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Polyprenal reductase AlphaSync

Plays a key role in early steps of protein N-linked glycosylation by being involved in the conversion of polyprenol into dolichol. Acts as a polyprenal reductase that mediates the reduction of polyprenal into dolichal in a NADP-dependent mechanism. Dolichols are required for the synthesis of dolichol-linked monosaccharides and the oligosaccharide precursor used for N-glycosylation.

AlphaFold DB , UniProt , Accession A0A5K4FEU2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 279 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
1M62.7Low81.5Confident79 Ų7985.2 Ų85.239%0.38946%0.463SS..  0131.10-87.1-178.1-8800108.3T3 F5 V6 L90 L147 L148 Q150M1-T3 PolarHBondContact O-N 2.93Å; M1-F5 HydrophobicContact CG-CD1 4.35Å; M1-F5 HydrophobicContact SD-CD1 4.09Å; M1-F5 HydrophobicContact SD-CE1 4.19Å; M1-V6 HydrophobicContact CB-CG2 3.55Å; M1-V6 HydrophobicContact CG-CG2 4.34Å; M1-V6 HydrophobicContact SD-CG2 3.94Å; M1-L90 HydrophobicContact CG-CD1 3.82Å; M1-L90 HydrophobicContact CG-CD2 3.97Å; M1-L90 HydrophobicContact CG-CG 4.45Å; M1-L147 HydrophobicContact CE-CG 4.25Å; M1-L147 WeakPolarHBondContact CE-O 3.4Å; M1-L147 HydrophobicContact SD-CD2 4.27Å; M1-L147 HydrophobicContact SD-CG 4.11Å; M1-L148 HydrophobicContact SD-CD2 4.18Å; M1-Q150 HydrophobicContact CE-CB 4.48Å
2D71.5Confident82.6Confident131 Ų13182.3 Ų82.370%0.70145%0.446SS*.  trans-58.4135.2174.3-62.1-28.8000110.1I4 F5 V6D2-I4 PolarHBondContact O-N 3.4Å; D2-I4 VanDerWaalsContact O-N 3.12Å; D2-F5 WeakPolarHBondContact O-CB 3.43Å; D2-F5 PolarHBondContact O-N 3.41Å; D2-V6 PolarHBondContact O-N 3.26Å
3T74.6Confident83.7Confident107 Ų10775.9 Ų75.966%0.65641%0.412SS*.Hα-helixtrans-54.4-34.7-177.949.30000112M1 N7M1-T3 PolarHBondContact O-N 2.93Å; T3-N7 VanDerWaalsContact O-CB 3.3Å; T3-N7 WeakPolarHBondContact O-CB 3.35Å; T3-N7 PolarHBondContact O-N 3.47Å; T3-N7 PolarHBondContact O-ND2 2.82Å
4I79.4Confident84.6Confident134 Ų13481.6 Ų81.669%0.68742%0.424SS*.Hα-helixtrans-61.9-46.7176.3-61174.6000111.4D2 N7 L8D2-I4 PolarHBondContact O-N 3.4Å; D2-I4 VanDerWaalsContact O-N 3.12Å; I4-N7 PolarHBondContact O-N 2.82Å; I4-L8 WeakPolarHBondContact O-CB 3.48Å; I4-L8 PolarHBondContact O-N 2.88Å
5F79.9Confident85.4Confident85 Ų8582.5 Ų82.537%0.37343%0.428SS..Hα-helixtrans-64.3-44.2-179.2-177.4-97.5000111.5M1 D2 L8 L9 L147M1-F5 HydrophobicContact CG-CD1 4.35Å; M1-F5 HydrophobicContact SD-CD1 4.09Å; M1-F5 HydrophobicContact SD-CE1 4.19Å; D2-F5 WeakPolarHBondContact O-CB 3.43Å; D2-F5 PolarHBondContact O-N 3.41Å; F5-L8 PolarHBondContact O-N 2.83Å; F5-L9 HydrophobicContact CD1-CD1 4.02Å; F5-L9 HydrophobicContact CD2-CD1 3.92Å; F5-L9 HydrophobicContact CE1-CD1 3.49Å; F5-L9 VanDerWaalsContact CE1-CD1 3.49Å; F5-L9 HydrophobicContact CE2-CD1 3.37Å; F5-L9 HydrophobicContact CE2-CG 4.38Å; F5-L9 HydrophobicContact CG-CD1 4.23Å; F5-L9 HydrophobicContact CZ-CD1 3.13Å; F5-L9 HydrophobicContact CZ-CG 4.42Å; F5-L9 WeakPolarHBondContact O-CG 3.36Å; F5-L9 PolarHBondContact O-N 3.18Å; F5-L147 HydrophobicContact CE1-CD2 4.33Å
6V81.7Confident86.1Confident47 Ų4777.7 Ų77.729%0.28540%0.403SS..Hα-helixtrans-62.8-44.6176.5-179.50000110.7M1 D2 L8 L9 S10 L148M1-V6 HydrophobicContact CB-CG2 3.55Å; M1-V6 HydrophobicContact CG-CG2 4.34Å; M1-V6 HydrophobicContact SD-CG2 3.94Å; D2-V6 PolarHBondContact O-N 3.26Å; V6-L8 VanDerWaalsContact C-N 3.34Å; V6-L8 PolarHBondContact O-N 2.7Å; V6-L9 PolarHBondContact O-N 3.35Å; V6-S10 WeakPolarHBondContact O-CB 3.19Å; V6-S10 PolarHBondContact O-N 3.36Å; V6-S10 PolarHBondContact O-OG 3.22Å; V6-L148 HydrophobicContact CG1-CD2 4.28Å
7N84.5Confident86.7Confident114 Ų11473.9 Ų73.961%0.6139%0.385SS*.Hα-helixtrans-64.4-38.2179.7-72.7-16.9000112.2T3 I4 P11T3-N7 VanDerWaalsContact O-CB 3.3Å; T3-N7 WeakPolarHBondContact O-CB 3.35Å; T3-N7 PolarHBondContact O-N 3.47Å; T3-N7 PolarHBondContact O-ND2 2.82Å; I4-N7 PolarHBondContact O-N 2.82Å; N7-P11 WeakPolarHBondContact O-CD 3.45Å
8L89.9Confident87.2Confident125 Ų12572.2 Ų72.265%0.65439%0.388SS*.Hα-helixtrans-69.6-41.7178.7-176.764.1000112.5I4 F5 V6 P11I4-L8 WeakPolarHBondContact O-CB 3.48Å; I4-L8 PolarHBondContact O-N 2.88Å; F5-L8 PolarHBondContact O-N 2.83Å; V6-L8 VanDerWaalsContact C-N 3.34Å; V6-L8 PolarHBondContact O-N 2.7Å; L8-P11 WeakPolarHBondContact O-CD 3.2Å
9L91Very high87.6Confident22 Ų2271.4 Ų71.412%0.11538%0.383CS..Hα-helixtrans-96-23.7-171-59.7-175.3000114.5F5 V6 P11 L12 P13 I144 L148F5-L9 HydrophobicContact CD1-CD1 4.02Å; F5-L9 HydrophobicContact CD2-CD1 3.92Å; F5-L9 HydrophobicContact CE1-CD1 3.49Å; F5-L9 VanDerWaalsContact CE1-CD1 3.49Å; F5-L9 HydrophobicContact CE2-CD1 3.37Å; F5-L9 HydrophobicContact CE2-CG 4.38Å; F5-L9 HydrophobicContact CG-CD1 4.23Å; F5-L9 HydrophobicContact CZ-CD1 3.13Å; F5-L9 HydrophobicContact CZ-CG 4.42Å; F5-L9 WeakPolarHBondContact O-CG 3.36Å; F5-L9 PolarHBondContact O-N 3.18Å; V6-L9 PolarHBondContact O-N 3.35Å; L9-P11 VanDerWaalsContact C-N 3.29Å; L9-L12 HydrophobicContact CB-CD1 4.36Å; L9-L12 HydrophobicContact CD2-CD1 3.52Å; L9-L12 WeakPolarHBondContact O-CB 3.47Å; L9-L12 PolarHBondContact O-N 2.87Å; L9-P13 WeakPolarHBondContact O-CD 3.47Å; L9-I144 HydrophobicContact CB-CG2 4.08Å; L9-I144 HydrophobicContact CD1-CG2 3.77Å; L9-I144 HydrophobicContact CG-CG2 4.49Å; L9-L148 HydrophobicContact CB-CD1 4.07Å
10S88.5Confident87.9Confident32 Ų3267.9 Ų67.922%0.22437%0.365CS..THydrogen-bonded Turntrans-57.7-27.5-179.462.20000115.9V6V6-S10 WeakPolarHBondContact O-CB 3.19Å; V6-S10 PolarHBondContact O-N 3.36Å; V6-S10 PolarHBondContact O-OG 3.22Å
11P93.3Very high88.3Confident61 Ų6168.9 Ų68.940%0.39637%0.369SS..THydrogen-bonded Turntrans-74.3-24.3173.4-19.134.7000113.5N7 L8 L9 R14N7-P11 WeakPolarHBondContact O-CD 3.45Å; L8-P11 WeakPolarHBondContact O-CD 3.2Å; L9-P11 VanDerWaalsContact C-N 3.29Å; P11-R14 VanDerWaalsContact O-CB 3.29Å; P11-R14 WeakPolarHBondContact O-CB 3.41Å; P11-R14 PolarHBondContact O-N 2.73Å
12L94.9Very high89.8Confident50 Ų5066.6 Ų66.626%0.26236%0.363SS..Hα-helixtrans-60.8-44.7-169.9-62.1178.8000113.7L9 R14 I15 I141L9-L12 HydrophobicContact CB-CD1 4.36Å; L9-L12 HydrophobicContact CD2-CD1 3.52Å; L9-L12 WeakPolarHBondContact O-CB 3.47Å; L9-L12 PolarHBondContact O-N 2.87Å; L12-R14 PolarHBondContact O-N 3.29Å; L12-I15 HydrophobicContact CD2-CD1 4.12Å; L12-I15 WeakPolarHBondContact O-CB 3.41Å; L12-I15 PolarHBondContact O-N 3.21Å; L12-I141 HydrophobicContact CB-CD1 3.94Å; L12-I141 HydrophobicContact CB-CG1 4.24Å; L12-I141 HydrophobicContact CB-CG2 4.13Å; L12-I141 HydrophobicContact CD1-CG1 4.45Å
13P96.4Very high90.7Very high0 Ų060.9 Ų60.90%034%0.335CS..Hα-helixtrans-59.7-31.8176.2-24.836000112.9L9 I15 F16 I141 L148 S237 H240 I241L9-P13 WeakPolarHBondContact O-CD 3.47Å; P13-I15 PolarHBondContact O-N 3.27Å; P13-F16 WeakPolarHBondContact O-CB 3.05Å; P13-F16 PolarHBondContact O-N 3.26Å; P13-I141 HydrophobicContact CB-CG2 4.44Å; P13-I141 HydrophobicContact CG-CG2 4.04Å; P13-L148 HydrophobicContact CG-CD1 4.44Å; P13-S237 VanDerWaalsContact CB-O 3.31Å; P13-S237 WeakPolarHBondContact CB-O 3.2Å; P13-H240 HydrophobicContact CB-CB 3.93Å; P13-H240 WeakPolarHBondContact O-CB 3.41Å; P13-I241 HydrophobicContact CB-CD1 4.5Å
14R96.1Very high91.5Very high155 Ų15558.5 Ų58.559%0.58532%0.32SS*.Hα-helixtrans-63.3-29-178.5-55-176.7-177.6174.71.7112.7P11 L12 F16 S17 G18P11-R14 VanDerWaalsContact O-CB 3.29Å; P11-R14 WeakPolarHBondContact O-CB 3.41Å; P11-R14 PolarHBondContact O-N 2.73Å; L12-R14 PolarHBondContact O-N 3.29Å; R14-F16 PolarHBondContact O-N 2.9Å; R14-S17 PolarHBondContact O-N 2.91Å; R14-S17 VanDerWaalsContact O-N 3.11Å; R14-G18 PolarHBondContact O-N 3.24Å
15I96.1Very high92.2Very high95 Ų9557 Ų5749%0.48731%0.313SS..Hα-helixtrans-55.4-40.4174.2-60.2174.4000109.9L12 P13 S17 G18 L19L12-I15 HydrophobicContact CD2-CD1 4.12Å; L12-I15 WeakPolarHBondContact O-CB 3.41Å; L12-I15 PolarHBondContact O-N 3.21Å; P13-I15 PolarHBondContact O-N 3.27Å; I15-S17 PolarHBondContact O-N 3.19Å; I15-G18 PolarHBondContact O-N 3.09Å; I15-L19 HydrophobicContact CG2-CD1 4.16Å; I15-L19 HydrophobicContact CG2-CG 4.39Å; I15-L19 WeakPolarHBondContact O-CG 3.3Å; I15-L19 PolarHBondContact O-N 3.34Å
16F96.9Very high92.7Very high6 Ų655.4 Ų55.43%0.02631%0.306CS..Hα-helixtrans-68.1-33.2179.2-76.6-74.9000113.3P13 R14 G18 L19 G20 M134 F138 I141 I241 F244P13-F16 WeakPolarHBondContact O-CB 3.05Å; P13-F16 PolarHBondContact O-N 3.26Å; R14-F16 PolarHBondContact O-N 2.9Å; F16-G18 VanDerWaalsContact C-N 3.34Å; F16-L19 HydrophobicContact CD1-CD1 4.09Å; F16-L19 HydrophobicContact CE1-CD1 4.05Å; F16-L19 PolarHBondContact O-N 3.39Å; F16-G20 PolarHBondContact O-N 2.91Å; F16-M134 HydrophobicContact CE1-CG 4.27Å; F16-F138 HydrophobicContact CD1-CB 4.28Å; F16-F138 AromaticContact CD1-CD2 3.93Å; F16-F138 HydrophobicContact CD1-CD2 3.93Å; F16-F138 HydrophobicContact CE1-CB 3.54Å; F16-F138 HydrophobicContact CE1-CD2 4.06Å; F16-F138 HydrophobicContact CE1-CG 4.31Å; F16-F138 HydrophobicContact CG-CD2 4.43Å; F16-F138 HydrophobicContact CZ-CB 3.79Å; F16-I141 HydrophobicContact CD2-CB 4.5Å; F16-I141 HydrophobicContact CD2-CD1 4.5Å; F16-I141 HydrophobicContact CD2-CG2 4.26Å; F16-I141 HydrophobicContact CE2-CB 3.9Å; F16-I141 HydrophobicContact CE2-CD1 3.6Å; F16-I141 HydrophobicContact CE2-CG1 4.28Å; F16-I141 HydrophobicContact CE2-CG2 4.13Å; F16-I141 HydrophobicContact CZ-CD1 4.41Å; F16-I241 HydrophobicContact CB-CD1 4.17Å; F16-I241 HydrophobicContact CD2-CD1 3.78Å; F16-I241 HydrophobicContact CG-CD1 4.06Å; F16-F244 HydrophobicContact CB-CB 3.78Å; F16-F244 HydrophobicContact CB-CD2 4.33Å; F16-F244 HydrophobicContact CB-CG 3.99Å; F16-F244 AromaticContact CD1-CD1 3.87Å; F16-F244 HydrophobicContact CD1-CD1 3.87Å; F16-F244 AromaticContact CD1-CD2 3.99Å; F16-F244 HydrophobicContact CD1-CD2 3.99Å; F16-F244 HydrophobicContact CD1-CE1 4.01Å; F16-F244 HydrophobicContact CD1-CE2 4.14Å; F16-F244 AromaticContact CD1-CG 3.84Å; F16-F244 HydrophobicContact CD1-CG 3.84Å; F16-F244 HydrophobicContact CD1-CZ 4.15Å; F16-F244 HydrophobicContact CE1-CE1 4.45Å; F16-F244 HydrophobicContact CG-CG 4.37Å; F16-F244 WeakPolarHBondContact O-CB 3.42Å; F16-F244 VanDerWaalsContact O-CD2 3.24Å; F16-F244 WeakPolarHBondContact O-CD2 3.39Å
