrophobicContact CD1-CB 4.23Å; I30-D232 HydrophobicContact CG1-CB 3.83Å; H228-D232 IonicContact CE1-OD1 2.59Å; H228-D232 IonicContact CE1-OD2 3.56Å; H228-D232 PolarHBondContact CE1-OD2 3.33Å; H228-D232 VanDerWaalsContact CE1-OD2 3.26Å; H228-D232 IonicContact ND1-OD2 3.11Å; H228-D232 PolarHBondContact ND1-OD2 3.05Å; H228-D232 VanDerWaalsContact ND1-OD2 3.14Å; H228-D232 PolarHBondContact O-N 3.13Å; I229-D232 PolarHBondContact O-N 3.41Å; D232-S234 VanDerWaalsContact C-N 3.34Å; D232-S234 PolarHBondContact O-N 2.95Å; D232-I235 PolarHBondContact O-N 3.44Å; D232-F236 VanDerWaalsContact O-CB 3.29Å; D232-F236 WeakPolarHBondContact O-CB 3.26Å; D232-F236 PolarHBondContact O-N 3.33Å
233M95.4Very high95Very high1 Ų148.8 Ų48.81%0.00523%0.234CC..Hα-helixtrans-62.1-40.1174.7-72.7-178.964.900111.9I30 L48 F51 F219 I229 Y231 F236 G237I30-M233 HydrophobicContact CD1-CG 4.07Å; L48-M233 HydrophobicContact CD1-CE 3.89Å; L48-M233 HydrophobicContact CD1-CG 3.91Å; L48-M233 HydrophobicContact CD1-SD 4.44Å; F51-M233 HydrophobicContact CB-CE 3.75Å; F51-M233 HydrophobicContact CD1-CB 4.09Å; F51-M233 HydrophobicContact CD1-CE 3.93Å; F51-M233 HydrophobicContact CD2-CE 4.22Å; F51-M233 HydrophobicContact CE1-CB 3.89Å; F51-M233 VanDerWaalsContact CE1-O 3.26Å; F51-M233 WeakPolarHBondContact CE1-O 3.39Å; F51-M233 HydrophobicContact CG-CE 3.7Å; F51-M233 HydrophobicContact CZ-CB 4.46Å; F219-M233 HydrophobicContact CE2-CE 4.06Å; F219-M233 HydrophobicContact CE2-SD 4.13Å; F219-M233 HydrophobicContact CZ-CE 3.73Å; F219-M233 HydrophobicContact CZ-SD 4.2Å; I229-M233 HydrophobicContact CG1-CG 4.12Å; I229-M233 HydrophobicContact CG1-SD 4.21Å; I229-M233 WeakPolarHBondContact O-CB 3.31Å; I229-M233 VanDerWaalsContact O-CG 3.29Å; I229-M233 WeakPolarHBondContact O-CG 3.28Å; I229-M233 PolarHBondContact O-N 3.47Å; Y231-M233 PolarHBondContact O-N 2.86Å; M233-F236 WeakPolarHBondContact O-CB 3.43Å; M233-F236 PolarHBondContact O-N 3.13Å; M233-G237 PolarHBondContact O-N 2.68Å
234S96.1Very high95.2Very high29 Ų2947.1 Ų47.120%0.20323%0.226CC..Hα-helixtrans-62.9-46.3178.1-63.80000111.3F230 Y231 D232 G237 L238F230-S234 WeakPolarHBondContact O-CB 3.48Å; F230-S234 PolarHBondContact O-N 3.45Å; F230-S234 PolarHBondContact O-OG 2.85Å; Y231-S234 WeakPolarHBondContact O-CB 3.47Å; Y231-S234 PolarHBondContact O-N 3.36Å; D232-S234 VanDerWaalsContact C-N 3.34Å; D232-S234 PolarHBondContact O-N 2.95Å; S234-G237 PolarHBondContact O-N 2.68Å; S234-L238 WeakPolarHBondContact O-CB 3.46Å; S234-L238 WeakPolarHBondContact O-CG 3.13Å; S234-L238 PolarHBondContact O-N 3.19Å
235I96.6Very high95.3Very high32 Ų3241.4 Ų41.416%0.16420%0.203CC..Hα-helixtrans-65.3-42.7175.8-64.8177.1000111V22 Y26 Y231 D232 G237 L238 T239V22-I235 HydrophobicContact CG1-CG2 4.4Å; Y26-I235 HydrophobicContact CD1-CB 4Å; Y26-I235 HydrophobicContact CD1-CG2 4.09Å; Y26-I235 HydrophobicContact CD2-CB 4.48Å; Y26-I235 HydrophobicContact CD2-CG2 3.67Å; Y26-I235 HydrophobicContact CE1-CB 3.81Å; Y26-I235 HydrophobicContact CE1-CD1 3.73Å; Y26-I235 HydrophobicContact CE1-CG1 4.31Å; Y26-I235 HydrophobicContact CE1-CG2 3.92Å; Y26-I235 HydrophobicContact CE2-CB 4.32Å; Y26-I235 HydrophobicContact CE2-CD1 4.43Å; Y26-I235 HydrophobicContact CE2-CG2 3.48Å; Y26-I235 VanDerWaalsContact CE2-CG2 3.48Å; Y26-I235 HydrophobicContact CG-CB 4.33Å; Y26-I235 HydrophobicContact CG-CG2 3.97Å; Y26-I235 VanDerWaalsContact OH-CD1 3.22Å; Y26-I235 WeakPolarHBondContact OH-CD1 3.01Å; Y231-I235 HydrophobicContact CD1-CD1 4.05Å; Y231-I235 HydrophobicContact CE1-CD1 3.38Å; Y231-I235 HydrophobicContact CE1-CG1 4.47Å; Y231-I235 HydrophobicContact CE2-CD1 4.08Å; Y231-I235 VanDerWaalsContact CZ-CD1 3.4Å; Y231-I235 PolarHBondContact O-N 3.02Å; D232-I235 PolarHBondContact O-N 3.44Å; I235-G237 VanDerWaalsContact C-N 3.34Å; I235-G237 PolarHBondContact O-N 3.06Å; I235-L238 PolarHBondContact O-N 3.11Å; I235-T239 HydrophobicContact CG2-CG2 3.96Å; I235-T239 WeakPolarHBondContact O-CB 3.26Å; I235-T239 VanDerWaalsContact O-CG2 3.23Å; I235-T239 WeakPolarHBondContact O-CG2 3.38Å; I235-T239 PolarHBondContact O-N 3.33Å; I235-T239 PolarHBondContact O-OG1 3.29Å
236F95.6Very high95.4Very high0 Ų038.1 Ų38.10%019%0.192CC..Hα-helixtrans-55.2-48.6173.7170.6-99.3000111.7Y23 Q27 I30 L48 Q52 D232 M233 T239 S240Y23-F236 HydrophobicContact CD1-CE2 4.45Å; Y23-F236 AromaticContact CD2-CD2 3.7Å; Y23-F236 HydrophobicContact CD2-CD2 3.7Å; Y23-F236 AromaticContact CD2-CE2 3.6Å; Y23-F236 HydrophobicContact CD2-CE2 3.6Å; Y23-F236 HydrophobicContact CD2-CG 4.48Å; Y23-F236 HydrophobicContact CD2-CZ 4.3Å; Y23-F236 AromaticContact CE1-CE2 3.98Å; Y23-F236 HydrophobicContact CE1-CE2 3.98Å; Y23-F236 AromaticContact CE2-CD2 3.58Å; Y23-F236 HydrophobicContact CE2-CD2 3.58Å; Y23-F236 HydrophobicContact CE2-CE1 4.14Å; Y23-F236 AromaticContact CE2-CE2 3.01Å; Y23-F236 HydrophobicContact CE2-CE2 3.01Å; Y23-F236 HydrophobicContact CE2-CG 4.34Å; Y23-F236 AromaticContact CE2-CZ 3.35Å; Y23-F236 HydrophobicContact CE2-CZ 3.35Å; Y23-F236 HydrophobicContact CG-CD2 4.4Å; Y23-F236 HydrophobicContact CG-CE2 4.29Å; Y23-F236 AromaticContact CZ-CE2 3.24Å; Y23-F236 AromaticContact CZ-CZ 3.54Å; Y23-F236 VanDerWaalsContact OH-CZ 3.32Å; Y23-F236 WeakPolarHBondContact OH-CZ 3.43Å; Q27-F236 HydrophobicContact CB-CD2 4.17Å; Q27-F236 HydrophobicContact CB-CE2 3.81Å; Q27-F236 HydrophobicContact CG-CE2 4.06Å; I30-F236 HydrophobicContact CD1-CB 3.85Å; I30-F236 HydrophobicContact CD1-CG 4.11Å; L48-F236 HydrophobicContact CD1-CD1 3.74Å; L48-F236 HydrophobicContact CD1-CE1 3.67Å; L48-F236 HydrophobicContact CD1-CZ 4.47Å; L48-F236 HydrophobicContact CD2-CE1 4.27Å; L48-F236 HydrophobicContact CD2-CZ 4.31Å; L48-F236 HydrophobicContact CG-CD1 4.37Å; L48-F236 HydrophobicContact CG-CE1 3.79Å; L48-F236 HydrophobicContact CG-CZ 4.27Å; Q52-F236 HydrophobicContact CB-CE1 3.89Å; Q52-F236 HydrophobicContact CG-CD1 4.47Å; Q52-F236 HydrophobicContact CG-CE1 3.87Å; Q52-F236 HydrophobicContact CG-CZ 4.45Å; D232-F236 VanDerWaalsContact O-CB 3.29Å; D232-F236 WeakPolarHBondContact O-CB 3.26Å; D232-F236 PolarHBondContact O-N 3.33Å; M233-F236 WeakPolarHBondContact O-CB 3.43Å; M233-F236 PolarHBondContact O-N 3.13Å; F236-T239 PolarHBondContact O-OG1 3.06Å; F236-T239 VanDerWaalsContact O-OG1 3.05Å; F236-S240 VanDerWaalsContact O-CB 3.28Å; F236-S240 WeakPolarHBondContact O-CB 3.26Å; F236-S240 PolarHBondContact O-N 3.11Å
237G96.9Very high95.6Very high0 Ų038.1 Ų38.10%019%0.193CC..Hα-helixtrans-63.4-49.3177.900000113M233 S234 I235 S240 A241M233-G237 PolarHBondContact O-N 2.68Å; S234-G237 PolarHBondContact O-N 2.68Å; I235-G237 VanDerWaalsContact C-N 3.34Å; I235-G237 PolarHBondContact O-N 3.06Å; G237-S240 WeakPolarHBondContact O-CB 3.49Å; G237-S240 PolarHBondContact O-N 2.91Å; G237-S240 PolarHBondContact O-OG 2.87Å; G237-A241 PolarHBondContact O-N 3.44Å
238L96.8Very high95.8Very high81 Ų8133.9 Ų33.942%0.42417%0.165SC..Hα-helixtrans-62.3-46.3179.9-71.7171.9000112.7I55 F59 S234 I235 S240 A241 V242I55-L238 HydrophobicContact CG2-CD2 4.43Å; F59-L238 HydrophobicContact CE2-CD2 3.57Å; F59-L238 HydrophobicContact CZ-CD2 3.6Å; S234-L238 WeakPolarHBondContact O-CB 3.46Å; S234-L238 WeakPolarHBondContact O-CG 3.13Å; S234-L238 PolarHBondContact O-N 3.19Å; I235-L238 PolarHBondContact O-N 3.11Å; L238-S240 VanDerWaalsContact C-N 3.25Å; L238-S240 PolarHBondContact O-N 2.95Å; L238-A241 PolarHBondContact O-N 3.06Å; L238-V242 WeakPolarHBondContact O-CG2 3.47Å; L238-V242 PolarHBondContact O-N 2.9Å
239T96.6Very high96Very high22 Ų2229 Ų2914%0.13514%0.143CC..Hα-helixtrans-64.7-34.4177.154.40000111.2V22 I235 F236 G243V22-T239 HydrophobicContact CB-CG2 3.97Å; V22-T239 HydrophobicContact CG1-CG2 3.63Å; I235-T239 HydrophobicContact CG2-CG2 3.96Å; I235-T239 WeakPolarHBondContact O-CB 3.26Å; I235-T239 VanDerWaalsContact O-CG2 3.23Å; I235-T239 WeakPolarHBondContact O-CG2 3.38Å; I235-T239 PolarHBondContact O-N 3.33Å; I235-T239 PolarHBondContact O-OG1 3.29Å; F236-T239 PolarHBondContact O-OG1 3.06Å; F236-T239 VanDerWaalsContact O-OG1 3.05Å; T239-G243 PolarHBondContact O-N 3.17Å
240S96.9Very high96.1Very high0 Ų029 Ų290%014%0.143CC..Hα-helixtrans-65.7-39.2173.689.50000112.7Q52 N56 F236 G237 L238 G243 Q244Q52-S240 WeakPolarHBondContact CG-OG 3.2Å; Q52-S240 PolarHBondContact NE2-OG 3.2Å; N56-S240 PolarHBondContact ND2-OG 3.49Å; N56-S240 PolarHBondContact OD1-OG 3.39Å; F236-S240 VanDerWaalsContact O-CB 3.28Å; F236-S240 WeakPolarHBondContact O-CB 3.26Å; F236-S240 PolarHBondContact O-N 3.11Å; G237-S240 WeakPolarHBondContact O-CB 3.49Å; G237-S240 PolarHBondContact O-N 2.91Å; G237-S240 PolarHBondContact O-OG 2.87Å; L238-S240 VanDerWaalsContact C-N 3.25Å; L238-S240 PolarHBondContact O-N 2.95Å; S240-G243 PolarHBondContact O-N 3.4Å; S240-Q244 WeakPolarHBondContact O-CB 3.31Å; S240-Q244 WeakPolarHBondContact O-CG 3.3Å; S240-Q244 PolarHBondContact O-N 3.36Å