17S96.4Very high93.1Very high14 Ų1453.6 Ų53.610%0.09830%0.296CS..Hα-helixtrans-64.6-40.9170.8-63.50000112.3R14 I15 G20 I21 H240R14-S17 PolarHBondContact O-N 2.91Å; R14-S17 VanDerWaalsContact O-N 3.11Å; I15-S17 PolarHBondContact O-N 3.19Å; S17-G20 PolarHBondContact O-N 3.25Å; S17-I21 WeakPolarHBondContact O-CG1 3.27Å; S17-I21 PolarHBondContact O-N 2.88Å; S17-H240 WeakPolarHBondContact OG-CA 3.49Å; S17-H240 WeakPolarHBondContact OG-CB 3.26Å; S17-H240 PolarHBondContact OG-ND1 3.1Å
18G95.7Very high93.4Very high42 Ų4252 Ų5243%0.43329%0.287SS..Hα-helixtrans-59.6-45.8173.200000112.4R14 I15 F16 G20 I21 A22R14-G18 PolarHBondContact O-N 3.24Å; I15-G18 PolarHBondContact O-N 3.09Å; F16-G18 VanDerWaalsContact C-N 3.34Å; G18-G20 VanDerWaalsContact C-N 3.32Å; G18-G20 PolarHBondContact O-N 3.24Å; G18-I21 PolarHBondContact O-N 2.87Å; G18-A22 WeakPolarHBondContact O-CB 3.47Å; G18-A22 PolarHBondContact O-N 3.44Å
19L94.8Very high93.4Very high57 Ų5747.5 Ų47.530%0.29827%0.266SS..Hα-helixtrans-63.3-36.3175.4-68.2174.7000112.5I15 F16 A22 G23 M134 F244I15-L19 HydrophobicContact CG2-CD1 4.16Å; I15-L19 HydrophobicContact CG2-CG 4.39Å; I15-L19 WeakPolarHBondContact O-CG 3.3Å; I15-L19 PolarHBondContact O-N 3.34Å; F16-L19 HydrophobicContact CD1-CD1 4.09Å; F16-L19 HydrophobicContact CE1-CD1 4.05Å; F16-L19 PolarHBondContact O-N 3.39Å; L19-A22 PolarHBondContact O-N 2.9Å; L19-G23 PolarHBondContact O-N 3.1Å; L19-M134 HydrophobicContact CD1-CG 4.06Å; L19-M134 HydrophobicContact CD1-SD 4.29Å; L19-F244 HydrophobicContact CB-CD2 4.07Å; L19-F244 HydrophobicContact CB-CE2 3.91Å
20G94.8Very high93.4Very high2 Ų249 Ų492%0.02127%0.27CS..Hα-helixtrans-64.3-46.8175.900000111.8F16 S17 G18 G23 V24F16-G20 PolarHBondContact O-N 2.91Å; S17-G20 PolarHBondContact O-N 3.25Å; G18-G20 VanDerWaalsContact C-N 3.32Å; G18-G20 PolarHBondContact O-N 3.24Å; G20-G23 PolarHBondContact O-N 3.5Å; G20-V24 WeakPolarHBondContact O-CG2 3.19Å; G20-V24 PolarHBondContact O-N 3.46Å
21I95.2Very high93.4Very high89 Ų8953 Ų5346%0.45629%0.285SS..Hα-helixtrans-60.6-47.7174.8-65.7165.6000110.3S17 G18 G23 V24 L25 F243S17-I21 WeakPolarHBondContact O-CG1 3.27Å; S17-I21 PolarHBondContact O-N 2.88Å; G18-I21 PolarHBondContact O-N 2.87Å; I21-G23 VanDerWaalsContact C-N 3.31Å; I21-G23 PolarHBondContact O-N 3.44Å; I21-V24 PolarHBondContact O-N 2.99Å; I21-L25 HydrophobicContact CG2-CD1 4.02Å; I21-L25 HydrophobicContact CG2-CG 4.35Å; I21-L25 WeakPolarHBondContact O-CG 3.41Å; I21-L25 PolarHBondContact O-N 2.93Å; I21-F243 HydrophobicContact CG1-CE1 3.91Å; I21-F243 HydrophobicContact CG1-CZ 4.08Å
22A93.3Very high93.3Very high30 Ų3057.4 Ų57.425%0.24830%0.298CS..Hα-helixtrans-59-42.9177.800000111.9G18 L19 V24 L25 F26G18-A22 WeakPolarHBondContact O-CB 3.47Å; G18-A22 PolarHBondContact O-N 3.44Å; L19-A22 PolarHBondContact O-N 2.9Å; A22-V24 PolarHBondContact O-N 3.12Å; A22-L25 PolarHBondContact O-N 2.95Å; A22-F26 WeakPolarHBondContact O-CB 3.38Å; A22-F26 WeakPolarHBondContact O-CD1 3.34Å; A22-F26 WeakPolarHBondContact O-CG 3.36Å; A22-F26 PolarHBondContact O-N 3.49Å
23G91.6Very high93Very high11 Ų1162 Ų6211%0.11331%0.313CS..Hα-helixtrans-60.4-42175.500000113.1L19 G20 I21 F26 G27L19-G23 PolarHBondContact O-N 3.1Å; G20-G23 PolarHBondContact O-N 3.5Å; I21-G23 VanDerWaalsContact C-N 3.31Å; I21-G23 PolarHBondContact O-N 3.44Å; G23-F26 PolarHBondContact O-N 3.2Å; G23-G27 PolarHBondContact O-N 3.29Å
24V92.1Very high92.4Very high57 Ų5763 Ų6335%0.34532%0.324SS..Hα-helixtrans-65.7-45.6175.1173.10000111.2G20 I21 A22 F26 G27 I28 C247G20-V24 WeakPolarHBondContact O-CG2 3.19Å; G20-V24 PolarHBondContact O-N 3.46Å; I21-V24 PolarHBondContact O-N 2.99Å; A22-V24 PolarHBondContact O-N 3.12Å; V24-F26 VanDerWaalsContact C-N 3.29Å; V24-F26 PolarHBondContact O-N 3.34Å; V24-G27 WeakPolarHBondContact O-CA 3.42Å; V24-G27 PolarHBondContact O-N 2.94Å; V24-G27 VanDerWaalsContact O-N 3.07Å; V24-I28 HydrophobicContact CG1-CD1 3.9Å; V24-I28 HydrophobicContact CG1-CG1 4.43Å; V24-I28 WeakPolarHBondContact O-CG1 3.49Å; V24-I28 PolarHBondContact O-N 3.23Å; V24-C247 HydrophobicContact CG2-CB 3.8Å
25L93.3Very high91.7Very high104 Ų10458.6 Ų58.655%0.54532%0.317SS..Hα-helixtrans-60.3-41.1177.1-69.9174.5000111.8I21 A22 I28 C29I21-L25 HydrophobicContact CG2-CD1 4.02Å; I21-L25 HydrophobicContact CG2-CG 4.35Å; I21-L25 WeakPolarHBondContact O-CG 3.41Å; I21-L25 PolarHBondContact O-N 2.93Å; A22-L25 PolarHBondContact O-N 2.95Å; L25-I28 PolarHBondContact O-N 3.38Å; L25-C29 WeakPolarHBondContact O-CB 3.31Å; L25-C29 PolarHBondContact O-N 3.21Å
26F91.3Very high91.1Very high51 Ų5163.7 Ų63.722%0.22433%0.331CS..Hα-helixtrans-62.2-44.8172.6-71.7-3.8000110.9A22 G23 V24 I28 C29 Y30 F40 V41 F44 L45A22-F26 WeakPolarHBondContact O-CB 3.38Å; A22-F26 WeakPolarHBondContact O-CD1 3.34Å; A22-F26 WeakPolarHBondContact O-CG 3.36Å; A22-F26 PolarHBondContact O-N 3.49Å; G23-F26 PolarHBondContact O-N 3.2Å; V24-F26 VanDerWaalsContact C-N 3.29Å; V24-F26 PolarHBondContact O-N 3.34Å; F26-I28 VanDerWaalsContact C-N 3.33Å; F26-I28 PolarHBondContact O-N 3Å; F26-C29 WeakPolarHBondContact O-CB 3.37Å; F26-C29 PolarHBondContact O-N 2.91Å; F26-Y30 WeakPolarHBondContact O-CB 3.46Å; F26-Y30 PolarHBondContact O-N 2.99Å; F26-F40 HydrophobicContact CD1-CE2 4.46Å; F26-F40 AromaticContact CE1-CE2 3.7Å; F26-F40 HydrophobicContact CE1-CE2 3.7Å; F26-F40 HydrophobicContact CE1-CZ 4.49Å; F26-F40 HydrophobicContact CE2-CE2 4.37Å; F26-F40 HydrophobicContact CZ-CD2 4.22Å; F26-F40 AromaticContact CZ-CE2 3.65Å; F26-F40 HydrophobicContact CZ-CE2 3.65Å; F26-V41 HydrophobicContact CB-CG1 3.95Å; F26-V41 HydrophobicContact CD1-CG2 3.92Å; F26-V41 HydrophobicContact CE1-CG2 4.32Å; F26-V41 HydrophobicContact CG-CG1 4.36Å; F26-V41 HydrophobicContact CG-CG2 4.18Å; F26-V41 WeakPolarHBondContact O-CG1 3.3Å; F26-F44 HydrophobicContact CD2-CB 4.29Å; F26-F44 AromaticContact CD2-CD1 3.65Å; F26-F44 HydrophobicContact CD2-CD1 3.65Å; F26-F44 HydrophobicContact CD2-CE1 4.17Å; F26-F44 HydrophobicContact CD2-CG 4.01Å; F26-F44 HydrophobicContact CE2-CD1 4.19Å; F26-F44 HydrophobicContact CE2-CG 4.19Å; F26-L45 VanDerWaalsContact C-CD1 3.48Å; F26-L45 HydrophobicContact CB-CD1 3.94Å; F26-L45 HydrophobicContact CB-CD2 4.07Å; F26-L45 HydrophobicContact CB-CG 4.07Å; F26-L45 WeakPolarHBondContact O-CD1 3.47Å
27G89.4Confident90.6Very high8 Ų863.6 Ų63.68%0.08233%0.331CS..Hα-helixtrans-58.7-43176.600000112.5G23 V24 Y30 H31G23-G27 PolarHBondContact O-N 3.29Å; V24-G27 WeakPolarHBondContact O-CA 3.42Å; V24-G27 PolarHBondContact O-N 2.94Å; V24-G27 VanDerWaalsContact O-N 3.07Å; G27-Y30 PolarHBondContact O-N 2.93Å; G27-H31 PolarHBondContact O-N 3.34Å
28I90.8Very high90.1Very high81 Ų8165.5 Ų65.542%0.41534%0.344SS..Hα-helixtrans-64.2-45.6174.8-66.7167.3000110.8V24 L25 F26 Y30 H31 F32V24-I28 HydrophobicContact CG1-CD1 3.9Å; V24-I28 HydrophobicContact CG1-CG1 4.43Å; V24-I28 WeakPolarHBondContact O-CG1 3.49Å; V24-I28 PolarHBondContact O-N 3.23Å; L25-I28 PolarHBondContact O-N 3.38Å; F26-I28 VanDerWaalsContact C-N 3.33Å; F26-I28 PolarHBondContact O-N 3Å; I28-Y30 VanDerWaalsContact C-N 3.31Å; I28-Y30 PolarHBondContact O-N 3.12Å; I28-H31 WeakPolarHBondContact O-CB 3.35Å; I28-H31 PolarHBondContact O-N 3.14Å; I28-H31 VanDerWaalsContact O-N 3.14Å; I28-F32 HydrophobicContact CG2-CD2 3.72Å; I28-F32 HydrophobicContact CG2-CE2 3.52Å; I28-F32 VanDerWaalsContact O-CD2 3.25Å; I28-F32 WeakPolarHBondContact O-CD2 3.44Å; I28-F32 PolarHBondContact O-N 2.66Å; I28-F32 VanDerWaalsContact O-N 3.08Å
29C90.4Very high89.5Confident30 Ų3066.6 Ų66.620%0.20334%0.339CS..Hα-helixtrans-58.1-44.8175.1-178.30000111.2L25 F26 H31 F32 Y33L25-C29 WeakPolarHBondContact O-CB 3.31Å; L25-C29 PolarHBondContact O-N 3.21Å; F26-C29 WeakPolarHBondContact O-CB 3.37Å; F26-C29 PolarHBondContact O-N 2.91Å; C29-H31 VanDerWaalsContact C-N 3.33Å; C29-H31 PolarHBondContact O-N 3.13Å; C29-F32 PolarHBondContact O-N 2.99Å; C29-Y33 VanDerWaalsContact O-CD2 3.31Å; C29-Y33 WeakPolarHBondContact O-CD2 3.28Å; C29-Y33 PolarHBondContact O-N 2.91Å
30Y89.4Confident88.8Confident53 Ų5369.5 Ų69.521%0.20835%0.349CS..Hα-helixtrans-65.9-34.3176-172.7-100000112.6F26 G27 I28 G34 S37 Q42 L45 L46 W254 L255F26-Y30 WeakPolarHBondContact O-CB 3.46Å; F26-Y30 PolarHBondContact O-N 2.99Å; G27-Y30 PolarHBondContact O-N 2.93Å; I28-Y30 VanDerWaalsContact C-N 3.31Å; I28-Y30 PolarHBondContact O-N 3.12Å; Y30-G34 WeakPolarHBondContact CD2-O 3.18Å; Y30-G34 WeakPolarHBondContact CE2-O 3.33Å; Y30-G34 WeakPolarHBondContact O-CA 3.5Å; Y30-G34 PolarHBondContact O-N 3.31Å; Y30-S37 WeakPolarHBondContact CD2-OG 3.31Å; Y30-Q42 HydrophobicContact CD2-CG 4.33Å; Y30-Q42 HydrophobicContact CE2-CG 4.28Å; Y30-L45 HydrophobicContact CG-CD1 4.33Å; Y30-L46 HydrophobicContact CE1-CD2 4.06Å; Y30-L46 HydrophobicContact CE2-CD1 3.74Å; Y30-L46 HydrophobicContact CE2-CD2 4.22Å; Y30-L46 HydrophobicContact CE2-CG 4.3Å; Y30-W254 AromaticContact CD1-CH2 3.81Å; Y30-W254 HydrophobicContact CD1-CH2 3.81Å; Y30-W254 AromaticContact CD1-CZ3 3.83Å; Y30-W254 HydrophobicContact CD1-CZ3 3.83Å; Y30-W254 HydrophobicContact CE1-CH2 4.44Å; Y30-L255 HydrophobicContact CD1-CD2 4Å; Y30-L255 HydrophobicContact CE1-CD2 3.99Å