241A97.3Very high96.2Very high0 Ų023.9 Ų23.90%012%0.121CC..Hα-helixtrans-65.8-45.7177.600000111.8I55 N56 F59 G237 L238 G243 Q244 I245I55-A241 HydrophobicContact CG2-CB 4.12Å; N56-A241 WeakPolarHBondContact OD1-CA 3.28Å; N56-A241 VanDerWaalsContact OD1-CB 3.31Å; N56-A241 WeakPolarHBondContact OD1-CB 3.46Å; N56-A241 PolarHBondContact OD1-N 3.34Å; F59-A241 HydrophobicContact CB-CB 3.88Å; F59-A241 HydrophobicContact CD1-CB 3.93Å; F59-A241 HydrophobicContact CD2-CB 3.94Å; F59-A241 HydrophobicContact CE1-CB 4.48Å; F59-A241 HydrophobicContact CE2-CB 4.48Å; F59-A241 HydrophobicContact CG-CB 3.63Å; G237-A241 PolarHBondContact O-N 3.44Å; L238-A241 PolarHBondContact O-N 3.06Å; A241-G243 VanDerWaalsContact C-N 3.32Å; A241-G243 PolarHBondContact O-N 3.1Å; A241-Q244 PolarHBondContact O-N 2.82Å; A241-I245 WeakPolarHBondContact O-CG1 3.46Å; A241-I245 PolarHBondContact O-N 3.49Å; A241-I245 VanDerWaalsContact O-N 3.14Å
242V96.9Very high96.1Very high65 Ų6518.4 Ų18.439%0.39410%0.102SC..Hα-helixtrans-59.1-45.4173.71740000110.7L238 Q244 I245 F246L238-V242 WeakPolarHBondContact O-CG2 3.47Å; L238-V242 PolarHBondContact O-N 2.9Å; V242-Q244 VanDerWaalsContact C-N 3.34Å; V242-Q244 PolarHBondContact O-N 2.91Å; V242-I245 PolarHBondContact O-N 2.91Å; V242-F246 HydrophobicContact CG1-CD2 4.45Å; V242-F246 HydrophobicContact CG1-CE2 3.86Å; V242-F246 WeakPolarHBondContact O-CD2 3.41Å
243G96.6Very high96Very high0 Ų022.6 Ų22.60%012%0.124CC..Hα-helixtrans-63.4-38.7177.800000113.4S19 T239 S240 A241 I245 F246 L247S19-G243 VanDerWaalsContact CB-CA 3.49Å; S19-G243 WeakPolarHBondContact OG-CA 3.36Å; T239-G243 PolarHBondContact O-N 3.17Å; S240-G243 PolarHBondContact O-N 3.4Å; A241-G243 VanDerWaalsContact C-N 3.32Å; A241-G243 PolarHBondContact O-N 3.1Å; G243-I245 VanDerWaalsContact C-N 3.35Å; G243-I245 PolarHBondContact O-N 3.26Å; G243-F246 PolarHBondContact O-N 3.45Å; G243-L247 WeakPolarHBondContact O-CB 3.32Å; G243-L247 PolarHBondContact O-N 2.79Å
244Q96.6Very high95.9Very high0 Ų025.3 Ų25.30%014%0.136CC..Hα-helixtrans-64.7-36.3177.5-80.3-165.319.700112.7N56 Y86 M195 N199 S240 A241 V242 F246 L247 F248N56-Q244 PolarHBondContact ND2-NE2 2.92Å; Y86-Q244 PolarHBondContact OH-NE2 2.86Å; M195-Q244 HydrophobicContact CE-CB 3.72Å; M195-Q244 HydrophobicContact CG-CB 4.45Å; M195-Q244 HydrophobicContact SD-CB 3.92Å; N199-Q244 PolarHBondContact ND2-OE1 3.16Å; S240-Q244 WeakPolarHBondContact O-CB 3.31Å; S240-Q244 WeakPolarHBondContact O-CG 3.3Å; S240-Q244 PolarHBondContact O-N 3.36Å; A241-Q244 PolarHBondContact O-N 2.82Å; V242-Q244 VanDerWaalsContact C-N 3.34Å; V242-Q244 PolarHBondContact O-N 2.91Å; Q244-F246 VanDerWaalsContact C-N 3.26Å; Q244-F246 PolarHBondContact O-N 3.05Å; Q244-L247 PolarHBondContact O-N 2.91Å; Q244-L247 VanDerWaalsContact O-N 3.15Å; Q244-F248 HydrophobicContact CB-CD2 3.98Å; Q244-F248 HydrophobicContact CB-CE2 4.11Å; Q244-F248 HydrophobicContact CG-CD2 4.47Å; Q244-F248 HydrophobicContact CG-CE2 4.14Å; Q244-F248 WeakPolarHBondContact O-CB 3.11Å; Q244-F248 VanDerWaalsContact O-CD2 3.24Å; Q244-F248 WeakPolarHBondContact O-CD2 3.18Å; Q244-F248 PolarHBondContact O-N 3.44Å
245I96.2Very high95.7Very high52 Ų5224.4 Ų24.427%0.26713%0.13SC..Hα-helixtrans-55-45.9174.5-69.6166.1000110.6Y192 M195 A241 V242 G243 G249Y192-I245 HydrophobicContact CE1-CG1 4.48Å; Y192-I245 HydrophobicContact CE1-CG2 4.08Å; M195-I245 HydrophobicContact CE-CG1 4.48Å; M195-I245 HydrophobicContact SD-CG1 4.18Å; A241-I245 WeakPolarHBondContact O-CG1 3.46Å; A241-I245 PolarHBondContact O-N 3.49Å; A241-I245 VanDerWaalsContact O-N 3.14Å; V242-I245 PolarHBondContact O-N 2.91Å; G243-I245 VanDerWaalsContact C-N 3.35Å; G243-I245 PolarHBondContact O-N 3.26Å; I245-G249 PolarHBondContact O-N 3.42Å; I245-G249 VanDerWaalsContact O-N 3.08Å
246F96.7Very high95.7Very high45 Ų4523.1 Ų23.120%0.19712%0.124CC..Hα-helixtrans-71.1-39.9176.9-61.7-70.3000112.7F11 R12 V16 V242 G243 Q244 G249 L250F11-F246 HydrophobicContact CD1-CE1 4.45Å; F11-F246 HydrophobicContact CE1-CD1 4.45Å; F11-F246 AromaticContact CE1-CE1 3.77Å; F11-F246 HydrophobicContact CE1-CE1 3.77Å; F11-F246 HydrophobicContact CZ-CE1 4.05Å; R12-F246 HydrophobicContact CG-CD1 4.38Å; V16-F246 HydrophobicContact CG2-CB 3.68Å; V242-F246 HydrophobicContact CG1-CD2 4.45Å; V242-F246 HydrophobicContact CG1-CE2 3.86Å; V242-F246 WeakPolarHBondContact O-CD2 3.41Å; G243-F246 PolarHBondContact O-N 3.45Å; Q244-F246 VanDerWaalsContact C-N 3.26Å; Q244-F246 PolarHBondContact O-N 3.05Å; F246-G249 CarbonylContact O-C 3.59Å; F246-G249 PolarHBondContact O-N 3.32Å; F246-L250 WeakPolarHBondContact O-CG 3.36Å; F246-L250 PolarHBondContact O-N 3.14Å
247L96.4Very high95.7Very high28 Ų2823.1 Ų23.115%0.14712%0.124CC..Hα-helixtrans-63.4-50.1-179-163.8165.7000111.2V16 Y20 G243 Q244 G249 L250 I251 C259V16-L247 HydrophobicContact CG2-CB 4.39Å; Y20-L247 HydrophobicContact CE2-CD1 4.07Å; Y20-L247 WeakPolarHBondContact OH-CD1 3.09Å; G243-L247 WeakPolarHBondContact O-CB 3.32Å; G243-L247 PolarHBondContact O-N 2.79Å; Q244-L247 PolarHBondContact O-N 2.91Å; Q244-L247 VanDerWaalsContact O-N 3.15Å; L247-G249 VanDerWaalsContact C-N 3.31Å; L247-G249 PolarHBondContact O-N 3.45Å; L247-L250 WeakPolarHBondContact O-CB 3.05Å; L247-L250 PolarHBondContact O-N 2.62Å; L247-I251 HydrophobicContact CD2-CD1 3.32Å; L247-I251 HydrophobicContact CD2-CG1 4.1Å; L247-I251 WeakPolarHBondContact O-CG1 3.39Å; L247-I251 PolarHBondContact O-N 2.88Å; L247-C259 WeakPolarHBondContact CD2-SG 3.47Å; L247-C259 VanDerWaalsContact CG-SG 3.55Å
248F96.6Very high95.6Very high2 Ų223.9 Ų23.91%0.00913%0.128CC..Hα-helixtrans-65.4-36.4175.7-77.1-67.8000112S191 L194 M195 M198 Q244 L250 I251 T252S191-F248 WeakPolarHBondContact O-CB 3.3Å; L194-F248 HydrophobicContact CB-CD1 4.16Å; L194-F248 HydrophobicContact CD2-CD1 3.71Å; L194-F248 HydrophobicContact CD2-CE1 4.03Å; L194-F248 HydrophobicContact CG-CD1 3.67Å; L194-F248 HydrophobicContact CG-CE1 3.71Å; M195-F248 HydrophobicContact CB-CB 4.37Å; M195-F248 HydrophobicContact CB-CD1 4.44Å; M195-F248 HydrophobicContact CB-CD2 3.4Å; M195-F248 VanDerWaalsContact CB-CD2 3.4Å; M195-F248 HydrophobicContact CB-CE2 3.74Å; M195-F248 HydrophobicContact CB-CG 3.81Å; M195-F248 HydrophobicContact CB-CZ 4.4Å; M195-F248 HydrophobicContact CG-CD2 3.54Å; M195-F248 HydrophobicContact CG-CE2 3.68Å; M195-F248 HydrophobicContact CG-CG 4.42Å; M195-F248 HydrophobicContact SD-CD2 4.09Å; M198-F248 HydrophobicContact CB-CZ 4.15Å; M198-F248 HydrophobicContact CE-CE1 4.32Å; M198-F248 HydrophobicContact CE-CZ 4.14Å; M198-F248 HydrophobicContact CG-CE1 4.37Å; M198-F248 HydrophobicContact CG-CZ 4.41Å; M198-F248 HydrophobicContact SD-CE1 3.37Å; M198-F248 WeakPolarHBondContact SD-CE1 3.47Å; M198-F248 HydrophobicContact SD-CZ 3.66Å; Q244-F248 HydrophobicContact CB-CD2 3.98Å; Q244-F248 HydrophobicContact CB-CE2 4.11Å; Q244-F248 HydrophobicContact CG-CD2 4.47Å; Q244-F248 HydrophobicContact CG-CE2 4.14Å; Q244-F248 WeakPolarHBondContact O-CB 3.11Å; Q244-F248 VanDerWaalsContact O-CD2 3.24Å; Q244-F248 WeakPolarHBondContact O-CD2 3.18Å; Q244-F248 PolarHBondContact O-N 3.44Å; F248-L250 VanDerWaalsContact C-N 3.29Å; F248-L250 PolarHBondContact O-N 2.93Å; F248-I251 HydrophobicContact CD1-CD1 3.85Å; F248-I251 HydrophobicContact CE1-CD1 4.05Å; F248-I251 PolarHBondContact O-N 3.21Å; F248-T252 WeakPolarHBondContact O-CG2 3.16Å; F248-T252 PolarHBondContact O-N 3.31Å; F248-T252 PolarHBondContact O-OG1 3.34Å; F248-T252 VanDerWaalsContact O-OG1 3.07Å
249G95.1Very high95.5Very high4 Ų420.5 Ų20.54%0.04111%0.111CC..Hα-helixtrans-58.2-37.8168.700000113.3I245 F246 L247 T252 N253I245-G249 PolarHBondContact O-N 3.42Å; I245-G249 VanDerWaalsContact O-N 3.08Å; F246-G249 CarbonylContact O-C 3.59Å; F246-G249 PolarHBondContact O-N 3.32Å; L247-G249 VanDerWaalsContact C-N 3.31Å; L247-G249 PolarHBondContact O-N 3.45Å; G249-T252 PolarHBondContact O-OG1 3.45Å; G249-N253 VanDerWaalsContact O-CB 3.23Å; G249-N253 WeakPolarHBondContact O-CB 3.23Å; G249-N253 PolarHBondContact O-N 3.05Å; G249-N253 VanDerWaalsContact O-N 3.14Å; G249-N253 PolarHBondContact O-ND2 3.18Å
250L94.9Very high95.5Very high0 Ų019.6 Ų19.60%011%0.106CC..Hα-helixtrans-68.6-41.6174.4-74.3167.3000112.1L9 R12 V16 F246 L247 F248 F254 S255 C259 V262L9-L250 HydrophobicContact CD1-CD2 3.65Å; R12-L250 HydrophobicContact CB-CD1 4.3Å; R12-L250 HydrophobicContact CB-CD2 3.59Å; R12-L250 HydrophobicContact CB-CG 3.7Å; R12-L250 HydrophobicContact CG-CD2 4.49Å; V16-L250 HydrophobicContact CG2-CD1 3.79Å; F246-L250 WeakPolarHBondContact O-CG 3.36Å; F246-L250 PolarHBondContact O-N 3.14Å; L247-L250 WeakPolarHBondContact O-CB 3.05Å; L247-L250 PolarHBondContact O-N 2.62Å; F248-L250 VanDerWaalsContact C-N 3.29Å; F248-L250 PolarHBondContact O-N 2.93Å; L250-F254 HydrophobicContact CD2-CD2 3.96Å; L250-F254 HydrophobicContact CD2-CE2 4.38Å; L250-F254 WeakPolarHBondContact O-CA 3.24Å; L250-F254 WeakPolarHBondContact O-CB 3.42Å; L250-F254 PolarHBondContact O-N 2.95Å; L250-S255 PolarHBondContact O-N 3Å; L250-S255 VanDerWaalsContact O-N 3.11Å; L250-C259 HydrophobicContact CB-CB 4.17Å; L250-V262 HydrophobicContact CD1-CB 4.24Å; L250-V262 HydrophobicContact CD1-CG1 3.91Å; L250-V262 HydrophobicContact CD1-CG2 4.38Å
251I95.4Very high95.4Very high1 Ų120 Ų201%0.00511%0.108CC..Hα-helixtrans-60.5-54.5179.5-71.7161.8000110.5Q181 L194 L247 F248 S255 P256 C259Q181-I251 HydrophobicContact CB-CG2 4.01Å; Q181-I251 HydrophobicContact CG-CG2 4.38Å; L194-I251 HydrophobicContact CD2-CG2 3.72Å; L247-I251 HydrophobicContact CD2-CD1 3.32Å; L247-I251 HydrophobicContact CD2-CG1 4.1Å; L247-I251 WeakPolarHBondContact O-CG1 3.39Å; L247-I251 PolarHBondContact O-N 2.88Å; F248-I251 HydrophobicContact CD1-CD1 3.85Å; F248-I251 HydrophobicContact CE1-CD1 4.05Å; F248-I251 PolarHBondContact O-N 3.21Å; I251-S255 WeakPolarHBondContact O-CA 3.48Å; I251-S255 PolarHBondContact O-N 2.8Å; I251-P256 HydrophobicContact CG2-CG 3.96Å; I251-C259 HydrophobicContact CG1-CB 3.97Å
252T94Very high95.2Very high23 Ų2320.7 Ų20.714%0.14111%0.112CC..Hα-helixtrans-68.4-45.7-175.356.80000111.6K185 V189 S191 L194 F248 G249K185-T252 WeakPolarHBondContact CE-O 3.48Å; K185-T252 PolarHBondContact NZ-O 3Å; V189-T252 WeakPolarHBondContact O-CG2 3.37Å; S191-T252 PolarHBondContact OG-OG1 3.05Å; L194-T252 HydrophobicContact CD2-CG2 4.24Å; F248-T252 WeakPolarHBondContact O-CG2 3.16Å; F248-T252 PolarHBondContact O-N 3.31Å; F248-T252 PolarHBondContact O-OG1 3.34Å; F248-T252 VanDerWaalsContact O-OG1 3.07Å; G249-T252 PolarHBondContact O-OG1 3.45Å
253N92.2Very high95Very high89 Ų8918.9 Ų18.948%0.47610%0.101SC..Hα-helixtrans-77.9-41.3-175.9-68.3-84.6000112.6K185 G249K185-N253 PolarHBondContact NZ-O 3.46Å; G249-N253 VanDerWaalsContact O-CB 3.23Å; G249-N253 WeakPolarHBondContact O-CB 3.23Å; G249-N253 PolarHBondContact O-N 3.05Å; G249-N253 VanDerWaalsContact O-N 3.14Å; G249-N253 PolarHBondContact O-ND2 3.18Å
254F92.6Very high94.8Very high59 Ų5919.1 Ų19.126%0.25910%0.102SC..THydrogen-bonded Turntrans-107.7-73.3-174.4-63-86.1000112.5G5 L9 K185 L250 T258G5-F254 VanDerWaalsContact O-CZ 3.3Å; G5-F254 WeakPolarHBondContact O-CZ 3.25Å; L9-F254 HydrophobicContact CB-CE1 3.86Å; L9-F254 HydrophobicContact CB-CE2 4.05Å; L9-F254 HydrophobicContact CB-CZ 3.56Å; L9-F254 HydrophobicContact CD1-CD1 4.14Å; L9-F254 HydrophobicContact CD1-CD2 3.99Å; L9-F254 HydrophobicContact CD1-CE1 4.24Å; L9-F254 HydrophobicContact CD1-CE2 4.09Å; L9-F254 HydrophobicContact CD1-CG 4.02Å; L9-F254 HydrophobicContact CD1-CZ 4.22Å; L9-F254 HydrophobicContact CG-CE1 4.49Å; L9-F254 HydrophobicContact CG-CZ 4.47Å; K185-F254 PolarHBondContact NZ-O 3.01Å; L250-F254 HydrophobicContact CD2-CD2 3.96Å; L250-F254 HydrophobicContact CD2-CE2 4.38Å; L250-F254 WeakPolarHBondContact O-CA 3.24Å; L250-F254 WeakPolarHBondContact O-CB 3.42Å; L250-F254 PolarHBondContact O-N 2.95Å; F254-T258 HydrophobicContact CB-CG2 3.79Å; F254-T258 HydrophobicContact CG-CG2 4.33Å
255S93.5Very high94.5Very high10 Ų1019.7 Ų19.77%0.0711%0.106CC..  trans174.1162.5170.457.50000109.6E182 L250 I251 L257 T258 C259E182-S255 WeakPolarHBondContact OE2-CB 3.39Å; L250-S255 PolarHBondContact O-N 3Å; L250-S255 VanDerWaalsContact O-N 3.11Å; I251-S255 WeakPolarHBondContact O-CA 3.48Å; I251-S255 PolarHBondContact O-N 2.8Å; S255-L257 PolarHBondContact O-N 2.93Å; S255-T258 PolarHBondContact O-N 3.31Å; S255-T258 PolarHBondContact OG-N 3.26Å; S255-T258 PolarHBondContact OG-OG1 3.49Å; S255-C259 PolarHBondContact O-N 3.38Å
256P95.9Very high94.2Very high5 Ų519 Ų193%0.03210%0.1CC..Hα-helixtrans-58.5-34.1167.9-24.136.5000113V116 G178 Q181 E182 I251 C259 S260V116-P256 HydrophobicContact CG1-CB 4.37Å; G178-P256 WeakPolarHBondContact O-CB 3.5Å; G178-P256 WeakPolarHBondContact O-CG 3.25Å; Q181-P256 HydrophobicContact CB-CB 4.22Å; Q181-P256 HydrophobicContact CB-CG 3.43Å; Q181-P256 VanDerWaalsContact CB-CG 3.43Å; E182-P256 HydrophobicContact CB-CG 4.15Å; E182-P256 WeakPolarHBondContact OE2-CD 3.4Å; I251-P256 HydrophobicContact CG2-CG 3.96Å; P256-C259 WeakPolarHBondContact O-CB 3.48Å; P256-C259 PolarHBondContact O-N 3.15Å; P256-S260 PolarHBondContact O-N 3.07Å
257L95.6Very high93.7Very high0 Ų018.8 Ų18.80%010%0.099CC..Hα-helixtrans-62.7-47.3174.517659000111.5P113 V116 M117 Y128 K132 V136 S255 C259 S260 I261P113-L257 HydrophobicContact CB-CD1 4.38Å; P113-L257 WeakPolarHBondContact O-CD1 3.48Å; V116-L257 HydrophobicContact CG1-CB 4.38Å; M117-L257 HydrophobicContact CB-CD1 3.96Å; M117-L257 HydrophobicContact CB-CD2 4.35Å; M117-L257 HydrophobicContact CE-CD1 4.21Å; M117-L257 HydrophobicContact CE-CD2 3.47Å; M117-L257 VanDerWaalsContact CE-CD2 3.47Å; M117-L257 HydrophobicContact CE-CG 4.46Å; M117-L257 HydrophobicContact CG-CD2 4.36Å; Y128-L257 HydrophobicContact CD1-CD2 4.33Å; Y128-L257 HydrophobicContact CE1-CD2 3.77Å; Y128-L257 HydrophobicContact CE2-CD2 4.42Å; K132-L257 VanDerWaalsContact CE-CD2 3.47Å; V136-L257 HydrophobicContact CG1-CD1 4.29Å; V136-L257 HydrophobicContact CG2-CD1 4.4Å; V136-L257 HydrophobicContact CG2-CD2 4.5Å; S255-L257 PolarHBondContact O-N 2.93Å; L257-C259 VanDerWaalsContact C-N 3.29Å; L257-C259 PolarHBondContact O-N 3.47Å; L257-S260 WeakPolarHBondContact O-CB 3.12Å; L257-S260 PolarHBondContact O-N 3.14Å; L257-S260 VanDerWaalsContact O-N 3.14Å; L257-I261 HydrophobicContact CD1-CD1 4.26Å; L257-I261 HydrophobicContact CD1-CG1 4.43Å; L257-I261 HydrophobicContact CG-CD1 4.15Å; L257-I261 WeakPolarHBondContact O-CG1 3.47Å; L257-I261 PolarHBondContact O-N 2.98Å
258T94.4Very high93.3Very high16 Ų1617.5 Ų17.510%0.0989%0.092CC..Hα-helixtrans-59.9-42.4175-57.60000111L9 F254 S255 S260 I261 V262L9-T258 HydrophobicContact CD1-CG2 3.56Å; F254-T258 HydrophobicContact CB-CG2 3.79Å; F254-T258 HydrophobicContact CG-CG2 4.33Å; S255-T258 PolarHBondContact O-N 3.31Å; S255-T258 PolarHBondContact OG-N 3.26Å; S255-T258 PolarHBondContact OG-OG1 3.49Å; T258-S260 VanDerWaalsContact C-N 3.33Å; T258-S260 PolarHBondContact O-N 3.26Å; T258-I261 PolarHBondContact O-N 3Å; T258-V262 HydrophobicContact CG2-CG2 4.39Å; T258-V262 VanDerWaalsContact O-CG2 3.3Å; T258-V262 WeakPolarHBondContact O-CG2 3.41Å; T258-V262 PolarHBondContact O-N 2.91Å
259C95.2Very high93Very high10 Ų1019.8 Ų19.87%0.06810%0.103CC..Hα-helixtrans-58.6-43.7173.8177.20000112.2L247 L250 I251 S255 P256 L257 I261 V262 T263L247-C259 WeakPolarHBondContact CD2-SG 3.47Å; L247-C259 VanDerWaalsContact CG-SG 3.55Å; L250-C259 HydrophobicContact CB-CB 4.17Å; I251-C259 HydrophobicContact CG1-CB 3.97Å; S255-C259 PolarHBondContact O-N 3.38Å; P256-C259 WeakPolarHBondContact O-CB 3.48Å; P256-C259 PolarHBondContact O-N 3.15Å; L257-C259 VanDerWaalsContact C-N 3.29Å; L257-C259 PolarHBondContact O-N 3.47Å; C259-I261 VanDerWaalsContact C-N 3.34Å; C259-I261 PolarHBondContact O-N 3.46Å; C259-V262 PolarHBondContact O-N 3.21Å; C259-T263 WeakPolarHBondContact O-CG2 3.38Å; C259-T263 PolarHBondContact O-N 3.14Å; C259-T263 PolarHBondContact O-OG1 3.39Å
260S95.5Very high92.6Very high3 Ų322 Ų222%0.02112%0.115CC..Hα-helixtrans-63.6-39.3176.7-168.30000112.4K112 P113 P256 L257 T258 T263 T264K112-S260 WeakPolarHBondContact CG-OG 3.36Å; P113-S260 WeakPolarHBondContact CA-OG 3.44Å; P256-S260 PolarHBondContact O-N 3.07Å; L257-S260 WeakPolarHBondContact O-CB 3.12Å; L257-S260 PolarHBondContact O-N 3.14Å; L257-S260 VanDerWaalsContact O-N 3.14Å; T258-S260 VanDerWaalsContact C-N 3.33Å; T258-S260 PolarHBondContact O-N 3.26Å; S260-T263 WeakPolarHBondContact CA-OG1 3.35Å; S260-T263 PolarHBondContact O-OG1 3.41Å; S260-T263 VanDerWaalsContact O-OG1 3.08Å; S260-T264 VanDerWaalsContact O-CB 3.26Å; S260-T264 WeakPolarHBondContact O-CB 3.46Å; S260-T264 PolarHBondContact O-N 2.98Å; S260-T264 PolarHBondContact O-OG1 2.94Å