31H88.7Confident88.2Confident117 Ų11769.5 Ų69.554%0.54235%0.349SS..Hα-helixtrans-62-45174.5177.456.4000112.3G27 I28 C29 W254G27-H31 PolarHBondContact O-N 3.34Å; I28-H31 WeakPolarHBondContact O-CB 3.35Å; I28-H31 PolarHBondContact O-N 3.14Å; I28-H31 VanDerWaalsContact O-N 3.14Å; C29-H31 VanDerWaalsContact C-N 3.33Å; C29-H31 PolarHBondContact O-N 3.13Å; H31-W254 HydrophobicContact CB-CH2 3.82Å; H31-W254 HydrophobicContact CB-CZ2 3.75Å; H31-W254 AromaticContact CG-CZ2 3.92Å; H31-W254 AromaticContact ND1-CZ2 3.5Å; H31-W254 WeakPolarHBondContact ND1-CZ2 3.49Å
32F90.6Very high87.5Confident154 Ų15465.4 Ų65.468%0.67533%0.328SS*.Hα-helixtrans-76.4-41.7-178.5-74.7-64.8000113.7I28 C29I28-F32 HydrophobicContact CG2-CD2 3.72Å; I28-F32 HydrophobicContact CG2-CE2 3.52Å; I28-F32 VanDerWaalsContact O-CD2 3.25Å; I28-F32 WeakPolarHBondContact O-CD2 3.44Å; I28-F32 PolarHBondContact O-N 2.66Å; I28-F32 VanDerWaalsContact O-N 3.08Å; C29-F32 PolarHBondContact O-N 2.99Å
33Y89Confident86.7Confident145 Ų14564.7 Ų64.757%0.56932%0.32SS*.Hα-helixtrans-100.5-17.1-173.2-63.7-76.8000113.5C29 S35 Y36C29-Y33 VanDerWaalsContact O-CD2 3.31Å; C29-Y33 WeakPolarHBondContact O-CD2 3.28Å; C29-Y33 PolarHBondContact O-N 2.91Å; Y33-S35 PolarHBondContact O-N 3.14Å; Y33-Y36 WeakPolarHBondContact O-CA 3.27Å; Y33-Y36 VanDerWaalsContact O-CB 3.31Å; Y33-Y36 WeakPolarHBondContact O-CB 3.43Å; Y33-Y36 PolarHBondContact O-N 3.09Å
34G84.3Confident86.2Confident22 Ų2265.9 Ų65.923%0.22732%0.322CS..G310 helixtrans52.6-121.8-17800000112.1Y30 Y36 S37Y30-G34 WeakPolarHBondContact CD2-O 3.18Å; Y30-G34 WeakPolarHBondContact CE2-O 3.33Å; Y30-G34 WeakPolarHBondContact O-CA 3.5Å; Y30-G34 PolarHBondContact O-N 3.31Å; G34-Y36 PolarHBondContact O-N 3.07Å; G34-S37 WeakPolarHBondContact O-CB 3.34Å; G34-S37 PolarHBondContact O-N 3.28Å; G34-S37 VanDerWaalsContact O-N 3.16Å; G34-S37 PolarHBondContact O-OG 3.01Å
35S81.1Confident85.5Confident63 Ų6363.5 Ų63.544%0.44131%0.307SS..G310 helixtrans-65.7-15.7175.650.80000114.6Y33 Q42 Q53Y33-S35 PolarHBondContact O-N 3.14Å; S35-Q42 PolarHBondContact O-NE2 2.96Å; S35-Q53 PolarHBondContact O-NE2 3.08Å; S35-Q53 PolarHBondContact O-OE1 2.87Å
36Y85Confident84.6Confident201 Ų20159 Ų5979%0.78828%0.283SS*.G310 helixtrans-89.3-1.5175.4-59.3-81.6000113.1Y33 G34Y33-Y36 WeakPolarHBondContact O-CA 3.27Å; Y33-Y36 VanDerWaalsContact O-CB 3.31Å; Y33-Y36 WeakPolarHBondContact O-CB 3.43Å; Y33-Y36 PolarHBondContact O-N 3.09Å; G34-Y36 PolarHBondContact O-N 3.07Å
37S85.7Confident83.7Confident4 Ų458.6 Ų58.63%0.02828%0.282CS..SBendtrans-63.2151.117458.70000110.8Y30 G34 L39 Q42Y30-S37 WeakPolarHBondContact CD2-OG 3.31Å; G34-S37 WeakPolarHBondContact O-CB 3.34Å; G34-S37 PolarHBondContact O-N 3.28Å; G34-S37 VanDerWaalsContact O-N 3.16Å; G34-S37 PolarHBondContact O-OG 3.01Å; S37-L39 PolarHBondContact O-N 3.39Å; S37-Q42 PolarHBondContact O-NE2 3.07Å; S37-Q42 WeakPolarHBondContact OG-CG 3.29Å; S37-Q42 PolarHBondContact OG-NE2 3.34Å
38P85.9Confident82.5Confident55 Ų5558.7 Ų58.736%0.35728%0.283SS..  trans-52.6139.6179.2-26.234.1000112.2F40 V41 Q42P38-F40 HydrophobicContact CB-CD1 3.54Å; P38-F40 HydrophobicContact CB-CE1 3.26Å; P38-F40 HydrophobicContact CB-CZ 4.05Å; P38-F40 HydrophobicContact CG-CE1 3.97Å; P38-F40 HydrophobicContact CG-CZ 4.43Å; P38-F40 PolarHBondContact O-N 3.1Å; P38-F40 VanDerWaalsContact O-N 3.12Å; P38-V41 HydrophobicContact CB-CG2 4.14Å; P38-V41 HydrophobicContact CG-CG2 4.28Å; P38-V41 WeakPolarHBondContact O-CA 3.47Å; P38-V41 VanDerWaalsContact O-CB 3.28Å; P38-V41 WeakPolarHBondContact O-CB 3.36Å; P38-V41 PolarHBondContact O-N 2.95Å; P38-Q42 PolarHBondContact O-N 3.02Å
39L81.8Confident81.2Confident64 Ų6456.9 Ų56.934%0.33527%0.272SS..Hα-helixtrans-55.1-37.6-175.1-72.1170.8000112.8S37 V41 Q42 H43 Q53 C55 L58S37-L39 PolarHBondContact O-N 3.39Å; L39-V41 VanDerWaalsContact C-N 3.3Å; L39-V41 PolarHBondContact O-N 3.01Å; L39-Q42 PolarHBondContact O-N 3.26Å; L39-H43 PolarHBondContact O-N 3.16Å; L39-H43 PolarHBondContact O-ND1 2.67Å; L39-Q53 HydrophobicContact CD2-CB 3.63Å; L39-C55 HydrophobicContact CD1-CB 4.24Å; L39-L58 HydrophobicContact CB-CD1 4.19Å
40F81.1Confident80.1Confident118 Ų11857 Ų5752%0.51827%0.274SS..Hα-helixtrans-63.3-34.8177.475.9-93.5000112.6F26 P38 F44F26-F40 HydrophobicContact CD1-CE2 4.46Å; F26-F40 AromaticContact CE1-CE2 3.7Å; F26-F40 HydrophobicContact CE1-CE2 3.7Å; F26-F40 HydrophobicContact CE1-CZ 4.49Å; F26-F40 HydrophobicContact CE2-CE2 4.37Å; F26-F40 HydrophobicContact CZ-CD2 4.22Å; F26-F40 AromaticContact CZ-CE2 3.65Å; F26-F40 HydrophobicContact CZ-CE2 3.65Å; P38-F40 HydrophobicContact CB-CD1 3.54Å; P38-F40 HydrophobicContact CB-CE1 3.26Å; P38-F40 HydrophobicContact CB-CZ 4.05Å; P38-F40 HydrophobicContact CG-CE1 3.97Å; P38-F40 HydrophobicContact CG-CZ 4.43Å; P38-F40 PolarHBondContact O-N 3.1Å; P38-F40 VanDerWaalsContact O-N 3.12Å; F40-F44 VanDerWaalsContact O-CB 3.31Å; F40-F44 WeakPolarHBondContact O-CB 3.44Å; F40-F44 PolarHBondContact O-N 3.22Å
41V82.2Confident79Confident2 Ų259.5 Ų59.51%0.01229%0.29CS..Hα-helixtrans-64.6-46.7174.8171.70000109.7F26 P38 L39 F44 L45F26-V41 HydrophobicContact CB-CG1 3.95Å; F26-V41 HydrophobicContact CD1-CG2 3.92Å; F26-V41 HydrophobicContact CE1-CG2 4.32Å; F26-V41 HydrophobicContact CG-CG1 4.36Å; F26-V41 HydrophobicContact CG-CG2 4.18Å; F26-V41 WeakPolarHBondContact O-CG1 3.3Å; P38-V41 HydrophobicContact CB-CG2 4.14Å; P38-V41 HydrophobicContact CG-CG2 4.28Å; P38-V41 WeakPolarHBondContact O-CA 3.47Å; P38-V41 VanDerWaalsContact O-CB 3.28Å; P38-V41 WeakPolarHBondContact O-CB 3.36Å; P38-V41 PolarHBondContact O-N 2.95Å; L39-V41 VanDerWaalsContact C-N 3.3Å; L39-V41 PolarHBondContact O-N 3.01Å; V41-F44 PolarHBondContact O-N 3.04Å; V41-L45 HydrophobicContact CG1-CD1 3.78Å; V41-L45 HydrophobicContact CG1-CG 4.47Å; V41-L45 WeakPolarHBondContact O-CG 3.35Å; V41-L45 PolarHBondContact O-N 3.42Å
42Q80.2Confident78Confident4 Ų454.4 Ų54.42%0.01927%0.268CS..Hα-helixtrans-62.2-45.9177.7-61-174.535.700111.8Y30 S35 S37 P38 L39 F44 L45 L46 P52 Q53Y30-Q42 HydrophobicContact CD2-CG 4.33Å; Y30-Q42 HydrophobicContact CE2-CG 4.28Å; S35-Q42 PolarHBondContact O-NE2 2.96Å; S37-Q42 PolarHBondContact O-NE2 3.07Å; S37-Q42 WeakPolarHBondContact OG-CG 3.29Å; S37-Q42 PolarHBondContact OG-NE2 3.34Å; P38-Q42 PolarHBondContact O-N 3.02Å; L39-Q42 PolarHBondContact O-N 3.26Å; Q42-F44 VanDerWaalsContact C-N 3.28Å; Q42-F44 PolarHBondContact O-N 3.45Å; Q42-L45 PolarHBondContact O-N 3.09Å; Q42-L46 HydrophobicContact CB-CD1 4.08Å; Q42-L46 HydrophobicContact CG-CD1 4.45Å; Q42-L46 WeakPolarHBondContact O-CA 3.5Å; Q42-L46 WeakPolarHBondContact O-CB 3.41Å; Q42-L46 WeakPolarHBondContact O-CG 3.25Å; Q42-L46 PolarHBondContact O-N 2.87Å; Q42-P52 HydrophobicContact CB-CB 3.74Å; Q42-Q53 VanDerWaalsContact OE1-N 3.11Å
43H77.6Confident76.9Confident14 Ų1451.6 Ų51.67%0.06526%0.257CS..Hα-helixtrans-69.9-25.9-179.6-74.377.6000113.1L39 Q53 L58 S128L39-H43 PolarHBondContact O-N 3.16Å; L39-H43 PolarHBondContact O-ND1 2.67Å; H43-Q53 PolarHBondContact CE1-O 3.04Å; H43-L58 HydrophobicContact CB-CD1 4.38Å; H43-L58 WeakPolarHBondContact CD2-CB 3.29Å; H43-L58 WeakPolarHBondContact ND1-CD1 3.45Å; H43-L58 WeakPolarHBondContact NE2-CB 3.39Å; H43-S128 VanDerWaalsContact O-CB 3.3Å; H43-S128 WeakPolarHBondContact O-CB 3.14Å; H43-S128 PolarHBondContact O-OG 3.49Å
44F79.4Confident75.7Confident36 Ų3649.6 Ų49.616%0.15826%0.262CS..Hα-helixtrans-70.8-62.8168.8-168.3-94.1000109.2F26 F40 V41 Q42 H131 M134F26-F44 HydrophobicContact CD2-CB 4.29Å; F26-F44 AromaticContact CD2-CD1 3.65Å; F26-F44 HydrophobicContact CD2-CD1 3.65Å; F26-F44 HydrophobicContact CD2-CE1 4.17Å; F26-F44 HydrophobicContact CD2-CG 4.01Å; F26-F44 HydrophobicContact CE2-CD1 4.19Å; F26-F44 HydrophobicContact CE2-CG 4.19Å; F40-F44 VanDerWaalsContact O-CB 3.31Å; F40-F44 WeakPolarHBondContact O-CB 3.44Å; F40-F44 PolarHBondContact O-N 3.22Å; V41-F44 PolarHBondContact O-N 3.04Å; Q42-F44 VanDerWaalsContact C-N 3.28Å; Q42-F44 PolarHBondContact O-N 3.45Å; F44-H131 VanDerWaalsContact C-CE1 3.43Å; F44-H131 AromaticContact CD1-CE1 3.6Å; F44-H131 AromaticContact CD2-CE1 3.65Å; F44-H131 AromaticContact CD2-ND1 3.84Å; F44-H131 AromaticContact CE1-CE1 3.68Å; F44-H131 AromaticContact CE2-CE1 3.72Å; F44-H131 AromaticContact CE2-ND1 3.96Å; F44-H131 AromaticContact CG-CE1 3.59Å; F44-H131 AromaticContact CZ-CE1 3.73Å; F44-H131 PolarHBondContact O-CE1 2.67Å; F44-H131 PolarHBondContact O-ND1 3.04Å; F44-H131 PolarHBondContact O-NE2 3.32Å; F44-M134 HydrophobicContact CE2-SD 4.47Å; F44-M134 HydrophobicContact CZ-CE 4.11Å; F44-M134 HydrophobicContact CZ-SD 3.94Å
45L78.1Confident74.9Confident8 Ų850 Ų504%0.04226%0.262CS..Hα-helixtrans-73.5-38.2-168.9-65174.2000115.4F26 Y30 V41 Q42 F47 L255F26-L45 VanDerWaalsContact C-CD1 3.48Å; F26-L45 HydrophobicContact CB-CD1 3.94Å; F26-L45 HydrophobicContact CB-CD2 4.07Å; F26-L45 HydrophobicContact CB-CG 4.07Å; F26-L45 WeakPolarHBondContact O-CD1 3.47Å; Y30-L45 HydrophobicContact CG-CD1 4.33Å; V41-L45 HydrophobicContact CG1-CD1 3.78Å; V41-L45 HydrophobicContact CG1-CG 4.47Å; V41-L45 WeakPolarHBondContact O-CG 3.35Å; V41-L45 PolarHBondContact O-N 3.42Å; Q42-L45 PolarHBondContact O-N 3.09Å; L45-F47 WeakPolarHBondContact O-CD1 3.36Å; L45-L255 HydrophobicContact CB-CD1 4.29Å
46L75.3Confident74.2Confident8 Ų854.1 Ų54.14%0.04227%0.274CS..  trans-91.2114.1-168.1-55.6179.4000110.7Y30 Q42 L255Y30-L46 HydrophobicContact CE1-CD2 4.06Å; Y30-L46 HydrophobicContact CE2-CD1 3.74Å; Y30-L46 HydrophobicContact CE2-CD2 4.22Å; Y30-L46 HydrophobicContact CE2-CG 4.3Å; Q42-L46 HydrophobicContact CB-CD1 4.08Å; Q42-L46 HydrophobicContact CG-CD1 4.45Å; Q42-L46 WeakPolarHBondContact O-CA 3.5Å; Q42-L46 WeakPolarHBondContact O-CB 3.41Å; Q42-L46 WeakPolarHBondContact O-CG 3.25Å; Q42-L46 PolarHBondContact O-N 2.87Å; L46-L255 HydrophobicContact CD2-CD2 3.93Å
47F71.1Confident73.5Confident43 Ų4353.6 Ų53.619%0.18927%0.272CS..  trans-145.1163.717158.3-89.4000111.1L45 K49 M127 H131L45-F47 WeakPolarHBondContact O-CD1 3.36Å; F47-K49 PolarHBondContact O-N 3.49Å; F47-M127 HydrophobicContact CB-CB 4.38Å; F47-H131 AromaticContact CE1-CD2 3.94Å; F47-H131 AromaticContact CE1-NE2 3.88Å
48G65.4Low72.7Confident11 Ų1155.7 Ų55.711%0.11328%0.283CS..THydrogen-bonded Turntrans78.6-101.5178.900000113.1
49K62.9Low72Confident43 Ų4356.6 Ų56.619%0.18728%0.282CS..THydrogen-bonded Turntrans-88.6-22.3-172.9-51.7-169-173.61700113.9F47 Y201 W259 Y260F47-K49 PolarHBondContact O-N 3.49Å; K49-Y201 HydrophobicContact CB-CE1 4.36Å; K49-Y201 HydrophobicContact CD-CD1 3.9Å; K49-Y201 HydrophobicContact CD-CE1 3.69Å; K49-Y201 HydrophobicContact CG-CD1 4.31Å; K49-Y201 HydrophobicContact CG-CE1 3.58Å; K49-W259 HydrophobicContact CB-CD2 4.05Å; K49-W259 HydrophobicContact CB-CG 4.34Å; K49-W259 HydrophobicContact CB-CZ2 4.06Å; K49-W259 HydrophobicContact CD-CD2 3.78Å; K49-W259 HydrophobicContact CD-CE3 3.6Å; K49-W259 HydrophobicContact CD-CH2 3.72Å; K49-W259 HydrophobicContact CD-CZ2 3.82Å; K49-W259 HydrophobicContact CD-CZ3 3.59Å; K49-W259 PolarHBondContact O-NE1 3.37Å; K49-Y260 PolarHBondContact NZ-OH 3.24Å
50S67Low71.5Confident33 Ų3363.2 Ų63.223%0.23130%0.304CS..SBendtrans-107.8125.9175.6-58.20000107.8
51N66.6Low71.4Confident104 Ų10461.6 Ų61.656%0.55630%0.3SS*.PPolyproline II helixtrans-101.3140.4174.5-75.4-42.6000109.5R62N51-R62 PolarHBondContact OD1-NH2 3.4Å
52P68.2Low71.4Confident11 Ų1162.8 Ų62.87%0.07131%0.305CS..PPolyproline II helixtrans-64.5164.4169.330.9-35.6000110.8Q42 C54Q42-P52 HydrophobicContact CB-CB 3.74Å; P52-C54 PolarHBondContact O-N 3.36Å
53Q67.4Low71.7Confident95 Ų9563.2 Ų63.244%0.44431%0.307SS..PPolyproline II helixtrans-56136.8165.8-76.5178.2-14.500110.4S35 L39 Q42 H43 C55S35-Q53 PolarHBondContact O-NE2 3.08Å; S35-Q53 PolarHBondContact O-OE1 2.87Å; L39-Q53 HydrophobicContact CD2-CB 3.63Å; Q42-Q53 VanDerWaalsContact OE1-N 3.11Å; H43-Q53 PolarHBondContact CE1-O 3.04Å; Q53-C55 PolarHBondContact O-N 3.24Å
54C63Low72.2Confident102 Ų10264.4 Ų64.469%0.68932%0.316SS*.PPolyproline II helixtrans-63128.7-176.4-170.20000110.7P52P52-C54 PolarHBondContact O-N 3.36Å
55C67.2Low72.4Confident31 Ų3164.8 Ų64.821%0.20932%0.318CS..  trans-143.5113.4172.3-179.90000108.1L39 Q53 Y57 L58 E59L39-C55 HydrophobicContact CD1-CB 4.24Å; Q53-C55 PolarHBondContact O-N 3.24Å; C55-Y57 VanDerWaalsContact C-N 3.33Å; C55-Y57 PolarHBondContact O-N 3.41Å; C55-L58 HydrophobicContact CB-CB 4.27Å; C55-L58 HydrophobicContact CB-CD1 4.24Å; C55-L58 HydrophobicContact CB-CG 4.4Å; C55-L58 PolarHBondContact O-N 3.2Å; C55-E59 WeakPolarHBondContact O-CG 3.48Å; C55-E59 PolarHBondContact O-N 3.17Å
56E67.6Low72.8Confident150 Ų15071.8 Ų71.870%0.70134%0.344SS*.Hα-helixtrans-52.6-46.9-171.1-69.2-176.6167.900113L58 E59 Y60E56-L58 VanDerWaalsContact C-N 3.31Å; E56-L58 PolarHBondContact O-N 2.75Å; E56-E59 PolarHBondContact O-N 3.3Å; E56-Y60 WeakPolarHBondContact O-CD2 3.49Å; E56-Y60 PolarHBondContact O-N 3.02Å
57Y69.3Low73.6Confident190 Ų19075.3 Ų75.375%0.74536%0.356SS*.Hα-helixtrans-60.9-37.7179.6-64.3-75.5000113.4C55C55-Y57 VanDerWaalsContact C-N 3.33Å; C55-Y57 PolarHBondContact O-N 3.41Å
58L69.7Low74.4Confident48 Ų4875.3 Ų75.325%0.25136%0.356SS..Hα-helixtrans-84-24.6-178.5-63.4177.6000112.2L39 H43 C55 E56 Y60 L61L39-L58 HydrophobicContact CB-CD1 4.19Å; H43-L58 HydrophobicContact CB-CD1 4.38Å; H43-L58 WeakPolarHBondContact CD2-CB 3.29Å; H43-L58 WeakPolarHBondContact ND1-CD1 3.45Å; H43-L58 WeakPolarHBondContact NE2-CB 3.39Å; C55-L58 HydrophobicContact CB-CB 4.27Å; C55-L58 HydrophobicContact CB-CD1 4.24Å; C55-L58 HydrophobicContact CB-CG 4.4Å; C55-L58 PolarHBondContact O-N 3.2Å; E56-L58 VanDerWaalsContact C-N 3.31Å; E56-L58 PolarHBondContact O-N 2.75Å; L58-Y60 VanDerWaalsContact C-N 3.34Å; L58-L61 HydrophobicContact CD2-CD1 4.21Å; L58-L61 CarbonylContact O-C 3.55Å; L58-L61 WeakPolarHBondContact O-CA 3.46Å; L58-L61 WeakPolarHBondContact O-CB 3.29Å; L58-L61 PolarHBondContact O-N 3.11Å; L58-L61 VanDerWaalsContact O-N 3.1Å
59E70.5Confident75.7Confident73 Ų7377.7 Ų77.734%0.34136%0.364SS..Hα-helixtrans-63-38.8171.3-74.4-101.812200111.5C55 E56 L61 R62C55-E59 WeakPolarHBondContact O-CG 3.48Å; C55-E59 PolarHBondContact O-N 3.17Å; E56-E59 PolarHBondContact O-N 3.3Å; E59-L61 PolarHBondContact O-N 3.23Å; E59-R62 WeakPolarHBondContact O-CB 3.38Å; E59-R62 PolarHBondContact O-N 3.05Å; E59-R62 IonicContact OE1-CZ 3.71Å; E59-R62 IonicContact OE1-NH1 3.29Å; E59-R62 PolarHBondContact OE1-NH1 3Å
60Y72Confident77.2Confident204 Ų20480.1 Ų80.180%0.837%0.372SS*.THydrogen-bonded Turntrans-60.8-25.2172-76.6-70.8000113.2E56 L58 R62E56-Y60 WeakPolarHBondContact O-CD2 3.49Å; E56-Y60 PolarHBondContact O-N 3.02Å; L58-Y60 VanDerWaalsContact C-N 3.34Å; Y60-R62 VanDerWaalsContact C-N 3.27Å; Y60-R62 PolarHBondContact O-N 3.24Å
61L79.4Confident78.6Confident84 Ų8479 Ų7944%0.4436%0.363SS..THydrogen-bonded Turntrans-89.717.1175.8-60.1177.3000112.3L58 E59 S128 F129L58-L61 HydrophobicContact CD2-CD1 4.21Å; L58-L61 CarbonylContact O-C 3.55Å; L58-L61 WeakPolarHBondContact O-CA 3.46Å; L58-L61 WeakPolarHBondContact O-CB 3.29Å; L58-L61 PolarHBondContact O-N 3.11Å; L58-L61 VanDerWaalsContact O-N 3.1Å; E59-L61 PolarHBondContact O-N 3.23Å; L61-S128 CarbonylContact O-C 3.56Å; L61-F129 HydrophobicContact CB-CB 4.47Å; L61-F129 VanDerWaalsContact O-CB 3.23Å; L61-F129 WeakPolarHBondContact O-CB 3.48Å; L61-F129 PolarHBondContact O-N 3.02Å
62R82.2Confident80Confident27 Ų2775.3 Ų75.310%0.10234%0.342CS..EExtended strand (participates in β ladder)trans-100.5131.1174.6-61-177.979.4-1760.9110.8N51 E59 Y60 Q126 M127N51-R62 PolarHBondContact OD1-NH2 3.4Å; E59-R62 WeakPolarHBondContact O-CB 3.38Å; E59-R62 PolarHBondContact O-N 3.05Å; E59-R62 IonicContact OE1-CZ 3.71Å; E59-R62 IonicContact OE1-NH1 3.29Å; E59-R62 PolarHBondContact OE1-NH1 3Å; Y60-R62 VanDerWaalsContact C-N 3.27Å; Y60-R62 PolarHBondContact O-N 3.24Å; R62-Q126 HydrophobicContact CB-CB 3.91Å; R62-Q126 HydrophobicContact CB-CG 4.46Å; R62-M127 CarbonylContact C-O 3.59Å; R62-M127 VanDerWaalsContact CA-O 3.29Å; R62-M127 WeakPolarHBondContact CA-O 3.32Å
63V86.8Confident81.4Confident13 Ų1378.4 Ų78.48%0.07936%0.357CS..EExtended strand (participates in β ladder)trans-110.4150.5176.2-61.50000111.4K65 W67 Q126 M127 F129 F132V63-K65 PolarHBondContact O-N 3.39Å; V63-W67 HydrophobicContact CB-CD2 4.17Å; V63-W67 HydrophobicContact CB-CE3 3.67Å; V63-W67 HydrophobicContact CB-CZ3 4Å; V63-W67 HydrophobicContact CG1-CE3 3.85Å; V63-W67 HydrophobicContact CG1-CH2 4.41Å; V63-W67 HydrophobicContact CG1-CZ3 3.67Å; V63-W67 HydrophobicContact CG2-CE3 4.09Å; V63-Q126 CarbonylContact O-C 3.54Å; V63-Q126 VanDerWaalsContact O-CA 3.29Å; V63-Q126 WeakPolarHBondContact O-CA 3.34Å; V63-Q126 WeakPolarHBondContact O-CB 3.35Å; V63-M127 HydrophobicContact CG2-CG 3.62Å; V63-M127 HydrophobicContact CG2-SD 4.37Å; V63-M127 PolarHBondContact N-O 3.32Å; V63-M127 PolarHBondContact O-N 2.99Å; V63-F129 HydrophobicContact CG1-CB 4.44Å; V63-F129 HydrophobicContact CG1-CD2 3.89Å; V63-F132 HydrophobicContact CG2-CB 3.76Å; V63-F132 HydrophobicContact CG2-CD2 4.23Å; V63-F132 HydrophobicContact CG2-CG 4.14Å
64P87.1Confident82.9Confident38 Ų3875.8 Ų75.825%0.24735%0.348CS..EExtended strand (participates in β ladder)trans-57.7137.3-180-28.237.5000113.1R66 W67P64-R66 HydrophobicContact CB-CG 3.59Å; P64-R66 PolarHBondContact O-N 3.43Å; P64-R66 VanDerWaalsContact O-N 3.09Å; P64-W67 VanDerWaalsContact O-CB 3.25Å; P64-W67 WeakPolarHBondContact O-CB 3.44Å; P64-W67 PolarHBondContact O-N 3.05Å
65K84Confident84.5Confident44 Ų4471 Ų7119%0.19132%0.315CS..G310 helixtrans-57.7-29.2178.4-169.4177-177.4-175.20113V63 W67 F68 F122 S125 M127V63-K65 PolarHBondContact O-N 3.39Å; K65-W67 PolarHBondContact O-N 3.23Å; K65-F68 HydrophobicContact CD-CD2 4.42Å; K65-F68 HydrophobicContact CD-CE2 4.14Å; K65-F68 VanDerWaalsContact CE-CE2 3.49Å; K65-F68 HydrophobicContact CG-CD2 3.53Å; K65-F68 HydrophobicContact CG-CE2 3.52Å; K65-F68 WeakPolarHBondContact O-CB 3.41Å; K65-F68 WeakPolarHBondContact O-CD2 3.26Å; K65-F68 PolarHBondContact O-N 2.91Å; K65-F122 HydrophobicContact CB-CD1 4.25Å; K65-F122 HydrophobicContact CD-CD1 4.27Å; K65-F122 HydrophobicContact CG-CD1 3.95Å; K65-F122 HydrophobicContact CG-CE1 4.1Å; K65-S125 WeakPolarHBondContact CB-O 3.28Å; K65-S125 WeakPolarHBondContact CB-OG 3.31Å; K65-S125 VanDerWaalsContact CD-OG 3.23Å; K65-S125 WeakPolarHBondContact CD-OG 3.49Å; K65-S125 PolarHBondContact N-O 3.48Å; K65-M127 HydrophobicContact CG-CE 4.31Å
66R87.4Confident86Confident156 Ų15670.8 Ų70.859%0.58931%0.313SS*.G310 helixtrans-55.5-18.3172.965-178.1-178.9177.8-2.3113.7P64 F68 K69 F122P64-R66 HydrophobicContact CB-CG 3.59Å; P64-R66 PolarHBondContact O-N 3.43Å; P64-R66 VanDerWaalsContact O-N 3.09Å; R66-F68 PolarHBondContact O-N 2.87Å; R66-K69 WeakPolarHBondContact O-CG 3.3Å; R66-K69 PolarHBondContact O-N 3.46Å; R66-F122 HydrophobicContact CB-CB 4.38Å; R66-F122 HydrophobicContact CB-CD2 4.19Å; R66-F122 HydrophobicContact CB-CG 4.2Å