261I95Very high92.1Very high9 Ų923.9 Ų23.95%0.04613%0.127CC..Hα-helixtrans-63.9-50.1175.4-66.6164.2000109.8P113 V136 I139 L257 T258 C259 T263 T264 T265 L297P113-I261 HydrophobicContact CB-CG1 4.21Å; P113-I261 HydrophobicContact CG-CG1 4.43Å; V136-I261 HydrophobicContact CG2-CD1 3.81Å; I139-I261 HydrophobicContact CD1-CG2 4.13Å; L257-I261 HydrophobicContact CD1-CD1 4.26Å; L257-I261 HydrophobicContact CD1-CG1 4.43Å; L257-I261 HydrophobicContact CG-CD1 4.15Å; L257-I261 WeakPolarHBondContact O-CG1 3.47Å; L257-I261 PolarHBondContact O-N 2.98Å; T258-I261 PolarHBondContact O-N 3Å; C259-I261 VanDerWaalsContact C-N 3.34Å; C259-I261 PolarHBondContact O-N 3.46Å; I261-T263 PolarHBondContact O-N 2.86Å; I261-T264 PolarHBondContact O-N 3.17Å; I261-T264 VanDerWaalsContact O-N 3.16Å; I261-T265 HydrophobicContact CG2-CG2 4.22Å; I261-T265 WeakPolarHBondContact O-CG2 3.26Å; I261-T265 PolarHBondContact O-N 3.37Å; I261-T265 PolarHBondContact O-OG1 3.35Å; I261-T265 VanDerWaalsContact O-OG1 3.1Å; I261-L297 HydrophobicContact CG2-CD2 3.68Å
262V94.3Very high91.8Very high14 Ų1424.6 Ų24.69%0.08513%0.131CC..Hα-helixtrans-59-45.1179.81690000112L9 S13 V16 L250 T258 C259 T264 T265 R266L9-V262 HydrophobicContact CD1-CG2 4.42Å; S13-V262 WeakPolarHBondContact OG-CG2 3.36Å; V16-V262 HydrophobicContact CB-CG1 4.47Å; V16-V262 HydrophobicContact CG1-CG1 4.37Å; L250-V262 HydrophobicContact CD1-CB 4.24Å; L250-V262 HydrophobicContact CD1-CG1 3.91Å; L250-V262 HydrophobicContact CD1-CG2 4.38Å; T258-V262 HydrophobicContact CG2-CG2 4.39Å; T258-V262 VanDerWaalsContact O-CG2 3.3Å; T258-V262 WeakPolarHBondContact O-CG2 3.41Å; T258-V262 PolarHBondContact O-N 2.91Å; C259-V262 PolarHBondContact O-N 3.21Å; V262-T264 VanDerWaalsContact C-N 3.29Å; V262-T264 PolarHBondContact O-N 3.44Å; V262-T265 WeakPolarHBondContact CA-OG1 3.45Å; V262-T265 PolarHBondContact O-OG1 3.38Å; V262-T265 VanDerWaalsContact O-OG1 3.09Å; V262-R266 VanDerWaalsContact O-CB 3.28Å; V262-R266 WeakPolarHBondContact O-CB 3.36Å; V262-R266 PolarHBondContact O-N 2.98Å
263T92.4Very high91.5Very high27 Ų2728.4 Ų28.417%0.16615%0.145CC..Hα-helixtrans-68.6-30.1179.150.50000112.7V16 C259 S260 I261V16-T263 HydrophobicContact CG1-CG2 4.08Å; C259-T263 WeakPolarHBondContact O-CG2 3.38Å; C259-T263 PolarHBondContact O-N 3.14Å; C259-T263 PolarHBondContact O-OG1 3.39Å; S260-T263 WeakPolarHBondContact CA-OG1 3.35Å; S260-T263 PolarHBondContact O-OG1 3.41Å; S260-T263 VanDerWaalsContact O-OG1 3.08Å; I261-T263 PolarHBondContact O-N 2.86Å
264T91.6Very high91.2Very high4 Ų426.4 Ų26.43%0.02514%0.138CC..Hα-helixtrans-74.3-48.3175.7-60.80000111.3P113 V143 S260 I261 V262 R266 K267 F268P113-T264 HydrophobicContact CG-CG2 4.36Å; V143-T264 HydrophobicContact CB-CG2 4.27Å; V143-T264 HydrophobicContact CG1-CG2 4.19Å; V143-T264 HydrophobicContact CG2-CG2 4.04Å; S260-T264 VanDerWaalsContact O-CB 3.26Å; S260-T264 WeakPolarHBondContact O-CB 3.46Å; S260-T264 PolarHBondContact O-N 2.98Å; S260-T264 PolarHBondContact O-OG1 2.94Å; I261-T264 PolarHBondContact O-N 3.17Å; I261-T264 VanDerWaalsContact O-N 3.16Å; V262-T264 VanDerWaalsContact C-N 3.29Å; V262-T264 PolarHBondContact O-N 3.44Å; T264-R266 VanDerWaalsContact C-N 3.28Å; T264-R266 PolarHBondContact O-N 3.5Å; T264-K267 PolarHBondContact O-N 3.11Å; T264-K267 VanDerWaalsContact O-N 3.16Å; T264-F268 PolarHBondContact O-N 2.83Å
265T91.6Very high90.8Very high13 Ų1323.8 Ų23.88%0.0813%0.127CC..Hα-helixtrans-66.1-32177.655.90000112I139 I261 V262 K267 F268 F269 I293 L297I139-T265 HydrophobicContact CG2-CG2 4.14Å; I261-T265 HydrophobicContact CG2-CG2 4.22Å; I261-T265 WeakPolarHBondContact O-CG2 3.26Å; I261-T265 PolarHBondContact O-N 3.37Å; I261-T265 PolarHBondContact O-OG1 3.35Å; I261-T265 VanDerWaalsContact O-OG1 3.1Å; V262-T265 WeakPolarHBondContact CA-OG1 3.45Å; V262-T265 PolarHBondContact O-OG1 3.38Å; V262-T265 VanDerWaalsContact O-OG1 3.09Å; T265-K267 VanDerWaalsContact C-N 3.32Å; T265-K267 PolarHBondContact O-N 3.39Å; T265-F268 WeakPolarHBondContact O-CB 3.27Å; T265-F268 PolarHBondContact O-N 2.62Å; T265-F269 WeakPolarHBondContact O-CD2 3.38Å; T265-F269 PolarHBondContact O-N 3.14Å; T265-I293 HydrophobicContact CG2-CG2 4.42Å; T265-L297 HydrophobicContact CG2-CD1 3.84Å; T265-L297 HydrophobicContact CG2-CD2 3.83Å; T265-L297 HydrophobicContact CG2-CG 4.26Å
266R89.5Confident90.5Very high36 Ų3628.3 Ų28.314%0.13615%0.149CC..Hα-helixtrans-51.5-51.1169.6179.9-161.973.497.8-5.5111.3F17 Y20 V262 T264 F268 F269 T270F17-R266 HydrophobicContact CB-CG 4.23Å; F17-R266 HydrophobicContact CD2-CB 4.19Å; F17-R266 HydrophobicContact CD2-CG 3.5Å; F17-R266 VanDerWaalsContact CD2-CG 3.5Å; F17-R266 HydrophobicContact CE2-CG 4.12Å; F17-R266 HydrophobicContact CG-CG 4.15Å; Y20-R266 PolarHBondContact O-NH1 2.77Å; V262-R266 VanDerWaalsContact O-CB 3.28Å; V262-R266 WeakPolarHBondContact O-CB 3.36Å; V262-R266 PolarHBondContact O-N 2.98Å; T264-R266 VanDerWaalsContact C-N 3.28Å; T264-R266 PolarHBondContact O-N 3.5Å; R266-F268 VanDerWaalsContact C-N 3.29Å; R266-F268 PolarHBondContact O-N 3.01Å; R266-F269 PolarHBondContact O-N 3.16Å; R266-F269 VanDerWaalsContact O-N 3.13Å; R266-T270 PolarHBondContact O-N 2.98Å; R266-T270 PolarHBondContact O-OG1 3.12Å
267K85.1Confident90.2Very high42 Ų4235 Ų3518%0.18318%0.184CC..Hα-helixtrans-60.3-42.1-179.6-67.8-172.8178.9-1700111.3V106 M147 T264 T265 T270 V271V106-K267 HydrophobicContact CG1-CB 4.47Å; V106-K267 HydrophobicContact CG1-CD 4.09Å; V106-K267 HydrophobicContact CG2-CD 4.45Å; M147-K267 HydrophobicContact CE-CB 4.41Å; M147-K267 WeakPolarHBondContact CE-O 3.4Å; T264-K267 PolarHBondContact O-N 3.11Å; T264-K267 VanDerWaalsContact O-N 3.16Å; T265-K267 VanDerWaalsContact C-N 3.32Å; T265-K267 PolarHBondContact O-N 3.39Å; K267-T270 PolarHBondContact O-N 3.37Å; K267-V271 PolarHBondContact O-N 3.04Å
268F89.3Confident89.8Confident0 Ų042 Ų420%022%0.215CC..Hα-helixtrans-56.7-51.5171.6157.2-103.2000111.8V143 F146 T264 T265 R266 T270 V271 L272 T290 I293 F294V143-F268 HydrophobicContact CG1-CB 4.25Å; V143-F268 HydrophobicContact CG2-CB 4.04Å; F146-F268 AromaticContact CD1-CD2 3.95Å; F146-F268 HydrophobicContact CD1-CD2 3.95Å; F146-F268 HydrophobicContact CD1-CE2 4.42Å; F146-F268 AromaticContact CD2-CD2 3.95Å; F146-F268 HydrophobicContact CD2-CD2 3.95Å; F146-F268 AromaticContact CD2-CE2 3.63Å; F146-F268 HydrophobicContact CD2-CE2 3.63Å; F146-F268 HydrophobicContact CE1-CD2 4.08Å; F146-F268 HydrophobicContact CE1-CE2 4.39Å; F146-F268 HydrophobicContact CE2-CD2 4.05Å; F146-F268 AromaticContact CE2-CE2 3.57Å; F146-F268 HydrophobicContact CE2-CE2 3.57Å; F146-F268 AromaticContact CG-CD2 3.9Å; F146-F268 HydrophobicContact CG-CD2 3.9Å; F146-F268 HydrophobicContact CG-CE2 4.07Å; F146-F268 HydrophobicContact CZ-CD2 4.13Å; F146-F268 AromaticContact CZ-CE2 3.99Å; F146-F268 HydrophobicContact CZ-CE2 3.99Å; T264-F268 PolarHBondContact O-N 2.83Å; T265-F268 WeakPolarHBondContact O-CB 3.27Å; T265-F268 PolarHBondContact O-N 2.62Å; R266-F268 VanDerWaalsContact C-N 3.29Å; R266-F268 PolarHBondContact O-N 3.01Å; F268-T270 VanDerWaalsContact C-N 3.35Å; F268-T270 PolarHBondContact O-N 3.03Å; F268-V271 PolarHBondContact O-N 3.06Å; F268-L272 HydrophobicContact CE1-CD2 4.13Å; F268-L272 HydrophobicContact CE2-CB 4.47Å; F268-L272 HydrophobicContact CE2-CD2 4.43Å; F268-L272 HydrophobicContact CZ-CD2 3.78Å; F268-L272 WeakPolarHBondContact O-CB 3.24Å; F268-L272 PolarHBondContact O-N 3.11Å; F268-T290 HydrophobicContact CZ-CG2 4.16Å; F268-I293 HydrophobicContact CB-CD1 4.39Å; F268-I293 HydrophobicContact CD1-CD1 4.12Å; F268-I293 HydrophobicContact CD1-CG2 4.12Å; F268-I293 HydrophobicContact CD2-CD1 3.35Å; F268-I293 HydrophobicContact CE1-CD1 4.22Å; F268-I293 HydrophobicContact CE1-CG2 4.08Å; F268-I293 HydrophobicContact CE2-CD1 3.47Å; F268-I293 VanDerWaalsContact CE2-CD1 3.47Å; F268-I293 HydrophobicContact CG-CD1 3.68Å; F268-I293 HydrophobicContact CZ-CD1 3.91Å; F268-F294 HydrophobicContact CE1-CE2 4.41Å; F268-F294 HydrophobicContact CZ-CE2 4.23Å
269F90.7Very high89.3Confident51 Ų5144.2 Ų44.222%0.22424%0.241CC..Hα-helixtrans-62.8-38.1179.1-76.7-61.6000112.7F17 T265 R266 V271 L272 F273 F294F17-F269 HydrophobicContact CD2-CB 4.35Å; F17-F269 HydrophobicContact CE2-CB 3.66Å; T265-F269 WeakPolarHBondContact O-CD2 3.38Å; T265-F269 PolarHBondContact O-N 3.14Å; R266-F269 PolarHBondContact O-N 3.16Å; R266-F269 VanDerWaalsContact O-N 3.13Å; F269-V271 VanDerWaalsContact C-N 3.31Å; F269-V271 PolarHBondContact O-N 3.23Å; F269-L272 HydrophobicContact CD1-CD2 4.19Å; F269-L272 HydrophobicContact CE1-CD2 4.47Å; F269-L272 PolarHBondContact O-N 3.46Å; F269-F273 HydrophobicContact CB-CD2 4.23Å; F269-F273 HydrophobicContact CB-CE2 4.05Å; F269-F273 HydrophobicContact CD1-CE2 4.45Å; F269-F273 WeakPolarHBondContact O-CB 3.17Å; F269-F273 WeakPolarHBondContact O-CD2 3.29Å; F269-F273 WeakPolarHBondContact O-CG 3.5Å; F269-F273 PolarHBondContact O-N 3.38Å; F269-F294 HydrophobicContact CE1-CE1 4.34Å; F269-F294 AromaticContact CE1-CZ 3.98Å; F269-F294 HydrophobicContact CE1-CZ 3.98Å; F269-F294 HydrophobicContact CZ-CE1 4.23Å; F269-F294 HydrophobicContact CZ-CZ 4.29Å