67W90.7Very high87.4Confident82 Ų8270.4 Ų70.431%0.31131%0.309SS..G310 helixtrans-72.6-4.1175.2-72.513.7000113.7V63 P64 K65 K69 Y70 F132V63-W67 HydrophobicContact CB-CD2 4.17Å; V63-W67 HydrophobicContact CB-CE3 3.67Å; V63-W67 HydrophobicContact CB-CZ3 4Å; V63-W67 HydrophobicContact CG1-CE3 3.85Å; V63-W67 HydrophobicContact CG1-CH2 4.41Å; V63-W67 HydrophobicContact CG1-CZ3 3.67Å; V63-W67 HydrophobicContact CG2-CE3 4.09Å; P64-W67 VanDerWaalsContact O-CB 3.25Å; P64-W67 WeakPolarHBondContact O-CB 3.44Å; P64-W67 PolarHBondContact O-N 3.05Å; K65-W67 PolarHBondContact O-N 3.23Å; W67-K69 PolarHBondContact O-N 3.4Å; W67-K69 VanDerWaalsContact O-N 3.13Å; W67-Y70 HydrophobicContact CB-CD2 3.8Å; W67-Y70 HydrophobicContact CB-CE2 4.19Å; W67-Y70 AromaticContact CD1-CE2 3.7Å; W67-Y70 HydrophobicContact CD2-CD2 4.35Å; W67-Y70 HydrophobicContact CD2-CE2 4.15Å; W67-Y70 AromaticContact CG-CD2 3.9Å; W67-Y70 HydrophobicContact CG-CD2 3.9Å; W67-Y70 AromaticContact CG-CE2 3.8Å; W67-Y70 HydrophobicContact CG-CE2 3.8Å; W67-Y70 WeakPolarHBondContact O-CB 3.16Å; W67-Y70 WeakPolarHBondContact O-CD2 3.29Å; W67-Y70 PolarHBondContact O-N 2.97Å; W67-F132 HydrophobicContact CB-CD2 4.04Å; W67-F132 HydrophobicContact CB-CE2 3.91Å; W67-F132 HydrophobicContact CD2-CE2 4.45Å; W67-F132 AromaticContact CE3-CD2 3.99Å; W67-F132 HydrophobicContact CE3-CD2 3.99Å; W67-F132 HydrophobicContact CE3-CE1 4.49Å; W67-F132 AromaticContact CE3-CE2 3.78Å; W67-F132 HydrophobicContact CE3-CE2 3.78Å; W67-F132 HydrophobicContact CE3-CG 4.49Å; W67-F132 HydrophobicContact CE3-CZ 4.04Å
68F87.9Confident88.8Confident43 Ų4361.7 Ų61.719%0.18928%0.276CS..Hα-helixtrans-51.2-31.6166.5-91.4-59.4000112.7K65 R66 Y70 F71 Y72 F122 M127K65-F68 HydrophobicContact CD-CD2 4.42Å; K65-F68 HydrophobicContact CD-CE2 4.14Å; K65-F68 VanDerWaalsContact CE-CE2 3.49Å; K65-F68 HydrophobicContact CG-CD2 3.53Å; K65-F68 HydrophobicContact CG-CE2 3.52Å; K65-F68 WeakPolarHBondContact O-CB 3.41Å; K65-F68 WeakPolarHBondContact O-CD2 3.26Å; K65-F68 PolarHBondContact O-N 2.91Å; R66-F68 PolarHBondContact O-N 2.87Å; F68-Y70 PolarHBondContact O-N 3.26Å; F68-F71 AromaticContact CD1-CD2 3.37Å; F68-F71 HydrophobicContact CD1-CD2 3.37Å; F68-F71 AromaticContact CD1-CE2 3.25Å; F68-F71 HydrophobicContact CD1-CE2 3.25Å; F68-F71 HydrophobicContact CD1-CG 4.36Å; F68-F71 HydrophobicContact CD1-CZ 4.14Å; F68-F71 AromaticContact CE1-CD2 3.79Å; F68-F71 HydrophobicContact CE1-CD2 3.79Å; F68-F71 AromaticContact CE1-CE2 3.3Å; F68-F71 HydrophobicContact CE1-CE2 3.3Å; F68-F71 HydrophobicContact CE1-CZ 4.26Å; F68-F71 HydrophobicContact CG-CD2 4.49Å; F68-F71 HydrophobicContact CG-CE2 4.36Å; F68-F71 HydrophobicContact CZ-CE2 4.43Å; F68-F71 VanDerWaalsContact O-CB 3.24Å; F68-F71 WeakPolarHBondContact O-CB 3.47Å; F68-F71 PolarHBondContact O-N 3.44Å; F68-F71 VanDerWaalsContact O-N 3.08Å; F68-Y72 HydrophobicContact CB-CE2 4.34Å; F68-Y72 WeakPolarHBondContact O-CD2 3.4Å; F68-F122 HydrophobicContact CB-CZ 4.5Å; F68-F122 HydrophobicContact CD2-CE1 4.28Å; F68-M127 HydrophobicContact CB-CE 4.49Å; F68-M127 HydrophobicContact CD1-CE 3.96Å; F68-M127 HydrophobicContact CD2-CE 3.39Å; F68-M127 HydrophobicContact CE1-CE 3.95Å; F68-M127 HydrophobicContact CE2-CE 3.34Å; F68-M127 HydrophobicContact CG-CE 3.68Å; F68-M127 HydrophobicContact CZ-CE 3.62Å; F68-M127 HydrophobicContact CZ-SD 4.38Å
69K92.9Very high90.1Very high60 Ų6059.4 Ų59.426%0.26126%0.264SS..Hα-helixtrans-54.1-37175.668.8177.9177175.20113.7R66 W67 F71 Y72 I73 L113 E117R66-K69 WeakPolarHBondContact O-CG 3.3Å; R66-K69 PolarHBondContact O-N 3.46Å; W67-K69 PolarHBondContact O-N 3.4Å; W67-K69 VanDerWaalsContact O-N 3.13Å; K69-F71 PolarHBondContact O-N 3.31Å; K69-Y72 PolarHBondContact O-N 2.63Å; K69-Y72 VanDerWaalsContact O-N 3.14Å; K69-I73 WeakPolarHBondContact O-CG1 3.46Å; K69-I73 PolarHBondContact O-N 3.02Å; K69-L113 HydrophobicContact CB-CD1 4.35Å; K69-E117 WeakPolarHBondContact CB-OE1 3.28Å; K69-E117 WeakPolarHBondContact CD-OE1 3.2Å; K69-E117 IonicContact NZ-OE1 3.96Å
70Y95.8Very high91.4Very high94 Ų9459.4 Ų59.437%0.36927%0.266SS..Hα-helixtrans-67.8-28.9-177.6-64.8-67.5000111.8W67 F68 Y72 I73 T74 F132W67-Y70 HydrophobicContact CB-CD2 3.8Å; W67-Y70 HydrophobicContact CB-CE2 4.19Å; W67-Y70 AromaticContact CD1-CE2 3.7Å; W67-Y70 HydrophobicContact CD2-CD2 4.35Å; W67-Y70 HydrophobicContact CD2-CE2 4.15Å; W67-Y70 AromaticContact CG-CD2 3.9Å; W67-Y70 HydrophobicContact CG-CD2 3.9Å; W67-Y70 AromaticContact CG-CE2 3.8Å; W67-Y70 HydrophobicContact CG-CE2 3.8Å; W67-Y70 WeakPolarHBondContact O-CB 3.16Å; W67-Y70 WeakPolarHBondContact O-CD2 3.29Å; W67-Y70 PolarHBondContact O-N 2.97Å; F68-Y70 PolarHBondContact O-N 3.26Å; Y70-Y72 VanDerWaalsContact C-N 3.31Å; Y70-Y72 PolarHBondContact O-N 2.81Å; Y70-I73 HydrophobicContact CD1-CD1 4.13Å; Y70-I73 PolarHBondContact O-N 2.84Å; Y70-T74 WeakPolarHBondContact O-CB 3.4Å; Y70-T74 PolarHBondContact O-N 3.04Å; Y70-T74 PolarHBondContact O-OG1 2.82Å; Y70-T74 VanDerWaalsContact O-OG1 3.08Å; Y70-F132 HydrophobicContact CD2-CE2 4.18Å
71F95.4Very high92.5Very high9 Ų952 Ų524%0.03924%0.244CC..Hα-helixtrans-61-46.7173.8-61.2-0.6000110.3F68 K69 T74 G75 M127 F132 N136 Y139F68-F71 AromaticContact CD1-CD2 3.37Å; F68-F71 HydrophobicContact CD1-CD2 3.37Å; F68-F71 AromaticContact CD1-CE2 3.25Å; F68-F71 HydrophobicContact CD1-CE2 3.25Å; F68-F71 HydrophobicContact CD1-CG 4.36Å; F68-F71 HydrophobicContact CD1-CZ 4.14Å; F68-F71 AromaticContact CE1-CD2 3.79Å; F68-F71 HydrophobicContact CE1-CD2 3.79Å; F68-F71 AromaticContact CE1-CE2 3.3Å; F68-F71 HydrophobicContact CE1-CE2 3.3Å; F68-F71 HydrophobicContact CE1-CZ 4.26Å; F68-F71 HydrophobicContact CG-CD2 4.49Å; F68-F71 HydrophobicContact CG-CE2 4.36Å; F68-F71 HydrophobicContact CZ-CE2 4.43Å; F68-F71 VanDerWaalsContact O-CB 3.24Å; F68-F71 WeakPolarHBondContact O-CB 3.47Å; F68-F71 PolarHBondContact O-N 3.44Å; F68-F71 VanDerWaalsContact O-N 3.08Å; K69-F71 PolarHBondContact O-N 3.31Å; F71-T74 PolarHBondContact O-N 3Å; F71-G75 PolarHBondContact O-N 2.92Å; F71-M127 HydrophobicContact CE2-SD 4.37Å; F71-M127 HydrophobicContact CZ-CE 4.32Å; F71-M127 HydrophobicContact CZ-SD 3.75Å; F71-F132 HydrophobicContact CD1-CD2 4.27Å; F71-F132 HydrophobicContact CD1-CE2 4.29Å; F71-F132 HydrophobicContact CE1-CB 4.27Å; F71-F132 AromaticContact CE1-CD2 3.35Å; F71-F132 HydrophobicContact CE1-CD2 3.35Å; F71-F132 AromaticContact CE1-CE2 3.79Å; F71-F132 HydrophobicContact CE1-CE2 3.79Å; F71-F132 AromaticContact CE1-CG 3.99Å; F71-F132 HydrophobicContact CE1-CG 3.99Å; F71-F132 VanDerWaalsContact CE1-O 3.28Å; F71-F132 WeakPolarHBondContact CE1-O 3.43Å; F71-F132 HydrophobicContact CZ-CB 4.43Å; F71-F132 HydrophobicContact CZ-CD2 4.08Å; F71-N136 WeakPolarHBondContact CD1-ND2 3.46Å; F71-N136 WeakPolarHBondContact CE1-ND2 3.45Å; F71-Y139 HydrophobicContact CB-CD2 3.53Å; F71-Y139 HydrophobicContact CB-CE2 3.71Å; F71-Y139 HydrophobicContact CB-CG 4.42Å; F71-Y139 HydrophobicContact CD2-CE2 4.25Å; F71-Y139 HydrophobicContact CG-CD2 4.34Å; F71-Y139 HydrophobicContact CG-CE2 4.41Å; F71-Y139 VanDerWaalsContact O-CB 3.3Å; F71-Y139 WeakPolarHBondContact O-CB 3.18Å
72Y96.6Very high93.2Very high27 Ų2748.7 Ų48.711%0.10623%0.227CC..Hα-helixtrans-76.1-32-177.9-54.4-63.7000112.4F68 K69 Y70 G75 V76 R112 C116 Y139F68-Y72 HydrophobicContact CB-CE2 4.34Å; F68-Y72 WeakPolarHBondContact O-CD2 3.4Å; K69-Y72 PolarHBondContact O-N 2.63Å; K69-Y72 VanDerWaalsContact O-N 3.14Å; Y70-Y72 VanDerWaalsContact C-N 3.31Å; Y70-Y72 PolarHBondContact O-N 2.81Å; Y72-G75 PolarHBondContact O-N 3.45Å; Y72-V76 WeakPolarHBondContact O-CB 3.35Å; Y72-V76 VanDerWaalsContact O-CG2 3.27Å; Y72-V76 WeakPolarHBondContact O-CG2 3.48Å; Y72-V76 PolarHBondContact O-N 3.33Å; Y72-R112 HydrophobicContact CD1-CB 3.28Å; Y72-R112 HydrophobicContact CD1-CG 3.99Å; Y72-R112 HydrophobicContact CD2-CB 4.29Å; Y72-R112 HydrophobicContact CE1-CB 3.26Å; Y72-R112 HydrophobicContact CE1-CG 3.5Å; Y72-R112 HydrophobicContact CE2-CB 4.31Å; Y72-R112 HydrophobicContact CG-CB 3.8Å; Y72-R112 WeakPolarHBondContact OH-CD 3.36Å; Y72-C116 HydrophobicContact CD2-CB 4.38Å; Y72-C116 VanDerWaalsContact CD2-SG 3.57Å; Y72-C116 WeakPolarHBondContact CE2-SG 3.45Å; Y72-Y139 AromaticContact CD1-CE1 3.83Å; Y72-Y139 HydrophobicContact CD1-CE1 3.83Å; Y72-Y139 HydrophobicContact CD1-CE2 4.35Å; Y72-Y139 AromaticContact CD1-CZ 3.76Å; Y72-Y139 AromaticContact CE1-CE1 3.88Å; Y72-Y139 HydrophobicContact CE1-CE1 3.88Å; Y72-Y139 HydrophobicContact CE1-CE2 4.11Å; Y72-Y139 AromaticContact CE1-CZ 3.42Å; Y72-Y139 VanDerWaalsContact CE1-CZ 3.42Å; Y72-Y139 WeakPolarHBondContact CE1-OH 3.49Å
73I97.4Very high93.9Very high76 Ų7648.2 Ų48.239%0.3923%0.226SC..Hα-helixtrans-59.5-50.6168.6-67.5168.7000110K69 Y70 G75 V76 F77 L113K69-I73 WeakPolarHBondContact O-CG1 3.46Å; K69-I73 PolarHBondContact O-N 3.02Å; Y70-I73 HydrophobicContact CD1-CD1 4.13Å; Y70-I73 PolarHBondContact O-N 2.84Å; I73-G75 VanDerWaalsContact C-N 3.27Å; I73-G75 PolarHBondContact O-N 3.31Å; I73-V76 PolarHBondContact O-N 3.04Å; I73-F77 WeakPolarHBondContact O-CB 3.28Å; I73-F77 PolarHBondContact O-N 3.27Å; I73-L113 HydrophobicContact CD1-CD1 4.5Å; I73-L113 HydrophobicContact CG1-CD1 3.76Å; I73-L113 HydrophobicContact CG1-CD2 4.09Å
74T97.5Very high94.2Very high41 Ų4152 Ų5225%0.25225%0.245SC..Hα-helixtrans-58.5-41174.8-63.90000111.1Y70 F71 S78 N136 L140Y70-T74 WeakPolarHBondContact O-CB 3.4Å; Y70-T74 PolarHBondContact O-N 3.04Å; Y70-T74 PolarHBondContact O-OG1 2.82Å; Y70-T74 VanDerWaalsContact O-OG1 3.08Å; F71-T74 PolarHBondContact O-N 3Å; T74-S78 VanDerWaalsContact O-CB 3.25Å; T74-S78 WeakPolarHBondContact O-CB 3.49Å; T74-S78 PolarHBondContact O-N 3.12Å; T74-S78 PolarHBondContact O-OG 3.26Å; T74-N136 PolarHBondContact OG1-OD1 3.35Å; T74-N136 VanDerWaalsContact OG1-OD1 3.08Å; T74-L140 HydrophobicContact CG2-CB 4.14Å
75G97.9Very high94.3Very high0 Ų052.7 Ų52.70%025%0.249CC..Hα-helixtrans-62.8-47.9177.300000113.5F71 Y72 I73 S78 T79F71-G75 PolarHBondContact O-N 2.92Å; Y72-G75 PolarHBondContact O-N 3.45Å; I73-G75 VanDerWaalsContact C-N 3.27Å; I73-G75 PolarHBondContact O-N 3.31Å; G75-S78 PolarHBondContact O-OG 3.49Å; G75-T79 WeakPolarHBondContact O-CB 3.45Å; G75-T79 PolarHBondContact O-N 2.77Å; G75-T79 PolarHBondContact O-OG1 3.42Å
76V98.2Very high94.5Very high27 Ų2750.6 Ų50.616%0.16424%0.24CC..Hα-helixtrans-59.7-51.4176.5169.30000109.9Y72 I73 T79 L80 L106 V109 L113Y72-V76 WeakPolarHBondContact O-CB 3.35Å; Y72-V76 VanDerWaalsContact O-CG2 3.27Å; Y72-V76 WeakPolarHBondContact O-CG2 3.48Å; Y72-V76 PolarHBondContact O-N 3.33Å; I73-V76 PolarHBondContact O-N 3.04Å; V76-T79 PolarHBondContact O-N 3.47Å; V76-L80 HydrophobicContact CG1-CD1 3.84Å; V76-L80 WeakPolarHBondContact O-CB 3.47Å; V76-L80 VanDerWaalsContact O-CG 3.31Å; V76-L80 WeakPolarHBondContact O-CG 3.43Å; V76-L80 PolarHBondContact O-N 2.91Å; V76-L106 HydrophobicContact CG1-CD1 4.22Å; V76-V109 HydrophobicContact CB-CG2 4.44Å; V76-V109 HydrophobicContact CG2-CB 4.38Å; V76-V109 HydrophobicContact CG2-CG2 3.79Å; V76-L113 HydrophobicContact CG2-CD2 4.18Å
77F98Very high94.7Very high143 Ų14346.5 Ų46.563%0.62723%0.229SC*.Hα-helixtrans-62.5-51.4-177.8-177-99.6000112.2I73 T79 L80 C81I73-F77 WeakPolarHBondContact O-CB 3.28Å; I73-F77 PolarHBondContact O-N 3.27Å; F77-T79 VanDerWaalsContact C-N 3.33Å; F77-T79 PolarHBondContact O-N 3.38Å; F77-L80 PolarHBondContact O-N 3.29Å; F77-C81 PolarHBondContact O-N 3.21Å; F77-C81 PolarHBondContact O-SG 3.46Å; F77-C81 VanDerWaalsContact O-SG 3.32Å
78S97.5Very high94.5Very high7 Ų749.6 Ų49.65%0.04925%0.245CC..Hα-helixtrans-62.3-38.8179.7580000112.6T74 G75 C81 V82 Y139T74-S78 VanDerWaalsContact O-CB 3.25Å; T74-S78 WeakPolarHBondContact O-CB 3.49Å; T74-S78 PolarHBondContact O-N 3.12Å; T74-S78 PolarHBondContact O-OG 3.26Å; G75-S78 PolarHBondContact O-OG 3.49Å; S78-C81 PolarHBondContact O-N 3.27Å; S78-V82 WeakPolarHBondContact O-CG2 3.34Å; S78-V82 PolarHBondContact O-N 2.87Å; S78-Y139 PolarHBondContact OG-O 3.42Å; S78-Y139 VanDerWaalsContact OG-O 3.04Å
79T97.9Very high94Very high0 Ų054.6 Ų54.60%027%0.271CS..Hα-helixtrans-68.1-41.6177.4-540000111.5G75 V76 F77 V82 L83 Y105 L106 P143G75-T79 WeakPolarHBondContact O-CB 3.45Å; G75-T79 PolarHBondContact O-N 2.77Å; G75-T79 PolarHBondContact O-OG1 3.42Å; V76-T79 PolarHBondContact O-N 3.47Å; F77-T79 VanDerWaalsContact C-N 3.33Å; F77-T79 PolarHBondContact O-N 3.38Å; T79-V82 PolarHBondContact O-N 3.21Å; T79-L83 VanDerWaalsContact O-CB 3.25Å; T79-L83 WeakPolarHBondContact O-CB 3.35Å; T79-L83 PolarHBondContact O-N 3.28Å; T79-Y105 HydrophobicContact CG2-CD1 3.81Å; T79-Y105 VanDerWaalsContact OG1-CD1 3.28Å; T79-Y105 WeakPolarHBondContact OG1-CD1 3.2Å; T79-Y105 WeakPolarHBondContact OG1-CE1 3.45Å; T79-L106 HydrophobicContact CG2-CB 3.8Å; T79-L106 HydrophobicContact CG2-CD1 4.35Å; T79-P143 HydrophobicContact CG2-CB 4.37Å
80L97.2Very high92.9Very high73 Ų7353.3 Ų53.338%0.38227%0.267SS..Hα-helixtrans-59.3-47.9173.2-77.3168.5000111.2V76 F77 V82 L83 L84 L106V76-L80 HydrophobicContact CG1-CD1 3.84Å; V76-L80 WeakPolarHBondContact O-CB 3.47Å; V76-L80 VanDerWaalsContact O-CG 3.31Å; V76-L80 WeakPolarHBondContact O-CG 3.43Å; V76-L80 PolarHBondContact O-N 2.91Å; F77-L80 PolarHBondContact O-N 3.29Å; L80-V82 PolarHBondContact O-N 3.42Å; L80-L83 PolarHBondContact O-N 2.94Å; L80-L84 VanDerWaalsContact O-CG 3.25Å; L80-L84 WeakPolarHBondContact O-CG 3.47Å; L80-L84 PolarHBondContact O-N 2.85Å; L80-L106 HydrophobicContact CD2-CD1 4.13Å; L80-L106 HydrophobicContact CD2-CD2 3.5Å; L80-L106 VanDerWaalsContact CD2-CD2 3.5Å; L80-L106 HydrophobicContact CD2-CG 4.48Å; L80-L106 HydrophobicContact CG-CD1 3.83Å; L80-L106 HydrophobicContact CG-CD2 4.14Å
81C95.5Very high91.1Very high49 Ų4954 Ų5433%0.33129%0.285SS..Hα-helixtrans-58-48177.5-69.30000112F77 S78 L84 V85F77-C81 PolarHBondContact O-N 3.21Å; F77-C81 PolarHBondContact O-SG 3.46Å; F77-C81 VanDerWaalsContact O-SG 3.32Å; S78-C81 PolarHBondContact O-N 3.27Å; C81-L84 PolarHBondContact O-N 3.47Å; C81-V85 WeakPolarHBondContact O-CG2 3.24Å; C81-V85 PolarHBondContact O-N 3.36Å
82V94.4Very high89.8Confident14 Ų1459.1 Ų59.19%0.08532%0.322CS..Hα-helixtrans-65.5-40179.6171.30000111.8S78 T79 L80 V85 E86 L102 P143 I144 L147S78-V82 WeakPolarHBondContact O-CG2 3.34Å; S78-V82 PolarHBondContact O-N 2.87Å; T79-V82 PolarHBondContact O-N 3.21Å; L80-V82 PolarHBondContact O-N 3.42Å; V82-V85 PolarHBondContact O-N 3.44Å; V82-E86 PolarHBondContact O-N 3Å; V82-L102 HydrophobicContact CG1-CD1 4Å; V82-L102 HydrophobicContact CG1-CD2 3.84Å; V82-P143 HydrophobicContact CB-CB 4.05Å; V82-P143 HydrophobicContact CG1-CB 4.32Å; V82-P143 HydrophobicContact CG2-CB 4.01Å; V82-P143 HydrophobicContact CG2-CG 4.36Å; V82-I144 HydrophobicContact CG2-CG1 4.13Å; V82-L147 HydrophobicContact CG1-CB 3.85Å; V82-L147 HydrophobicContact CG1-CD2 4.16Å; V82-L147 HydrophobicContact CG1-CG 4.45Å
83L94.9Very high88.7Confident17 Ų1763.3 Ų63.39%0.08935%0.35CS..Hα-helixtrans-62.2-43.3175.4177.960.8000111.5T79 L80 V85 E86 L87 I99 L102 I103 L106T79-L83 VanDerWaalsContact O-CB 3.25Å; T79-L83 WeakPolarHBondContact O-CB 3.35Å; T79-L83 PolarHBondContact O-N 3.28Å; L80-L83 PolarHBondContact O-N 2.94Å; L83-V85 VanDerWaalsContact C-N 3.34Å; L83-V85 PolarHBondContact O-N 2.98Å; L83-E86 PolarHBondContact O-N 2.92Å; L83-L87 HydrophobicContact CD1-CD1 4.03Å; L83-L87 HydrophobicContact CD1-CG 4.19Å; L83-L87 HydrophobicContact CG-CD1 3.98Å; L83-L87 WeakPolarHBondContact O-CB 3.35Å; L83-L87 VanDerWaalsContact O-CG 3.26Å; L83-L87 WeakPolarHBondContact O-CG 3.4Å; L83-L87 PolarHBondContact O-N 3.5Å; L83-I99 HydrophobicContact CD1-CG2 4.27Å; L83-L102 HydrophobicContact CB-CB 4.47Å; L83-L102 HydrophobicContact CD1-CB 4.02Å; L83-L102 HydrophobicContact CD1-CD1 4.42Å; L83-I103 HydrophobicContact CD1-CG1 4.18Å; L83-I103 HydrophobicContact CD2-CG1 4.08Å; L83-L106 HydrophobicContact CD2-CD2 4.31Å
84L93.3Very high88.1Confident91 Ų9164.2 Ų64.248%0.47636%0.355SS..Hα-helixtrans-64.4-38.4175.7-67.8173.1000111.9L80 C81 L87 F88L80-L84 VanDerWaalsContact O-CG 3.25Å; L80-L84 WeakPolarHBondContact O-CG 3.47Å; L80-L84 PolarHBondContact O-N 2.85Å; C81-L84 PolarHBondContact O-N 3.47Å; L84-L87 PolarHBondContact O-N 2.97Å; L84-F88 HydrophobicContact CB-CD2 4.39Å; L84-F88 HydrophobicContact CD2-CD2 4.05Å; L84-F88 HydrophobicContact CD2-CE2 3.66Å; L84-F88 WeakPolarHBondContact O-CB 3.35Å; L84-F88 WeakPolarHBondContact O-CD2 3.43Å; L84-F88 PolarHBondContact O-N 2.96Å
85V89.7Confident87.8Confident53 Ų5363.8 Ų63.832%0.32135%0.352SS..Iπ-helixtrans-61.3-46.4174.4167.80000111.3C81 V82 L83 L87 M89 L90C81-V85 WeakPolarHBondContact O-CG2 3.24Å; C81-V85 PolarHBondContact O-N 3.36Å; V82-V85 PolarHBondContact O-N 3.44Å; L83-V85 VanDerWaalsContact C-N 3.34Å; L83-V85 PolarHBondContact O-N 2.98Å; V85-L87 VanDerWaalsContact C-N 3.34Å; V85-L87 PolarHBondContact O-N 3.39Å; V85-M89 HydrophobicContact CG1-CB 4.25Å; V85-M89 WeakPolarHBondContact O-CA 3.47Å; V85-M89 WeakPolarHBondContact O-CB 3.37Å; V85-M89 PolarHBondContact O-N 3.35Å; V85-L90 HydrophobicContact CG1-CD1 4.34Å; V85-L90 PolarHBondContact O-N 3.32Å
86E88.7Confident87.6Confident1 Ų168 Ų681%0.00537%0.37CS..Iπ-helixtrans-64.5-37.1177.3-179.465.2-176.900112.2V82 L83 L90 N95 I98 I99 L102 L147 Q150V82-E86 PolarHBondContact O-N 3Å; L83-E86 PolarHBondContact O-N 2.92Å; E86-L90 WeakPolarHBondContact OE2-CD2 3.35Å; E86-N95 WeakPolarHBondContact OE1-CB 3.39Å; E86-N95 PolarHBondContact OE1-N 3.4Å; E86-I98 HydrophobicContact CG-CG2 4.46Å; E86-I99 HydrophobicContact CG-CD1 4.22Å; E86-I99 HydrophobicContact CG-CG1 3.64Å; E86-L102 HydrophobicContact CB-CD1 4.32Å; E86-L147 HydrophobicContact CB-CD1 4.32Å; E86-L147 VanDerWaalsContact OE2-CD1 3.27Å; E86-L147 WeakPolarHBondContact OE2-CD1 3.35Å; E86-Q150 PolarHBondContact OE1-NE2 2.97Å; E86-Q150 PolarHBondContact OE2-NE2 2.83Å
87L90.7Very high87.5Confident70 Ų7066.8 Ų66.837%0.36636%0.363SS..Iπ-helixtrans-75.1-38.1-179.1-71.2172.9000113.8L83 L84 V85 L94 I99L83-L87 HydrophobicContact CD1-CD1 4.03Å; L83-L87 HydrophobicContact CD1-CG 4.19Å; L83-L87 HydrophobicContact CG-CD1 3.98Å; L83-L87 WeakPolarHBondContact O-CB 3.35Å; L83-L87 VanDerWaalsContact O-CG 3.26Å; L83-L87 WeakPolarHBondContact O-CG 3.4Å; L83-L87 PolarHBondContact O-N 3.5Å; L84-L87 PolarHBondContact O-N 2.97Å; V85-L87 VanDerWaalsContact C-N 3.34Å; V85-L87 PolarHBondContact O-N 3.39Å; L87-L94 HydrophobicContact CD2-CD2 4.48Å; L87-I99 HydrophobicContact CD2-CD1 4.01Å; L87-I99 HydrophobicContact CD2-CG1 4.44Å; L87-I99 HydrophobicContact CD2-CG2 4.41Å
88F87.2Confident87.4Confident147 Ų14760 Ų6065%0.64533%0.333SS*.Iπ-helixtrans-114.4-34.2-169.1-64.9-71.3000114.8L84L84-F88 HydrophobicContact CB-CD2 4.39Å; L84-F88 HydrophobicContact CD2-CD2 4.05Å; L84-F88 HydrophobicContact CD2-CE2 3.66Å; L84-F88 WeakPolarHBondContact O-CB 3.35Å; L84-F88 WeakPolarHBondContact O-CD2 3.43Å; L84-F88 PolarHBondContact O-N 2.96Å
89M77.3Confident87.3Confident147 Ų14760.7 Ų60.772%0.72434%0.335SS*.Iπ-helixtrans-99.3-31.7-170.5-62.6-65.2-171.100112.8V85 S91V85-M89 HydrophobicContact CG1-CB 4.25Å; V85-M89 WeakPolarHBondContact O-CA 3.47Å; V85-M89 WeakPolarHBondContact O-CB 3.37Å; V85-M89 PolarHBondContact O-N 3.35Å; M89-S91 PolarHBondContact O-N 3.49Å; M89-S91 VanDerWaalsContact O-N 3.09Å; M89-S91 PolarHBondContact O-OG 2.9Å
90L70.5Confident87.3Confident34 Ų3461.5 Ų61.518%0.17834%0.341CS..SBendtrans-87.855.6-180-120.885.2000111.6M1 V85 E86 S92 Q150M1-L90 HydrophobicContact CG-CD1 3.82Å; M1-L90 HydrophobicContact CG-CD2 3.97Å; M1-L90 HydrophobicContact CG-CG 4.45Å; V85-L90 HydrophobicContact CG1-CD1 4.34Å; V85-L90 PolarHBondContact O-N 3.32Å; E86-L90 WeakPolarHBondContact OE2-CD2 3.35Å; L90-S92 PolarHBondContact O-N 3.3Å; L90-S92 VanDerWaalsContact O-N 3.1Å; L90-Q150 VanDerWaalsContact CD2-OE1 3.3Å