270T86.3Confident88.7Confident49 Ų4948.8 Ų48.830%0.30126%0.261SS..Hα-helixtrans-58.1-44.7175.2-57.70000111.2R266 K267 F268 S274R266-T270 PolarHBondContact O-N 2.98Å; R266-T270 PolarHBondContact O-OG1 3.12Å; K267-T270 PolarHBondContact O-N 3.37Å; F268-T270 VanDerWaalsContact C-N 3.35Å; F268-T270 PolarHBondContact O-N 3.03Å; T270-S274 PolarHBondContact O-N 2.79Å; T270-S274 VanDerWaalsContact O-N 3.15Å
271V84.7Confident88.1Confident41 Ų4154.2 Ų54.225%0.24830%0.299CS..Hα-helixtrans-72.9-41.4178.1178.30000111.4F146 M147 K267 F268 F269 F273 S274 I275F146-V271 HydrophobicContact CE1-CB 4.1Å; F146-V271 HydrophobicContact CE1-CG1 3.72Å; F146-V271 HydrophobicContact CZ-CG1 4.49Å; M147-V271 HydrophobicContact CE-CB 4.03Å; M147-V271 HydrophobicContact CE-CG2 3.64Å; M147-V271 HydrophobicContact SD-CB 4.31Å; M147-V271 HydrophobicContact SD-CG1 4.39Å; M147-V271 HydrophobicContact SD-CG2 3.9Å; K267-V271 PolarHBondContact O-N 3.04Å; F268-V271 PolarHBondContact O-N 3.06Å; F269-V271 VanDerWaalsContact C-N 3.31Å; F269-V271 PolarHBondContact O-N 3.23Å; V271-F273 PolarHBondContact O-N 2.72Å; V271-S274 WeakPolarHBondContact O-CB 3.38Å; V271-S274 PolarHBondContact O-N 3.46Å; V271-I275 HydrophobicContact CG1-CD1 4.03Å; V271-I275 HydrophobicContact CG1-CG1 4.48Å; V271-I275 WeakPolarHBondContact O-CG1 3.39Å; V271-I275 PolarHBondContact O-N 3.41Å
272L88.2Confident87.5Confident16 Ų1655.5 Ų55.58%0.08431%0.305CS..Hα-helixtrans-58.5-47.7176.5-178.367000111.7F146 F268 F269 S274 I275 I276 M282F146-L272 HydrophobicContact CE2-CD1 4.28Å; F146-L272 HydrophobicContact CZ-CB 4.3Å; F146-L272 HydrophobicContact CZ-CD1 4.22Å; F268-L272 HydrophobicContact CE1-CD2 4.13Å; F268-L272 HydrophobicContact CE2-CB 4.47Å; F268-L272 HydrophobicContact CE2-CD2 4.43Å; F268-L272 HydrophobicContact CZ-CD2 3.78Å; F268-L272 WeakPolarHBondContact O-CB 3.24Å; F268-L272 PolarHBondContact O-N 3.11Å; F269-L272 HydrophobicContact CD1-CD2 4.19Å; F269-L272 HydrophobicContact CE1-CD2 4.47Å; F269-L272 PolarHBondContact O-N 3.46Å; L272-S274 VanDerWaalsContact C-N 3.31Å; L272-S274 PolarHBondContact O-N 2.99Å; L272-I275 PolarHBondContact O-N 3.27Å; L272-I276 HydrophobicContact CD1-CD1 4.21Å; L272-I276 HydrophobicContact CG-CD1 3.92Å; L272-I276 WeakPolarHBondContact O-CG1 3.43Å; L272-I276 PolarHBondContact O-N 3.47Å; L272-M282 HydrophobicContact CD1-CE 3.74Å; L272-M282 HydrophobicContact CD1-SD 3.84Å
273F87.7Confident87.2Confident102 Ų10257.5 Ų57.545%0.44732%0.318SS..Hα-helixtrans-63-38.4176.5-74-53.4000111.9F17 F269 V271 I276 L277F17-F273 HydrophobicContact CE2-CD2 4.38Å; F17-F273 HydrophobicContact CE2-CE2 4.32Å; F17-F273 AromaticContact CZ-CD2 3.8Å; F17-F273 HydrophobicContact CZ-CD2 3.8Å; F17-F273 AromaticContact CZ-CE2 3.92Å; F17-F273 HydrophobicContact CZ-CE2 3.92Å; F269-F273 HydrophobicContact CB-CD2 4.23Å; F269-F273 HydrophobicContact CB-CE2 4.05Å; F269-F273 HydrophobicContact CD1-CE2 4.45Å; F269-F273 WeakPolarHBondContact O-CB 3.17Å; F269-F273 WeakPolarHBondContact O-CD2 3.29Å; F269-F273 WeakPolarHBondContact O-CG 3.5Å; F269-F273 PolarHBondContact O-N 3.38Å; V271-F273 PolarHBondContact O-N 2.72Å; F273-I276 PolarHBondContact O-N 3.33Å; F273-L277 WeakPolarHBondContact O-CB 3.48Å; F273-L277 VanDerWaalsContact O-CG 3.25Å; F273-L277 WeakPolarHBondContact O-CG 3.35Å; F273-L277 PolarHBondContact O-N 3.37Å
274S85.4Confident87Confident48 Ų4861.5 Ų61.534%0.33634%0.342SS..Hα-helixtrans-57.7-50.5173.5-170.80000111.2T270 V271 L272 I276 L277 F278T270-S274 PolarHBondContact O-N 2.79Å; T270-S274 VanDerWaalsContact O-N 3.15Å; V271-S274 WeakPolarHBondContact O-CB 3.38Å; V271-S274 PolarHBondContact O-N 3.46Å; L272-S274 VanDerWaalsContact C-N 3.31Å; L272-S274 PolarHBondContact O-N 2.99Å; S274-I276 PolarHBondContact O-N 2.93Å; S274-L277 PolarHBondContact O-N 2.94Å; S274-F278 WeakPolarHBondContact O-CB 3.34Å; S274-F278 WeakPolarHBondContact O-CD2 3.45Å; S274-F278 PolarHBondContact O-N 2.81Å; S274-F278 WeakPolarHBondContact OG-CD2 3.3Å; S274-F278 WeakPolarHBondContact OG-CE2 3.24Å
275I85Confident86.8Confident4 Ų463.4 Ų63.42%0.02136%0.355CS..Hα-helixtrans-58.7-45.1178.7-69169.8000111.7F146 W150 V271 L272 G279 H280 M282F146-I275 HydrophobicContact CE1-CD1 4.39Å; F146-I275 HydrophobicContact CZ-CD1 3.99Å; W150-I275 HydrophobicContact CZ3-CD1 4.41Å; W150-I275 HydrophobicContact CZ3-CG1 4.22Å; V271-I275 HydrophobicContact CG1-CD1 4.03Å; V271-I275 HydrophobicContact CG1-CG1 4.48Å; V271-I275 WeakPolarHBondContact O-CG1 3.39Å; V271-I275 PolarHBondContact O-N 3.41Å; L272-I275 PolarHBondContact O-N 3.27Å; I275-G279 PolarHBondContact O-N 3.42Å; I275-H280 HydrophobicContact CG2-CB 4.02Å; I275-H280 WeakPolarHBondContact CG2-O 3.42Å; I275-H280 PolarHBondContact O-N 2.67Å; I275-M282 HydrophobicContact CG2-CG 3.73Å
276I88Confident86.7Confident105 Ų10563 Ų6354%0.53835%0.353SS..Hα-helixtrans-65-46.3-180-67.1167.5000111.1L272 F273 S274 G279L272-I276 HydrophobicContact CD1-CD1 4.21Å; L272-I276 HydrophobicContact CG-CD1 3.92Å; L272-I276 WeakPolarHBondContact O-CG1 3.43Å; L272-I276 PolarHBondContact O-N 3.47Å; F273-I276 PolarHBondContact O-N 3.33Å; S274-I276 PolarHBondContact O-N 2.93Å; I276-G279 PolarHBondContact O-N 3.5Å
277L88.6Confident86.8Confident145 Ų14568.5 Ų68.576%0.75937%0.373SS*.Hα-helixtrans-68.8-36.1-177.7-71.6173.9000112.7F273 S274 G279F273-L277 WeakPolarHBondContact O-CB 3.48Å; F273-L277 VanDerWaalsContact O-CG 3.25Å; F273-L277 WeakPolarHBondContact O-CG 3.35Å; F273-L277 PolarHBondContact O-N 3.37Å; S274-L277 PolarHBondContact O-N 2.94Å; L277-G279 VanDerWaalsContact C-N 3.33Å
278F87.6Confident87.3Confident147 Ų14770.6 Ų70.665%0.64539%0.385SS*.THydrogen-bonded Turntrans-87.40.8177.4-67-65.6000113.7S274 H280S274-F278 WeakPolarHBondContact O-CB 3.34Å; S274-F278 WeakPolarHBondContact O-CD2 3.45Å; S274-F278 PolarHBondContact O-N 2.81Å; S274-F278 WeakPolarHBondContact OG-CD2 3.3Å; S274-F278 WeakPolarHBondContact OG-CE2 3.24Å; F278-H280 VanDerWaalsContact C-N 3.27Å; F278-H280 PolarHBondContact O-N 2.84Å
279G83.2Confident87.5Confident63 Ų6370.6 Ų70.665%0.64939%0.385SS*.THydrogen-bonded Turntrans66.823.7176.600000114.5I275 I276 L277I275-G279 PolarHBondContact O-N 3.42Å; I276-G279 PolarHBondContact O-N 3.5Å; L277-G279 VanDerWaalsContact C-N 3.33Å
280H82.8Confident87.6Confident105 Ų10568.7 Ų68.749%0.48638%0.378SS..PPolyproline II helixtrans-73.8136.3176.7-68.5-53.2000110.7I275 F278I275-H280 HydrophobicContact CG2-CB 4.02Å; I275-H280 WeakPolarHBondContact CG2-O 3.42Å; I275-H280 PolarHBondContact O-N 2.67Å; F278-H280 VanDerWaalsContact C-N 3.27Å; F278-H280 PolarHBondContact O-N 2.84Å
281S83.8Confident88Confident118 Ų11870.4 Ų70.483%0.82539%0.388SS*.PPolyproline II helixtrans-72.7131.6175.3-53.50000111.2
282M82.6Confident88.5Confident36 Ų3670.3 Ų70.318%0.17739%0.386CS..PPolyproline II helixtrans-77.2131.9176.4-67.5-179.971.400111.2F146 L272 I275 Q286 W287 T290F146-M282 HydrophobicContact CD2-CE 4.42Å; F146-M282 HydrophobicContact CE2-CE 3.48Å; F146-M282 VanDerWaalsContact CE2-CE 3.48Å; F146-M282 HydrophobicContact CZ-CE 4.21Å; L272-M282 HydrophobicContact CD1-CE 3.74Å; L272-M282 HydrophobicContact CD1-SD 3.84Å; I275-M282 HydrophobicContact CG2-CG 3.73Å; M282-Q286 HydrophobicContact CB-CB 4.34Å; M282-Q286 HydrophobicContact CE-CB 3.94Å; M282-W287 HydrophobicContact SD-CZ2 4.36Å; M282-T290 WeakPolarHBondContact CE-OG1 3.14Å
283T86.6Confident88.8Confident56 Ų5669.6 Ų69.634%0.34438%0.382SS..PPolyproline II helixtrans-67.1157.2174.161.80000111.7C285 Q286 W287T283-C285 PolarHBondContact O-N 3.45Å; T283-Q286 WeakPolarHBondContact O-CB 3.45Å; T283-Q286 PolarHBondContact O-N 3.44Å; T283-Q286 VanDerWaalsContact OG1-CG 3.28Å; T283-Q286 WeakPolarHBondContact OG1-CG 3.49Å; T283-Q286 PolarHBondContact OG1-N 3.15Å; T283-Q286 PolarHBondContact OG1-OE1 3.07Å; T283-Q286 VanDerWaalsContact OG1-OE1 3.1Å; T283-W287 PolarHBondContact O-N 2.79Å
284T88.3Confident89.2Confident110 Ų11068.9 Ų68.968%0.67538%0.379SS*.Hα-helixtrans-56-39176.3-52.90000112.1W287 I288T284-W287 WeakPolarHBondContact O-CB 3.47Å; T284-W287 PolarHBondContact O-N 3.37Å; T284-I288 HydrophobicContact CG2-CD1 4.28Å; T284-I288 WeakPolarHBondContact O-CG1 3.43Å; T284-I288 PolarHBondContact O-N 3.44Å
285C88Confident89.6Confident44 Ų4468.8 Ų68.830%0.29738%0.378SS..Hα-helixtrans-61.4-45.7173.8-62.60000111.9L145 N149 T283 W287 I288 G289L145-C285 HydrophobicContact CD2-CB 3.86Å; L145-C285 WeakPolarHBondContact CD2-O 3.4Å; N149-C285 HydrophobicContact CB-CB 4.27Å; N149-C285 VanDerWaalsContact CG-CB 3.43Å; N149-C285 WeakPolarHBondContact ND2-CB 3.37Å; N149-C285 PolarHBondContact ND2-SG 2.89Å; N149-C285 PolarHBondContact OD1-SG 3.11Å; T283-C285 PolarHBondContact O-N 3.45Å; C285-W287 VanDerWaalsContact C-N 3.27Å; C285-W287 PolarHBondContact O-N 3.14Å; C285-I288 PolarHBondContact O-N 3.34Å; C285-I288 VanDerWaalsContact O-N 3.16Å; C285-G289 PolarHBondContact O-N 2.75Å
286Q89.4Confident90.1Very high6 Ų668.6 Ų68.63%0.02838%0.377CS..Hα-helixtrans-61-36.1176.3-76.4168.2-36.300112.4F146 M282 T283 G289 T290F146-Q286 HydrophobicContact CD2-CB 3.89Å; F146-Q286 HydrophobicContact CD2-CG 4.02Å; F146-Q286 WeakPolarHBondContact CD2-O 3.23Å; F146-Q286 HydrophobicContact CE2-CB 3.98Å; F146-Q286 HydrophobicContact CE2-CG 4.18Å; F146-Q286 HydrophobicContact CG-CG 4.31Å; F146-Q286 WeakPolarHBondContact O-CG 3.43Å; M282-Q286 HydrophobicContact CB-CB 4.34Å; M282-Q286 HydrophobicContact CE-CB 3.94Å; T283-Q286 WeakPolarHBondContact O-CB 3.45Å; T283-Q286 PolarHBondContact O-N 3.44Å; T283-Q286 VanDerWaalsContact OG1-CG 3.28Å; T283-Q286 WeakPolarHBondContact OG1-CG 3.49Å; T283-Q286 PolarHBondContact OG1-N 3.15Å; T283-Q286 PolarHBondContact OG1-OE1 3.07Å; T283-Q286 VanDerWaalsContact OG1-OE1 3.1Å; Q286-G289 PolarHBondContact O-N 3.25Å; Q286-T290 VanDerWaalsContact O-CB 3.27Å; Q286-T290 WeakPolarHBondContact O-CB 3.07Å; Q286-T290 PolarHBondContact O-N 2.89Å; Q286-T290 PolarHBondContact O-OG1 3.38Å
287W92.2Very high90.4Very high150 Ų15065.1 Ų65.157%0.56836%0.36SS*.Hα-helixtrans-62.7-48.2171.6-81109.5000112.3M282 T283 T284 C285 G289 T290 V291M282-W287 HydrophobicContact SD-CZ2 4.36Å; T283-W287 PolarHBondContact O-N 2.79Å; T284-W287 WeakPolarHBondContact O-CB 3.47Å; T284-W287 PolarHBondContact O-N 3.37Å; C285-W287 VanDerWaalsContact C-N 3.27Å; C285-W287 PolarHBondContact O-N 3.14Å; W287-G289 VanDerWaalsContact C-N 3.35Å; W287-G289 PolarHBondContact O-N 2.87Å; W287-T290 WeakPolarHBondContact O-CB 3.43Å; W287-T290 PolarHBondContact O-N 2.7Å; W287-V291 WeakPolarHBondContact O-CG2 3.41Å; W287-V291 PolarHBondContact O-N 3.05Å
288I94Very high90.6Very high86 Ų8663.8 Ų63.844%0.44135%0.353SS..Hα-helixtrans-58.2-48.3176-66.1165.8000110.4L145 T284 C285 T290 V291 L292L145-I288 HydrophobicContact CD1-CG2 4.45Å; L145-I288 HydrophobicContact CD2-CB 4.41Å; T284-I288 HydrophobicContact CG2-CD1 4.28Å; T284-I288 WeakPolarHBondContact O-CG1 3.43Å; T284-I288 PolarHBondContact O-N 3.44Å; C285-I288 PolarHBondContact O-N 3.34Å; C285-I288 VanDerWaalsContact O-N 3.16Å; I288-T290 VanDerWaalsContact C-N 3.3Å; I288-T290 PolarHBondContact O-N 3.42Å; I288-V291 PolarHBondContact O-N 3.19Å; I288-L292 HydrophobicContact CG2-CD1 4.06Å; I288-L292 HydrophobicContact CG2-CG 4.44Å; I288-L292 VanDerWaalsContact O-CG 3.31Å; I288-L292 WeakPolarHBondContact O-CG 3.23Å; I288-L292 PolarHBondContact O-N 3.08Å
289G93.4Very high90.8Very high0 Ų059.7 Ų59.70%034%0.338CS..Hα-helixtrans-58.8-42.2177.500000112.1G142 C285 Q286 W287 L292 I293G142-G289 WeakPolarHBondContact O-CA 3.36Å; C285-G289 PolarHBondContact O-N 2.75Å; Q286-G289 PolarHBondContact O-N 3.25Å; W287-G289 VanDerWaalsContact C-N 3.35Å; W287-G289 PolarHBondContact O-N 2.87Å; G289-L292 PolarHBondContact O-N 3.29Å; G289-I293 WeakPolarHBondContact O-CD1 3.14Å; G289-I293 WeakPolarHBondContact O-CG1 3.38Å; G289-I293 PolarHBondContact O-N 2.81Å
290T93.1Very high91.2Very high12 Ų1256.9 Ų56.97%0.07431%0.307CS..Hα-helixtrans-60.9-49.3176.5-61.50000111.6F146 F268 M282 Q286 W287 I288 L292 I293 F294F146-T290 WeakPolarHBondContact CD2-OG1 3.43Å; F146-T290 WeakPolarHBondContact CE2-OG1 3.38Å; F268-T290 HydrophobicContact CZ-CG2 4.16Å; M282-T290 WeakPolarHBondContact CE-OG1 3.14Å; Q286-T290 VanDerWaalsContact O-CB 3.27Å; Q286-T290 WeakPolarHBondContact O-CB 3.07Å; Q286-T290 PolarHBondContact O-N 2.89Å; Q286-T290 PolarHBondContact O-OG1 3.38Å; W287-T290 WeakPolarHBondContact O-CB 3.43Å; W287-T290 PolarHBondContact O-N 2.7Å; I288-T290 VanDerWaalsContact C-N 3.3Å; I288-T290 PolarHBondContact O-N 3.42Å; T290-L292 VanDerWaalsContact C-N 3.31Å; T290-L292 PolarHBondContact O-N 3.27Å; T290-I293 PolarHBondContact O-N 3.15Å; T290-F294 HydrophobicContact CG2-CD2 3.59Å; T290-F294 HydrophobicContact CG2-CE2 3.53Å; T290-F294 VanDerWaalsContact O-CD2 3.25Å; T290-F294 WeakPolarHBondContact O-CD2 3.42Å; T290-F294 PolarHBondContact O-N 3.48Å
291V95.6Very high91.4Very high85 Ų8555 Ų5552%0.51530%0.299SS..Hα-helixtrans-58.6-45.2176.3172.80000110.5W287 I288 I293 F294 S295W287-V291 WeakPolarHBondContact O-CG2 3.41Å; W287-V291 PolarHBondContact O-N 3.05Å; I288-V291 PolarHBondContact O-N 3.19Å; V291-I293 VanDerWaalsContact C-N 3.34Å; V291-I293 PolarHBondContact O-N 3.05Å; V291-F294 PolarHBondContact O-N 2.87Å; V291-S295 VanDerWaalsContact O-CB 3.28Å; V291-S295 WeakPolarHBondContact O-CB 3.36Å; V291-S295 PolarHBondContact O-N 3.21Å; V291-S295 PolarHBondContact O-OG 3.3Å; V291-S295 VanDerWaalsContact O-OG 3.11Å
292L95.4Very high91.5Very high39 Ų3953.7 Ų53.720%0.20429%0.286CS..Hα-helixtrans-59.7-43.2178.3-70.3172000112.4M138 F141 I288 G289 T290 G296M138-L292 HydrophobicContact CE-CB 4.46Å; M138-L292 HydrophobicContact CE-CD2 3.71Å; M138-L292 HydrophobicContact CG-CB 4.31Å; M138-L292 HydrophobicContact CG-CD2 4.09Å; F141-L292 HydrophobicContact CD1-CD1 3.84Å; F141-L292 HydrophobicContact CE1-CD1 4.02Å; I288-L292 HydrophobicContact CG2-CD1 4.06Å; I288-L292 HydrophobicContact CG2-CG 4.44Å; I288-L292 VanDerWaalsContact O-CG 3.31Å; I288-L292 WeakPolarHBondContact O-CG 3.23Å; I288-L292 PolarHBondContact O-N 3.08Å; G289-L292 PolarHBondContact O-N 3.29Å; T290-L292 VanDerWaalsContact C-N 3.31Å; T290-L292 PolarHBondContact O-N 3.27Å; L292-G296 PolarHBondContact O-N 2.84Å
293I94.5Very high91.7Very high0 Ų059.5 Ų59.50%031%0.307CS..Hα-helixtrans-64.6-51.1179-64.8158.2000110.7V143 T265 F268 G289 T290 V291 G296 L297V143-I293 HydrophobicContact CB-CD1 4.36Å; V143-I293 HydrophobicContact CG2-CD1 3.62Å; V143-I293 HydrophobicContact CG2-CG1 3.76Å; T265-I293 HydrophobicContact CG2-CG2 4.42Å; F268-I293 HydrophobicContact CB-CD1 4.39Å; F268-I293 HydrophobicContact CD1-CD1 4.12Å; F268-I293 HydrophobicContact CD1-CG2 4.12Å; F268-I293 HydrophobicContact CD2-CD1 3.35Å; F268-I293 HydrophobicContact CE1-CD1 4.22Å; F268-I293 HydrophobicContact CE1-CG2 4.08Å; F268-I293 HydrophobicContact CE2-CD1 3.47Å; F268-I293 VanDerWaalsContact CE2-CD1 3.47Å; F268-I293 HydrophobicContact CG-CD1 3.68Å; F268-I293 HydrophobicContact CZ-CD1 3.91Å; G289-I293 WeakPolarHBondContact O-CD1 3.14Å; G289-I293 WeakPolarHBondContact O-CG1 3.38Å; G289-I293 PolarHBondContact O-N 2.81Å; T290-I293 PolarHBondContact O-N 3.15Å; V291-I293 VanDerWaalsContact C-N 3.34Å; V291-I293 PolarHBondContact O-N 3.05Å; I293-G296 PolarHBondContact O-N 2.9Å; I293-L297 HydrophobicContact CG2-CD1 3.77Å; I293-L297 HydrophobicContact CG2-CG 4.35Å; I293-L297 WeakPolarHBondContact O-CB 3.3Å; I293-L297 VanDerWaalsContact O-CG 3.26Å; I293-L297 WeakPolarHBondContact O-CG 3.46Å; I293-L297 PolarHBondContact O-N 3.3Å
294F95.2Very high91.4Very high88 Ų8856.9 Ų56.939%0.38629%0.291SS..Hα-helixtrans-64-46.5-178.1-81.1-70000111.8F268 F269 T290 V291 G296 L297 L298F268-F294 HydrophobicContact CE1-CE2 4.41Å; F268-F294 HydrophobicContact CZ-CE2 4.23Å; F269-F294 HydrophobicContact CE1-CE1 4.34Å; F269-F294 AromaticContact CE1-CZ 3.98Å; F269-F294 HydrophobicContact CE1-CZ 3.98Å; F269-F294 HydrophobicContact CZ-CE1 4.23Å; F269-F294 HydrophobicContact CZ-CZ 4.29Å; T290-F294 HydrophobicContact CG2-CD2 3.59Å; T290-F294 HydrophobicContact CG2-CE2 3.53Å; T290-F294 VanDerWaalsContact O-CD2 3.25Å; T290-F294 WeakPolarHBondContact O-CD2 3.42Å; T290-F294 PolarHBondContact O-N 3.48Å; V291-F294 PolarHBondContact O-N 2.87Å; F294-G296 PolarHBondContact O-N 3.4Å; F294-L297 PolarHBondContact O-N 2.97Å; F294-L298 WeakPolarHBondContact O-CB 3.32Å; F294-L298 VanDerWaalsContact O-CG 3.26Å; F294-L298 WeakPolarHBondContact O-CG 3.36Å; F294-L298 PolarHBondContact O-N 3.33Å
295S95.4Very high90.8Very high45 Ų4556.9 Ų56.932%0.31528%0.282SS..Hα-helixtrans-60.7-45.2175-65.10000111.3V291 L297 L298 L299V291-S295 VanDerWaalsContact O-CB 3.28Å; V291-S295 WeakPolarHBondContact O-CB 3.36Å; V291-S295 PolarHBondContact O-N 3.21Å; V291-S295 PolarHBondContact O-OG 3.3Å; V291-S295 VanDerWaalsContact O-OG 3.11Å; S295-L297 PolarHBondContact O-N 2.97Å; S295-L298 PolarHBondContact O-N 3.4Å; S295-L299 VanDerWaalsContact O-CB 3.26Å; S295-L299 WeakPolarHBondContact O-CB 3.28Å; S295-L299 WeakPolarHBondContact O-CD1 3.43Å; S295-L299 WeakPolarHBondContact O-CG 3.48Å; S295-L299 PolarHBondContact O-N 2.88Å