91S56.6Low87.3Confident108 Ų10858 Ų5876%0.75532%0.323SS*.THydrogen-bonded Turntrans-86.660.7-161.742.40000116.1M89M89-S91 PolarHBondContact O-N 3.49Å; M89-S91 VanDerWaalsContact O-N 3.09Å; M89-S91 PolarHBondContact O-OG 2.9Å
92S68Low87.4Confident117 Ų11755.7 Ų55.782%0.81831%0.307SS*.THydrogen-bonded Turntrans-124.6-42.3162.954.40000114L90L90-S92 PolarHBondContact O-N 3.3Å; L90-S92 VanDerWaalsContact O-N 3.1Å
93V74.2Confident87.6Confident115 Ų11558.6 Ų58.670%0.69732%0.321SS*.  trans-151.1120.5172.6-178.10000108.8N95V93-N95 PolarHBondContact O-N 3.07Å
94L84.7Confident87.8Confident94 Ų9458.4 Ų58.449%0.49232%0.32SS..  trans-64.6120176.1-68.6173.9000110.3L87 K96 I99L87-L94 HydrophobicContact CD2-CD2 4.48Å; L94-K96 PolarHBondContact O-N 3.23Å; L94-K96 VanDerWaalsContact O-N 3.1Å; L94-I99 HydrophobicContact CB-CD1 3.84Å; L94-I99 HydrophobicContact CD2-CD1 3.91Å; L94-I99 HydrophobicContact CG-CD1 4.34Å
95N90.7Very high88Confident33 Ų3354 Ų5418%0.17630%0.298CS..  trans-82.194.3174.8-170.4-45.5000110E86 V93 T97 I98 I99 Q150E86-N95 WeakPolarHBondContact OE1-CB 3.39Å; E86-N95 PolarHBondContact OE1-N 3.4Å; V93-N95 PolarHBondContact O-N 3.07Å; N95-T97 PolarHBondContact O-N 3.45Å; N95-T97 VanDerWaalsContact O-N 3.13Å; N95-T97 WeakPolarHBondContact OD1-CB 3.35Å; N95-T97 PolarHBondContact OD1-N 3.36Å; N95-T97 VanDerWaalsContact OD1-N 3.14Å; N95-I98 HydrophobicContact CB-CB 4.1Å; N95-I98 HydrophobicContact CB-CG1 4.14Å; N95-I98 PolarHBondContact O-N 3.31Å; N95-I98 PolarHBondContact OD1-N 3.07Å; N95-I98 VanDerWaalsContact OD1-N 3.09Å; N95-I99 WeakPolarHBondContact O-CG1 3.46Å; N95-I99 PolarHBondContact O-N 3.07Å; N95-Q150 HydrophobicContact CB-CG 3.91Å; N95-Q150 WeakPolarHBondContact ND2-CG 3.42Å
96K93.9Very high88.4Confident88 Ų8853 Ų5338%0.38329%0.29SS..Hα-helixtrans-52.3-36.2-179.1-64.8-177.6-66.9-175.10113.2L94 S100 Y158 I161L94-K96 PolarHBondContact O-N 3.23Å; L94-K96 VanDerWaalsContact O-N 3.1Å; K96-S100 VanDerWaalsContact O-CB 3.31Å; K96-S100 WeakPolarHBondContact O-CB 3.48Å; K96-S100 PolarHBondContact O-N 2.64Å; K96-S100 PolarHBondContact O-OG 3.1Å; K96-Y158 HydrophobicContact CD-CE1 3.86Å; K96-Y158 WeakPolarHBondContact CD-OH 3.07Å; K96-Y158 PolarHBondContact NZ-OH 2.81Å; K96-I161 HydrophobicContact CB-CD1 4.17Å
97T96.2Very high88.9Confident2 Ų255.5 Ų55.51%0.01231%0.305CS..Hα-helixtrans-65.1-50.4178.2-55.10000110.7N95 S100 V101 A153 A154 R156 F230N95-T97 PolarHBondContact O-N 3.45Å; N95-T97 VanDerWaalsContact O-N 3.13Å; N95-T97 WeakPolarHBondContact OD1-CB 3.35Å; N95-T97 PolarHBondContact OD1-N 3.36Å; N95-T97 VanDerWaalsContact OD1-N 3.14Å; T97-S100 PolarHBondContact O-N 3.26Å; T97-V101 WeakPolarHBondContact O-CG2 3.27Å; T97-V101 PolarHBondContact O-N 2.93Å; T97-A153 HydrophobicContact CG2-CB 4.41Å; T97-A154 WeakPolarHBondContact CB-O 3.26Å; T97-A154 PolarHBondContact OG1-O 3.29Å; T97-R156 HydrophobicContact CG2-CG 3.79Å; T97-R156 WeakPolarHBondContact OG1-CG 3.36Å; T97-R156 PolarHBondContact OG1-N 2.89Å; T97-F230 HydrophobicContact CG2-CD1 3.96Å; T97-F230 HydrophobicContact CG2-CE1 3.74Å
98I96Very high89.2Confident0 Ų052.2 Ų52.20%029%0.288CS..Hα-helixtrans-64-44.5179.4-65.9-54.9000111.5E86 N95 S100 V101 L102 I146 Q150 A153 I231E86-I98 HydrophobicContact CG-CG2 4.46Å; N95-I98 HydrophobicContact CB-CB 4.1Å; N95-I98 HydrophobicContact CB-CG1 4.14Å; N95-I98 PolarHBondContact O-N 3.31Å; N95-I98 PolarHBondContact OD1-N 3.07Å; N95-I98 VanDerWaalsContact OD1-N 3.09Å; I98-S100 VanDerWaalsContact C-N 3.33Å; I98-S100 PolarHBondContact O-N 2.87Å; I98-V101 PolarHBondContact O-N 3.47Å; I98-L102 HydrophobicContact CG2-CD1 3.86Å; I98-L102 HydrophobicContact CG2-CG 4.32Å; I98-L102 WeakPolarHBondContact O-CG 3.26Å; I98-L102 PolarHBondContact O-N 3.31Å; I98-I146 HydrophobicContact CD1-CG2 4.39Å; I98-I146 HydrophobicContact CG2-CG2 4.26Å; I98-Q150 HydrophobicContact CD1-CB 4.43Å; I98-Q150 HydrophobicContact CG1-CB 3.9Å; I98-Q150 HydrophobicContact CG1-CG 3.98Å; I98-A153 HydrophobicContact CD1-CB 3.9Å; I98-A153 HydrophobicContact CG1-CB 4.17Å; I98-I231 HydrophobicContact CD1-CG2 4.41Å
99I95.9Very high89.8Confident21 Ų2145.2 Ų45.211%0.10826%0.257CS..Hα-helixtrans-59.5-45.3176.8-67.2166.1000110.7L83 E86 L87 L94 N95 V101 L102 I103L83-I99 HydrophobicContact CD1-CG2 4.27Å; E86-I99 HydrophobicContact CG-CD1 4.22Å; E86-I99 HydrophobicContact CG-CG1 3.64Å; L87-I99 HydrophobicContact CD2-CD1 4.01Å; L87-I99 HydrophobicContact CD2-CG1 4.44Å; L87-I99 HydrophobicContact CD2-CG2 4.41Å; L94-I99 HydrophobicContact CB-CD1 3.84Å; L94-I99 HydrophobicContact CD2-CD1 3.91Å; L94-I99 HydrophobicContact CG-CD1 4.34Å; N95-I99 WeakPolarHBondContact O-CG1 3.46Å; N95-I99 PolarHBondContact O-N 3.07Å; I99-V101 VanDerWaalsContact C-N 3.31Å; I99-V101 PolarHBondContact O-N 3.02Å; I99-L102 PolarHBondContact O-N 3.44Å; I99-I103 HydrophobicContact CG2-CD1 3.71Å; I99-I103 HydrophobicContact CG2-CG1 4.35Å; I99-I103 VanDerWaalsContact O-CG1 3.29Å; I99-I103 WeakPolarHBondContact O-CG1 3.31Å; I99-I103 PolarHBondContact O-N 3.4Å
100S97.3Very high90.7Very high17 Ų1740.4 Ų40.412%0.11924%0.238CC..Hα-helixtrans-60.6-40.9178.3-57.80000111.9K96 T97 I98 M104 I161K96-S100 VanDerWaalsContact O-CB 3.31Å; K96-S100 WeakPolarHBondContact O-CB 3.48Å; K96-S100 PolarHBondContact O-N 2.64Å; K96-S100 PolarHBondContact O-OG 3.1Å; T97-S100 PolarHBondContact O-N 3.26Å; I98-S100 VanDerWaalsContact C-N 3.33Å; I98-S100 PolarHBondContact O-N 2.87Å; S100-M104 WeakPolarHBondContact O-CB 3.47Å; S100-M104 WeakPolarHBondContact O-CG 3.41Å; S100-M104 PolarHBondContact O-N 3.19Å; S100-I161 WeakPolarHBondContact OG-CG2 3.5Å
101V98.2Very high92Very high0 Ų040.3 Ų40.30%024%0.235CC..Hα-helixtrans-67.7-44.3176.5173.40000111.5T97 I98 I99 I103 M104 Y105 I146 F164 F227 F230 I231T97-V101 WeakPolarHBondContact O-CG2 3.27Å; T97-V101 PolarHBondContact O-N 2.93Å; I98-V101 PolarHBondContact O-N 3.47Å; I99-V101 VanDerWaalsContact C-N 3.31Å; I99-V101 PolarHBondContact O-N 3.02Å; V101-I103 PolarHBondContact O-N 3.39Å; V101-M104 PolarHBondContact O-N 3.36Å; V101-Y105 VanDerWaalsContact O-CB 3.3Å; V101-Y105 WeakPolarHBondContact O-CB 3.23Å; V101-Y105 PolarHBondContact O-N 2.97Å; V101-I146 HydrophobicContact CB-CG2 4.21Å; V101-I146 HydrophobicContact CG1-CD1 3.92Å; V101-I146 HydrophobicContact CG1-CG1 4.15Å; V101-I146 HydrophobicContact CG1-CG2 3.72Å; V101-F164 HydrophobicContact CG2-CE1 4.48Å; V101-F164 HydrophobicContact CG2-CZ 4.45Å; V101-F227 HydrophobicContact CG1-CB 4.47Å; V101-F227 HydrophobicContact CG1-CD1 3.73Å; V101-F227 HydrophobicContact CG1-CE1 4.28Å; V101-F227 HydrophobicContact CG1-CG 4.32Å; V101-F230 HydrophobicContact CG2-CD1 3.48Å; V101-F230 VanDerWaalsContact CG2-CD1 3.48Å; V101-F230 HydrophobicContact CG2-CE1 3.96Å; V101-I231 HydrophobicContact CG1-CD1 4.26Å; V101-I231 HydrophobicContact CG1-CG1 4.45Å; V101-I231 HydrophobicContact CG2-CG1 3.91Å
102L97.9Very high93.9Very high0 Ų035.3 Ų35.30%020%0.2CC..Hα-helixtrans-62.7-41.5177.8-73.8171.1000111.8V82 L83 E86 I98 I99 Y105 L106 P143 I146V82-L102 HydrophobicContact CG1-CD1 4Å; V82-L102 HydrophobicContact CG1-CD2 3.84Å; L83-L102 HydrophobicContact CB-CB 4.47Å; L83-L102 HydrophobicContact CD1-CB 4.02Å; L83-L102 HydrophobicContact CD1-CD1 4.42Å; E86-L102 HydrophobicContact CB-CD1 4.32Å; I98-L102 HydrophobicContact CG2-CD1 3.86Å; I98-L102 HydrophobicContact CG2-CG 4.32Å; I98-L102 WeakPolarHBondContact O-CG 3.26Å; I98-L102 PolarHBondContact O-N 3.31Å; I99-L102 PolarHBondContact O-N 3.44Å; L102-Y105 PolarHBondContact O-N 3.46Å; L102-L106 WeakPolarHBondContact O-CB 3.34Å; L102-L106 PolarHBondContact O-N 3.22Å; L102-P143 HydrophobicContact CD2-CB 4.16Å; L102-I146 HydrophobicContact CD2-CB 4.02Å; L102-I146 HydrophobicContact CD2-CD1 4.24Å; L102-I146 HydrophobicContact CD2-CG2 3.79Å; L102-I146 HydrophobicContact CG-CG2 3.87Å
103I98Very high95.3Very high75 Ų7531.6 Ų31.639%0.38517%0.171SC..Hα-helixtrans-62.1-46.6174.2-68.2168.8000110.3L83 I99 V101 Y105 L106 V107L83-I103 HydrophobicContact CD1-CG1 4.18Å; L83-I103 HydrophobicContact CD2-CG1 4.08Å; I99-I103 HydrophobicContact CG2-CD1 3.71Å; I99-I103 HydrophobicContact CG2-CG1 4.35Å; I99-I103 VanDerWaalsContact O-CG1 3.29Å; I99-I103 WeakPolarHBondContact O-CG1 3.31Å; I99-I103 PolarHBondContact O-N 3.4Å; V101-I103 PolarHBondContact O-N 3.39Å; I103-Y105 VanDerWaalsContact C-N 3.35Å; I103-Y105 PolarHBondContact O-N 3.47Å; I103-L106 WeakPolarHBondContact O-CB 3.37Å; I103-L106 PolarHBondContact O-N 2.9Å; I103-V107 WeakPolarHBondContact O-CG2 3.36Å; I103-V107 PolarHBondContact O-N 3.24Å
104M98.4Very high96.4Very high13 Ų1331.1 Ų31.16%0.06416%0.157CC..Hα-helixtrans-68.1-33.8179-72.6-71.478.900113.4S100 V101 V107 H108 F164 T165 M168 F227S100-M104 WeakPolarHBondContact O-CB 3.47Å; S100-M104 WeakPolarHBondContact O-CG 3.41Å; S100-M104 PolarHBondContact O-N 3.19Å; V101-M104 PolarHBondContact O-N 3.36Å; M104-V107 HydrophobicContact CE-CB 3.97Å; M104-V107 HydrophobicContact CE-CG1 4.42Å; M104-V107 HydrophobicContact CE-CG2 3.67Å; M104-V107 PolarHBondContact O-N 2.83Å; M104-H108 WeakPolarHBondContact O-CB 3.21Å; M104-H108 PolarHBondContact O-N 2.88Å; M104-F164 HydrophobicContact CB-CE1 4.18Å; M104-F164 HydrophobicContact CG-CE1 3.84Å; M104-T165 HydrophobicContact SD-CG2 3.98Å; M104-M168 HydrophobicContact SD-CB 3.99Å; M104-F227 HydrophobicContact CB-CE1 3.71Å; M104-F227 HydrophobicContact CB-CZ 4.23Å