296G95.2Very high89.6Confident0 Ų057.9 Ų57.90%029%0.287CS..Hα-helixtrans-61.2-41.8177.600000113.1L292 I293 F294 D300L292-G296 PolarHBondContact O-N 2.84Å; I293-G296 PolarHBondContact O-N 2.9Å; F294-G296 PolarHBondContact O-N 3.4Å; G296-D300 WeakPolarHBondContact O-CB 3.48Å; G296-D300 PolarHBondContact O-N 3.24Å
297L93.4Very high87.4Confident33 Ų3368.7 Ų68.717%0.17333%0.327CS..Hα-helixtrans-66.4-47.1176.6-71.9170.2000112.2I139 I261 T265 I293 F294 S295 L299 D300 Q301I139-L297 HydrophobicContact CD1-CD2 3.73Å; I139-L297 HydrophobicContact CD1-CG 4.15Å; I139-L297 HydrophobicContact CG1-CD2 4.31Å; I139-L297 HydrophobicContact CG1-CG 4.27Å; I261-L297 HydrophobicContact CG2-CD2 3.68Å; T265-L297 HydrophobicContact CG2-CD1 3.84Å; T265-L297 HydrophobicContact CG2-CD2 3.83Å; T265-L297 HydrophobicContact CG2-CG 4.26Å; I293-L297 HydrophobicContact CG2-CD1 3.77Å; I293-L297 HydrophobicContact CG2-CG 4.35Å; I293-L297 WeakPolarHBondContact O-CB 3.3Å; I293-L297 VanDerWaalsContact O-CG 3.26Å; I293-L297 WeakPolarHBondContact O-CG 3.46Å; I293-L297 PolarHBondContact O-N 3.3Å; F294-L297 PolarHBondContact O-N 2.97Å; S295-L297 PolarHBondContact O-N 2.97Å; L297-L299 VanDerWaalsContact C-N 3.32Å; L297-L299 PolarHBondContact O-N 2.84Å; L297-D300 PolarHBondContact O-N 3.41Å; L297-Q301 VanDerWaalsContact O-CG 3.3Å; L297-Q301 WeakPolarHBondContact O-CG 3.43Å; L297-Q301 PolarHBondContact O-N 3.46Å
298L92.3Very high84.9Confident117 Ų11766.3 Ų66.361%0.61333%0.334SS*.Hα-helixtrans-61.7-42.7178.5-70.5172.7000111.2F294 S295 Q301 T302F294-L298 WeakPolarHBondContact O-CB 3.32Å; F294-L298 VanDerWaalsContact O-CG 3.26Å; F294-L298 WeakPolarHBondContact O-CG 3.36Å; F294-L298 PolarHBondContact O-N 3.33Å; S295-L298 PolarHBondContact O-N 3.4Å; L298-Q301 PolarHBondContact O-N 3.43Å; L298-T302 WeakPolarHBondContact O-CB 3.39Å; L298-T302 WeakPolarHBondContact O-CG2 3.3Å; L298-T302 PolarHBondContact O-N 2.9Å; L298-T302 VanDerWaalsContact O-N 3.11Å; L298-T302 PolarHBondContact O-OG1 3.04Å
299L93.3Very high81.9Confident61 Ų6171.9 Ų71.932%0.31935%0.354SS..Hα-helixtrans-68.7-39.9178.1-68.6170.8000112.4F135 S295 L297 Q301 T302 Y303 G304F135-L299 HydrophobicContact CD1-CB 3.54Å; F135-L299 HydrophobicContact CD1-CD1 4.01Å; F135-L299 HydrophobicContact CD1-CG 4.4Å; F135-L299 HydrophobicContact CD2-CB 4.09Å; F135-L299 HydrophobicContact CE1-CB 3.47Å; F135-L299 VanDerWaalsContact CE1-CB 3.47Å; F135-L299 HydrophobicContact CE1-CD1 3.75Å; F135-L299 HydrophobicContact CE1-CD2 4.47Å; F135-L299 HydrophobicContact CE1-CG 4.09Å; F135-L299 HydrophobicContact CE2-CB 4Å; F135-L299 WeakPolarHBondContact CE2-O 3.32Å; F135-L299 HydrophobicContact CG-CB 3.87Å; F135-L299 HydrophobicContact CZ-CB 3.69Å; F135-L299 HydrophobicContact CZ-CG 4.49Å; S295-L299 VanDerWaalsContact O-CB 3.26Å; S295-L299 WeakPolarHBondContact O-CB 3.28Å; S295-L299 WeakPolarHBondContact O-CD1 3.43Å; S295-L299 WeakPolarHBondContact O-CG 3.48Å; S295-L299 PolarHBondContact O-N 2.88Å; L297-L299 VanDerWaalsContact C-N 3.32Å; L297-L299 PolarHBondContact O-N 2.84Å; L299-Q301 PolarHBondContact O-N 3.26Å; L299-T302 WeakPolarHBondContact CA-OG1 3.5Å; L299-T302 PolarHBondContact O-N 2.96Å; L299-T302 PolarHBondContact O-OG1 2.73Å; L299-Y303 HydrophobicContact CD2-CD2 3.95Å; L299-Y303 HydrophobicContact CD2-CE2 4.11Å; L299-Y303 WeakPolarHBondContact O-CA 3.31Å; L299-Y303 PolarHBondContact O-N 2.98Å; L299-G304 PolarHBondContact O-N 3.02Å
300D91.2Very high78.8Confident3 Ų380.3 Ų80.32%0.01639%0.394CS..Hα-helixtrans-65.5-38174.8-175.458.4000112.2K132 F135 G296 L297 G304K132-D300 IonicContact NZ-OD1 3.03Å; K132-D300 PolarHBondContact NZ-OD1 2.83Å; K132-D300 IonicContact NZ-OD2 3.11Å; K132-D300 PolarHBondContact NZ-OD2 3.47Å; F135-D300 HydrophobicContact CB-CB 3.96Å; F135-D300 HydrophobicContact CD2-CB 4.24Å; F135-D300 HydrophobicContact CG-CB 4.48Å; G296-D300 WeakPolarHBondContact O-CB 3.48Å; G296-D300 PolarHBondContact O-N 3.24Å; L297-D300 PolarHBondContact O-N 3.41Å; D300-G304 WeakPolarHBondContact O-CA 3.39Å; D300-G304 PolarHBondContact O-N 3.29Å
301Q87.1Confident75.9Confident65 Ų6583.1 Ų83.130%0.30441%0.414SS..Hα-helixtrans-68.8-34.6177.8-70.7-54.6-53.800113.4L297 L298 L299 K305L297-Q301 VanDerWaalsContact O-CG 3.3Å; L297-Q301 WeakPolarHBondContact O-CG 3.43Å; L297-Q301 PolarHBondContact O-N 3.46Å; L298-Q301 PolarHBondContact O-N 3.43Å; L299-Q301 PolarHBondContact O-N 3.26Å; Q301-K305 WeakPolarHBondContact O-CE 3.25Å
302T86.1Confident72.9Confident91 Ų9182.9 Ų82.956%0.55842%0.416SS*.Hα-helixtrans-87.9-46.1-176.949.70000112.6L298 L299L298-T302 WeakPolarHBondContact O-CB 3.39Å; L298-T302 WeakPolarHBondContact O-CG2 3.3Å; L298-T302 PolarHBondContact O-N 2.9Å; L298-T302 VanDerWaalsContact O-N 3.11Å; L298-T302 PolarHBondContact O-OG1 3.04Å; L299-T302 WeakPolarHBondContact CA-OG1 3.5Å; L299-T302 PolarHBondContact O-N 2.96Å; L299-T302 PolarHBondContact O-OG1 2.73Å
303Y86Confident70.1Confident159 Ų15986.8 Ų86.862%0.62444%0.437SS*.Hα-helixtrans-116.2-11.6-172.4-59.9-74.4000114.3L299 K305L299-Y303 HydrophobicContact CD2-CD2 3.95Å; L299-Y303 HydrophobicContact CD2-CE2 4.11Å; L299-Y303 WeakPolarHBondContact O-CA 3.31Å; L299-Y303 PolarHBondContact O-N 2.98Å; Y303-K305 VanDerWaalsContact C-N 3.33Å; Y303-K305 PolarHBondContact O-N 3.13Å
304G80.2Confident67.4Low1 Ų191.8 Ų91.81%0.0146%0.464CS..  trans-80.8-3.9-17800000115.1K132 L299 D300 T306K132-G304 WeakPolarHBondContact CD-O 3.37Å; L299-G304 PolarHBondContact O-N 3.02Å; D300-G304 WeakPolarHBondContact O-CA 3.39Å; D300-G304 PolarHBondContact O-N 3.29Å; G304-T306 PolarHBondContact O-N 3.16Å
305K76.2Confident64.9Low109 Ų10991.3 Ų91.347%0.47447%0.468SS..SBendtrans-78.8122.3178.8-66.8177.1-176.2167.10110Q301 Y303 R307Q301-K305 WeakPolarHBondContact O-CE 3.25Å; Y303-K305 VanDerWaalsContact C-N 3.33Å; Y303-K305 PolarHBondContact O-N 3.13Å; K305-R307 PolarHBondContact O-N 2.79Å; K305-R307 VanDerWaalsContact O-N 3.07Å
306T62.8Low62.5Low65 Ų6594.4 Ų94.440%0.39948%0.482SS..  trans-59.1114.8165.2-48.10000107.1R127 G304 S308R127-T306 PolarHBondContact O-OG1 3.19Å; G304-T306 PolarHBondContact O-N 3.16Å; T306-S308 PolarHBondContact O-N 3.43Å
307R43.5Very low60.1Low234 Ų23499.7 Ų99.788%0.88351%0.51SS*.  trans-52.6116.6166.1-76.6-175.5178.9-178.4-0.4105.8K305 K309K305-R307 PolarHBondContact O-N 2.79Å; K305-R307 VanDerWaalsContact O-N 3.07Å; R307-K309 PolarHBondContact O-N 3.24Å; R307-K309 VanDerWaalsContact O-N 3.13Å
308S39.1Very low58.2Low100 Ų100102.9 Ų102.970%0.69953%0.526SS*.  trans-55.1127.9162.763.20000104.4T306 Q310T306-S308 PolarHBondContact O-N 3.43Å; S308-Q310 PolarHBondContact O-N 3.07Å
309K30.1Very low56.4Low202 Ų202101.3 Ų101.388%0.87852%0.518SS*.  trans-56.899161.9-88.2-177.4173.3-176.90103.9R307 S311R307-K309 PolarHBondContact O-N 3.24Å; R307-K309 VanDerWaalsContact O-N 3.13Å; K309-S311 PolarHBondContact O-N 3.36Å
310Q30Very low54.7Low178 Ų178100.2 Ų100.283%0.83252%0.522SS*.  trans-48.5119.3157.9-96.8177.6-23.400104.4S308 S312S308-Q310 PolarHBondContact O-N 3.07Å; Q310-S312 PolarHBondContact O-N 2.84Å
311S32.1Very low53.4Low70 Ų70104 Ų10449%0.4955%0.545SS..  trans-25.596.8176.6-177.40000112.4K309 N313 N314K309-S311 PolarHBondContact O-N 3.36Å; S311-N313 PolarHBondContact O-N 3.49Å; S311-N313 WeakPolarHBondContact OG-CB 3.35Å; S311-N313 PolarHBondContact OG-N 3.25Å; S311-N314 PolarHBondContact O-N 3.29Å; S311-N314 PolarHBondContact OG-N 3.17Å
312S32.3Very low52.2Low81 Ų81106.3 Ų106.357%0.56656%0.557SS**THydrogen-bonded Turntrans-70.17.6158.2-170.60000110.8Q310Q310-S312 PolarHBondContact O-N 2.84Å
313N36.7Very low51.4Low120 Ų120107.1 Ų107.164%0.64256%0.558SS**Hα-helixtrans-80.2-17.9166.6-75.50.8000112S311 N317S311-N313 PolarHBondContact O-N 3.49Å; S311-N313 WeakPolarHBondContact OG-CB 3.35Å; S311-N313 PolarHBondContact OG-N 3.25Å; N313-N317 WeakPolarHBondContact O-CB 3.36Å; N313-N317 PolarHBondContact O-N 2.9Å
314N37.2Very low50.6Low105 Ų105102.2 Ų102.256%0.56155%0.547SS*.Hα-helixtrans-69.9-33.6173.1-101.720.3000112.2S311 I318S311-N314 PolarHBondContact O-N 3.29Å; S311-N314 PolarHBondContact OG-N 3.17Å; N314-I318 WeakPolarHBondContact O-CB 3.35Å; N314-I318 WeakPolarHBondContact O-CD1 3.4Å; N314-I318 WeakPolarHBondContact O-CG1 3.14Å; N314-I318 PolarHBondContact O-N 3.45Å
315T42.9Very low50.4Low78 Ų78105.7 Ų105.748%0.47957%0.568SS.*Hα-helixtrans-70.5-38.6176.5-45.70000112N319T315-N319 WeakPolarHBondContact O-CB 3.36Å; T315-N319 VanDerWaalsContact O-CG 3.28Å; T315-N319 PolarHBondContact O-N 2.92Å
316N44.5Very low50.2Low111 Ų111106.3 Ų106.359%0.59457%0.571SS**Hα-helixtrans-69.1-36.4175.5-76.9-0.6000112.3G320N316-G320 PolarHBondContact O-N 3.04Å
317N46.2Very low50.7Low111 Ų111105.8 Ų105.859%0.59457%0.569SS**Hα-helixtrans-72.9-38.9177.6-144.315.7000111.5N313 G320 T321N313-N317 WeakPolarHBondContact O-CB 3.36Å; N313-N317 PolarHBondContact O-N 2.9Å; N317-G320 PolarHBondContact O-N 2.94Å; N317-T321 PolarHBondContact O-N 2.81Å; N317-T321 PolarHBondContact O-OG1 3.37Å
318I52.1Low52.1Low100 Ų100100.2 Ų100.251%0.51355%0.553SS.*Hα-helixtrans-63.3-45173.1-68.3164.5000110.6N314 G320 T321 M322N314-I318 WeakPolarHBondContact O-CB 3.35Å; N314-I318 WeakPolarHBondContact O-CD1 3.4Å; N314-I318 WeakPolarHBondContact O-CG1 3.14Å; N314-I318 PolarHBondContact O-N 3.45Å; I318-G320 VanDerWaalsContact C-N 3.32Å; I318-G320 PolarHBondContact O-N 2.87Å; I318-T321 PolarHBondContact O-N 3.3Å; I318-M322 WeakPolarHBondContact O-CB 3.3Å; I318-M322 PolarHBondContact O-N 2.96Å
319N53.9Low53.9Low83 Ų8399.3 Ų99.344%0.44454%0.54SS..Hα-helixtrans-65.1-36176.4-73.9-4.6000112.1T315 N323T315-N319 WeakPolarHBondContact O-CB 3.36Å; T315-N319 VanDerWaalsContact O-CG 3.28Å; T315-N319 PolarHBondContact O-N 2.92Å; N319-N323 VanDerWaalsContact O-CB 3.3Å; N319-N323 WeakPolarHBondContact O-CB 3.44Å; N319-N323 VanDerWaalsContact O-CG 3.27Å; N319-N323 PolarHBondContact O-N 2.95Å
320G57.8Low56.1Low39 Ų3995.8 Ų95.840%0.40253%0.527SS..Hα-helixtrans-62.8-49.2173.100000112.4N316 N317 I318 N323 S324N316-G320 PolarHBondContact O-N 3.04Å; N317-G320 PolarHBondContact O-N 2.94Å; I318-G320 VanDerWaalsContact C-N 3.32Å; I318-G320 PolarHBondContact O-N 2.87Å; G320-N323 PolarHBondContact O-N 3.24Å; G320-S324 WeakPolarHBondContact O-CB 3.21Å; G320-S324 PolarHBondContact O-N 2.94Å
321T65.5Low58.2Low81 Ų8192.8 Ų92.850%0.49752%0.515SS..Hα-helixtrans-63.7-42.3176-52.30000111.5N317 I318 N323 S324 V325N317-T321 PolarHBondContact O-N 2.81Å; N317-T321 PolarHBondContact O-OG1 3.37Å; I318-T321 PolarHBondContact O-N 3.3Å; T321-N323 PolarHBondContact O-N 2.92Å; T321-S324 PolarHBondContact O-N 3.47Å; T321-V325 HydrophobicContact CG2-CG2 4.39Å; T321-V325 VanDerWaalsContact O-CG2 3.3Å; T321-V325 WeakPolarHBondContact O-CG2 3.45Å; T321-V325 PolarHBondContact O-N 3.43Å
322M61.6Low60.1Low114 Ų11495.7 Ų95.756%0.56252%0.521SS*.Hα-helixtrans-67.6-35.9-179.4-152.1174.2-16500111.8I318 K326I318-M322 WeakPolarHBondContact O-CB 3.3Å; I318-M322 PolarHBondContact O-N 2.96Å; M322-K326 WeakPolarHBondContact O-CB 3.3Å; M322-K326 WeakPolarHBondContact O-CG 3.41Å; M322-K326 PolarHBondContact O-N 3.25Å
323N69.2Low62.1Low109 Ų10999.2 Ų99.258%0.58353%0.526SS*.Hα-helixtrans-69.5-39.4172.1-76.8-8.3000112.2N319 G320 T321 K326 S327N319-N323 VanDerWaalsContact O-CB 3.3Å; N319-N323 WeakPolarHBondContact O-CB 3.44Å; N319-N323 VanDerWaalsContact O-CG 3.27Å; N319-N323 PolarHBondContact O-N 2.95Å; G320-N323 PolarHBondContact O-N 3.24Å; T321-N323 PolarHBondContact O-N 2.92Å; N323-K326 PolarHBondContact O-N 3.47Å; N323-S327 PolarHBondContact O-N 3.03Å; N323-S327 PolarHBondContact O-OG 3.43Å
324S69.9Low63.8Low56 Ų56102 Ų10239%0.39253%0.533SS..Hα-helixtrans-64.6-42.7175.5171.30000112.3G320 T321 S327 H328G320-S324 WeakPolarHBondContact O-CB 3.21Å; G320-S324 PolarHBondContact O-N 2.94Å; T321-S324 PolarHBondContact O-N 3.47Å; S324-S327 WeakPolarHBondContact CA-OG 3.37Å; S324-S327 PolarHBondContact O-N 2.76Å; S324-S327 PolarHBondContact O-OG 2.99Å; S324-H328 PolarHBondContact O-CD2 3.06Å; S324-H328 PolarHBondContact O-N 3.4Å
325V73.9Confident65.2Low74 Ų74101.7 Ų101.745%0.44854%0.539SS..Hα-helixtrans-64.9-43.8175.8172.40000110.8T321 S327 H328 I329T321-V325 HydrophobicContact CG2-CG2 4.39Å; T321-V325 VanDerWaalsContact O-CG2 3.3Å; T321-V325 WeakPolarHBondContact O-CG2 3.45Å; T321-V325 PolarHBondContact O-N 3.43Å; V325-S327 VanDerWaalsContact C-N 3.34Å; V325-S327 PolarHBondContact O-N 3.44Å; V325-H328 PolarHBondContact O-N 3.01Å; V325-I329 HydrophobicContact CG1-CD1 3.78Å; V325-I329 HydrophobicContact CG1-CG1 4.45Å; V325-I329 WeakPolarHBondContact O-CG1 3.4Å; V325-I329 PolarHBondContact O-N 2.87Å
326K73.9Confident66.2Low122 Ų122108.6 Ų108.653%0.5357%0.566SS.*Hα-helixtrans-59.6-43.2174.1-80.8-177.2177-176.30112.1M322 N323 H328 I329 E330M322-K326 WeakPolarHBondContact O-CB 3.3Å; M322-K326 WeakPolarHBondContact O-CG 3.41Å; M322-K326 PolarHBondContact O-N 3.25Å; N323-K326 PolarHBondContact O-N 3.47Å; K326-H328 VanDerWaalsContact C-N 3.35Å; K326-H328 PolarHBondContact O-N 3.4Å; K326-I329 PolarHBondContact O-N 3.25Å; K326-E330 WeakPolarHBondContact O-CB 3.28Å; K326-E330 WeakPolarHBondContact O-CG 3.48Å; K326-E330 PolarHBondContact O-N 2.95Å
327S72.5Confident67.3Low53 Ų53108.5 Ų108.537%0.37156%0.564SS.*Hα-helixtrans-65.8-35.5177.3590000113N323 S324 V325 L331N323-S327 PolarHBondContact O-N 3.03Å; N323-S327 PolarHBondContact O-OG 3.43Å; S324-S327 WeakPolarHBondContact CA-OG 3.37Å; S324-S327 PolarHBondContact O-N 2.76Å; S324-S327 PolarHBondContact O-OG 2.99Å; V325-S327 VanDerWaalsContact C-N 3.34Å; V325-S327 PolarHBondContact O-N 3.44Å; S327-L331 VanDerWaalsContact O-CG 3.28Å; S327-L331 WeakPolarHBondContact O-CG 3.49Å; S327-L331 PolarHBondContact O-N 3.31Å
328H72.3Confident68.4Low117 Ų117108.3 Ų108.354%0.54256%0.563SS.*Hα-helixtrans-67.6-43.2175.8-88.6-61.1000112.2S324 V325 K326 E330 L331 E332S324-H328 PolarHBondContact O-CD2 3.06Å; S324-H328 PolarHBondContact O-N 3.4Å; V325-H328 PolarHBondContact O-N 3.01Å; K326-H328 VanDerWaalsContact C-N 3.35Å; K326-H328 PolarHBondContact O-N 3.4Å; H328-E330 VanDerWaalsContact C-N 3.33Å; H328-E330 PolarHBondContact O-N 3.09Å; H328-L331 PolarHBondContact O-N 3.43Å; H328-E332 PolarHBondContact O-N 3.12Å
329I77.1Confident69.3Low82 Ų82108.8 Ų108.842%0.42157%0.566SS.*Hα-helixtrans-65.1-37.6177-65.4167.9000111.2V325 K326 L331 K333V325-I329 HydrophobicContact CG1-CD1 3.78Å; V325-I329 HydrophobicContact CG1-CG1 4.45Å; V325-I329 WeakPolarHBondContact O-CG1 3.4Å; V325-I329 PolarHBondContact O-N 2.87Å; K326-I329 PolarHBondContact O-N 3.25Å; I329-L331 VanDerWaalsContact C-N 3.33Å; I329-K333 WeakPolarHBondContact O-CB 3.49Å; I329-K333 WeakPolarHBondContact O-CG 3.34Å; I329-K333 PolarHBondContact O-N 3.46Å; I329-K333 VanDerWaalsContact O-N 3.09Å
330E76.8Confident70.2Confident128 Ų128110.3 Ų110.360%0.59857%0.573SS**Hα-helixtrans-69.5-28.9175.9-76.5179.6-175.100113.2K326 H328 K334K326-E330 WeakPolarHBondContact O-CB 3.28Å; K326-E330 WeakPolarHBondContact O-CG 3.48Å; K326-E330 PolarHBondContact O-N 2.95Å; H328-E330 VanDerWaalsContact C-N 3.33Å; H328-E330 PolarHBondContact O-N 3.09Å; E330-K334 PolarHBondContact O-N 2.79Å
331L74.2Confident71Confident114 Ų114114.8 Ų114.860%0.59758%0.583SS**Hα-helixtrans-75.2-43174-74.6169.2000111.9S327 H328 I329 K333 K334 S335S327-L331 VanDerWaalsContact O-CG 3.28Å; S327-L331 WeakPolarHBondContact O-CG 3.49Å; S327-L331 PolarHBondContact O-N 3.31Å; H328-L331 PolarHBondContact O-N 3.43Å; I329-L331 VanDerWaalsContact C-N 3.33Å; L331-K333 VanDerWaalsContact C-N 3.34Å; L331-K333 PolarHBondContact O-N 3.22Å; L331-K334 PolarHBondContact O-N 3.38Å; L331-K334 VanDerWaalsContact O-N 3.12Å; L331-S335 PolarHBondContact O-N 3.2Å
332E71.3Confident71.4Confident132 Ų132117 Ų11762%0.61759%0.589SS**Hα-helixtrans-60.4-43.5175.2-78.1-179.1160.500111.4H328 K334 S335 E336H328-E332 PolarHBondContact O-N 3.12Å; E332-K334 PolarHBondContact O-N 3.03Å; E332-S335 PolarHBondContact O-N 3.47Å; E332-S335 PolarHBondContact O-OG 2.98Å; E332-E336 PolarHBondContact O-N 3.21Å
333K74.1Confident72.1Confident154 Ų154117.2 Ų117.267%0.6759%0.591SS**Hα-helixtrans-64.7-19175.7-80.1-173.7175.9-175.40115.1I329 L331I329-K333 WeakPolarHBondContact O-CB 3.49Å; I329-K333 WeakPolarHBondContact O-CG 3.34Å; I329-K333 PolarHBondContact O-N 3.46Å; I329-K333 VanDerWaalsContact O-N 3.09Å; L331-K333 VanDerWaalsContact C-N 3.34Å; L331-K333 PolarHBondContact O-N 3.22Å
334K72.4Confident72.3Confident178 Ų178117.8 Ų117.877%0.77459%0.592SS**Hα-helixtrans-91.2-13.6174.3-81.2-178.8177.7177.10112.7E330 L331 E332E330-K334 PolarHBondContact O-N 2.79Å; L331-K334 PolarHBondContact O-N 3.38Å; L331-K334 VanDerWaalsContact O-N 3.12Å; E332-K334 PolarHBondContact O-N 3.03Å
335S68.1Low72.5Confident99 Ų99123 Ų12369%0.69261%0.608SS**Hα-helixtrans-92.6-13.3177.8630000114.2L331 E332L331-S335 PolarHBondContact O-N 3.2Å; E332-S335 PolarHBondContact O-N 3.47Å; E332-S335 PolarHBondContact O-OG 2.98Å
336E63.3Low72.4Confident223 Ų223127.5 Ų127.5100%1.04262%0.623SS**  trans-88.10167.7-65.9-176161.700111.4E332E332-E336 PolarHBondContact O-N 3.21Å

Retrieved 336 of 336 residues in 692.6 ms (Link to these results)

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