105Y98.5Very high96.8Very high0 Ų026.8 Ų26.80%014%0.135CC..Hα-helixtrans-68.2-38.2171.9-171.6-109.5000111.5T79 V101 L102 I103 V107 H108 V109 Y139 T142 I146 Y224 F227T79-Y105 HydrophobicContact CG2-CD1 3.81Å; T79-Y105 VanDerWaalsContact OG1-CD1 3.28Å; T79-Y105 WeakPolarHBondContact OG1-CD1 3.2Å; T79-Y105 WeakPolarHBondContact OG1-CE1 3.45Å; V101-Y105 VanDerWaalsContact O-CB 3.3Å; V101-Y105 WeakPolarHBondContact O-CB 3.23Å; V101-Y105 PolarHBondContact O-N 2.97Å; L102-Y105 PolarHBondContact O-N 3.46Å; I103-Y105 VanDerWaalsContact C-N 3.35Å; I103-Y105 PolarHBondContact O-N 3.47Å; Y105-V107 PolarHBondContact O-N 3.36Å; Y105-H108 AromaticContact CE2-CD2 3.9Å; Y105-H108 WeakPolarHBondContact O-CB 3.26Å; Y105-H108 PolarHBondContact O-N 3.03Å; Y105-V109 HydrophobicContact CD1-CG1 4.24Å; Y105-V109 HydrophobicContact CD2-CG1 4.48Å; Y105-V109 HydrophobicContact CE1-CG1 3.69Å; Y105-V109 HydrophobicContact CE2-CG1 3.96Å; Y105-V109 WeakPolarHBondContact O-CG2 3.43Å; Y105-V109 PolarHBondContact O-N 2.99Å; Y105-Y139 WeakPolarHBondContact OH-CD1 3.44Å; Y105-T142 HydrophobicContact CD1-CG2 4.43Å; Y105-T142 HydrophobicContact CD2-CG2 4.3Å; Y105-T142 HydrophobicContact CE1-CG2 3.74Å; Y105-T142 HydrophobicContact CE2-CG2 3.6Å; Y105-T142 WeakPolarHBondContact OH-CB 3.35Å; Y105-T142 VanDerWaalsContact OH-CG2 3.3Å; Y105-T142 WeakPolarHBondContact OH-CG2 3.49Å; Y105-I146 HydrophobicContact CD1-CD1 4.21Å; Y105-I146 HydrophobicContact CG-CD1 4.01Å; Y105-Y224 HydrophobicContact CE2-CE1 4.44Å; Y105-F227 AromaticContact CD2-CE2 3.87Å; Y105-F227 HydrophobicContact CD2-CE2 3.87Å; Y105-F227 HydrophobicContact CD2-CZ 4.27Å
106L98.5Very high96.9Very high30 Ų3025.8 Ų25.816%0.15713%0.13CC..Hα-helixtrans-61.4-44.3174.2-179.760.6000111.5V76 T79 L80 L83 L102 I103 H108 V109 S110V76-L106 HydrophobicContact CG1-CD1 4.22Å; T79-L106 HydrophobicContact CG2-CB 3.8Å; T79-L106 HydrophobicContact CG2-CD1 4.35Å; L80-L106 HydrophobicContact CD2-CD1 4.13Å; L80-L106 HydrophobicContact CD2-CD2 3.5Å; L80-L106 VanDerWaalsContact CD2-CD2 3.5Å; L80-L106 HydrophobicContact CD2-CG 4.48Å; L80-L106 HydrophobicContact CG-CD1 3.83Å; L80-L106 HydrophobicContact CG-CD2 4.14Å; L83-L106 HydrophobicContact CD2-CD2 4.31Å; L102-L106 WeakPolarHBondContact O-CB 3.34Å; L102-L106 PolarHBondContact O-N 3.22Å; I103-L106 WeakPolarHBondContact O-CB 3.37Å; I103-L106 PolarHBondContact O-N 2.9Å; L106-H108 VanDerWaalsContact C-N 3.33Å; L106-V109 HydrophobicContact CD1-CG2 4.35Å; L106-V109 WeakPolarHBondContact O-CG2 3.3Å; L106-V109 PolarHBondContact O-N 3.47Å; L106-S110 VanDerWaalsContact O-CB 3.22Å; L106-S110 WeakPolarHBondContact O-CB 3.46Å; L106-S110 PolarHBondContact O-N 3.25Å; L106-S110 PolarHBondContact O-OG 2.94Å
107V98.3Very high96.8Very high55 Ų5525.7 Ų25.733%0.33313%0.131SC..Hα-helixtrans-60.5-44.7173.7174.40000110.5I103 M104 Y105 S110 R111I103-V107 WeakPolarHBondContact O-CG2 3.36Å; I103-V107 PolarHBondContact O-N 3.24Å; M104-V107 HydrophobicContact CE-CB 3.97Å; M104-V107 HydrophobicContact CE-CG1 4.42Å; M104-V107 HydrophobicContact CE-CG2 3.67Å; M104-V107 PolarHBondContact O-N 2.83Å; Y105-V107 PolarHBondContact O-N 3.36Å; V107-S110 PolarHBondContact O-N 2.94Å; V107-R111 WeakPolarHBondContact O-CB 3.43Å; V107-R111 PolarHBondContact O-N 2.92Å
108H98.3Very high96.7Very high0 Ų034 Ų340%016%0.163CC..Hα-helixtrans-55.8-53.4176.7173.573.8000112.9M104 Y105 L106 R111 R112 E220 Y224M104-H108 WeakPolarHBondContact O-CB 3.21Å; M104-H108 PolarHBondContact O-N 2.88Å; Y105-H108 AromaticContact CE2-CD2 3.9Å; Y105-H108 WeakPolarHBondContact O-CB 3.26Å; Y105-H108 PolarHBondContact O-N 3.03Å; L106-H108 VanDerWaalsContact C-N 3.33Å; H108-R111 PolarHBondContact CE1-NH2 2.77Å; H108-R111 PolarHBondContact ND1-NH2 2.7Å; H108-R112 WeakPolarHBondContact O-CB 3.29Å; H108-R112 WeakPolarHBondContact O-CG 3.2Å; H108-R112 PolarHBondContact O-N 3.49Å; H108-E220 IonicContact CE1-OE1 3.28Å; H108-E220 PolarHBondContact CE1-OE1 3.28Å; H108-E220 VanDerWaalsContact CE1-OE1 3.3Å; H108-E220 IonicContact CE1-OE2 3.06Å; H108-E220 PolarHBondContact CE1-OE2 2.96Å; H108-E220 IonicContact NE2-OE1 3.24Å; H108-E220 PolarHBondContact NE2-OE1 3.38Å; H108-E220 VanDerWaalsContact NE2-OE1 3.11Å; H108-E220 IonicContact NE2-OE2 2.8Å; H108-Y224 AromaticContact NE2-CE2 3.86Å
109V98Very high96.4Very high0 Ų034.9 Ų34.90%017%0.168CC..Hα-helixtrans-71.7-31.5-178.1-60.60000112.6V76 Y105 L106 R112 L113 Y139V76-V109 HydrophobicContact CB-CG2 4.44Å; V76-V109 HydrophobicContact CG2-CB 4.38Å; V76-V109 HydrophobicContact CG2-CG2 3.79Å; Y105-V109 HydrophobicContact CD1-CG1 4.24Å; Y105-V109 HydrophobicContact CD2-CG1 4.48Å; Y105-V109 HydrophobicContact CE1-CG1 3.69Å; Y105-V109 HydrophobicContact CE2-CG1 3.96Å; Y105-V109 WeakPolarHBondContact O-CG2 3.43Å; Y105-V109 PolarHBondContact O-N 2.99Å; L106-V109 HydrophobicContact CD1-CG2 4.35Å; L106-V109 WeakPolarHBondContact O-CG2 3.3Å; L106-V109 PolarHBondContact O-N 3.47Å; V109-R112 WeakPolarHBondContact O-CB 3.21Å; V109-R112 PolarHBondContact O-N 2.95Å; V109-L113 PolarHBondContact O-N 2.91Å; V109-Y139 HydrophobicContact CG1-CD1 3.95Å; V109-Y139 HydrophobicContact CG1-CE1 3.95Å
110S98Very high96Very high47 Ų4735.5 Ų35.533%0.32918%0.175SC..Hα-helixtrans-68.9-43.8176.1-58.50000111.5L106 V107 L113 Y114L106-S110 VanDerWaalsContact O-CB 3.22Å; L106-S110 WeakPolarHBondContact O-CB 3.46Å; L106-S110 PolarHBondContact O-N 3.25Å; L106-S110 PolarHBondContact O-OG 2.94Å; V107-S110 PolarHBondContact O-N 2.94Å; S110-L113 WeakPolarHBondContact O-CB 3.32Å; S110-L113 PolarHBondContact O-N 3.44Å; S110-Y114 PolarHBondContact O-N 3.31Å
111R97.5Very high95.3Very high31 Ų3138.3 Ų38.312%0.11719%0.188CC..Hα-helixtrans-61.6-44.2172.8173.3-153.356157.9-2.7110.8V107 H108 L113 Y114 E115 Q172V107-R111 WeakPolarHBondContact O-CB 3.43Å; V107-R111 PolarHBondContact O-N 2.92Å; H108-R111 PolarHBondContact CE1-NH2 2.77Å; H108-R111 PolarHBondContact ND1-NH2 2.7Å; R111-L113 VanDerWaalsContact C-N 3.29Å; R111-L113 PolarHBondContact O-N 3.48Å; R111-Y114 WeakPolarHBondContact O-CB 3.34Å; R111-Y114 PolarHBondContact O-N 3.2Å; R111-Y114 VanDerWaalsContact O-N 3.16Å; R111-E115 WeakPolarHBondContact CD-OE1 3.41Å; R111-E115 HydrophobicContact CG-CG 4.36Å; R111-E115 WeakPolarHBondContact CG-OE1 3.34Å; R111-E115 IonicContact CZ-OE1 2.66Å; R111-E115 IonicContact NE-OE1 3.37Å; R111-E115 IonicContact NH1-OE1 3.92Å; R111-E115 WeakPolarHBondContact O-CG 3.38Å; R111-E115 PolarHBondContact O-N 3.19Å; R111-Q172 PolarHBondContact NH1-O 3.44Å
112R96.4Very high94.5Very high4 Ų441.1 Ų41.12%0.01520%0.2CC..Hα-helixtrans-58-40.5174.8-81.6-74.2110.288.812113.1Y72 H108 V109 E115 C116 Q175 E220Y72-R112 HydrophobicContact CD1-CB 3.28Å; Y72-R112 HydrophobicContact CD1-CG 3.99Å; Y72-R112 HydrophobicContact CD2-CB 4.29Å; Y72-R112 HydrophobicContact CE1-CB 3.26Å; Y72-R112 HydrophobicContact CE1-CG 3.5Å; Y72-R112 HydrophobicContact CE2-CB 4.31Å; Y72-R112 HydrophobicContact CG-CB 3.8Å; Y72-R112 WeakPolarHBondContact OH-CD 3.36Å; H108-R112 WeakPolarHBondContact O-CB 3.29Å; H108-R112 WeakPolarHBondContact O-CG 3.2Å; H108-R112 PolarHBondContact O-N 3.49Å; V109-R112 WeakPolarHBondContact O-CB 3.21Å; V109-R112 PolarHBondContact O-N 2.95Å; R112-E115 IonicContact CZ-OE2 4Å; R112-E115 VanDerWaalsContact CZ-OE2 3.28Å; R112-E115 IonicContact NE-OE2 3.3Å; R112-E115 PolarHBondContact NE-OE2 3.3Å; R112-E115 IonicContact NH2-OE1 3.87Å; R112-E115 PolarHBondContact NH2-OE1 3.33Å; R112-E115 IonicContact NH2-OE2 2.75Å; R112-E115 PolarHBondContact NH2-OE2 3.11Å; R112-E115 PolarHBondContact O-N 3.13Å; R112-C116 PolarHBondContact O-N 2.78Å; R112-C116 PolarHBondContact O-SG 2.71Å; R112-C116 VanDerWaalsContact O-SG 3.33Å; R112-Q175 VanDerWaalsContact CZ-CD 3.45Å; R112-Q175 VanDerWaalsContact NH2-CG 3.3Å; R112-E220 IonicContact CZ-OE2 3.35Å; R112-E220 IonicContact NH1-OE1 3.92Å; R112-E220 IonicContact NH1-OE2 3.61Å; R112-E220 PolarHBondContact NH1-OE2 3.27Å
113L96.8Very high93.4Very high39 Ų3943.6 Ų43.620%0.20422%0.217CC..Hα-helixtrans-62.3-48174.1179.956000110.7K69 I73 V76 V109 S110 R111 E115 C116 E117K69-L113 HydrophobicContact CB-CD1 4.35Å; I73-L113 HydrophobicContact CD1-CD1 4.5Å; I73-L113 HydrophobicContact CG1-CD1 3.76Å; I73-L113 HydrophobicContact CG1-CD2 4.09Å; V76-L113 HydrophobicContact CG2-CD2 4.18Å; V109-L113 PolarHBondContact O-N 2.91Å; S110-L113 WeakPolarHBondContact O-CB 3.32Å; S110-L113 PolarHBondContact O-N 3.44Å; R111-L113 VanDerWaalsContact C-N 3.29Å; R111-L113 PolarHBondContact O-N 3.48Å; L113-E115 PolarHBondContact O-N 3.08Å; L113-C116 WeakPolarHBondContact O-CB 3.32Å; L113-C116 PolarHBondContact O-N 3.48Å; L113-C116 VanDerWaalsContact O-N 3.14Å; L113-E117 HydrophobicContact CD1-CG 4.24Å; L113-E117 PolarHBondContact O-N 3.42Å
114Y96.9Very high92.4Very high105 Ų10548.1 Ų48.141%0.41224%0.242SC..Hα-helixtrans-57.8-46.9175.4169-90.3000112.2S110 R111 C116 E117 Y118 V119S110-Y114 PolarHBondContact O-N 3.31Å; R111-Y114 WeakPolarHBondContact O-CB 3.34Å; R111-Y114 PolarHBondContact O-N 3.2Å; R111-Y114 VanDerWaalsContact O-N 3.16Å; Y114-C116 PolarHBondContact O-N 2.84Å; Y114-E117 PolarHBondContact O-N 3.24Å; Y114-Y118 AromaticContact CD2-CD2 3.41Å; Y114-Y118 HydrophobicContact CD2-CD2 3.41Å; Y114-Y118 VanDerWaalsContact CD2-CD2 3.41Å; Y114-Y118 HydrophobicContact CD2-CE2 4.09Å; Y114-Y118 HydrophobicContact CD2-CG 4.19Å; Y114-Y118 AromaticContact CE2-CD2 3.72Å; Y114-Y118 HydrophobicContact CE2-CD2 3.72Å; Y114-Y118 HydrophobicContact CE2-CG 4.06Å; Y114-Y118 HydrophobicContact CG-CD2 4.16Å; Y114-Y118 PolarHBondContact O-N 3.39Å; Y114-V119 HydrophobicContact CD1-CG2 4.3Å; Y114-V119 HydrophobicContact CE1-CG2 3.74Å
115E94.2Very high91.4Very high3 Ų348 Ų481%0.01424%0.243CC..Iπ-helixtrans-59.8-35.2176.9-74.2169.8-173.400111.5R111 R112 L113 V119 S120 D176 F179R111-E115 WeakPolarHBondContact CD-OE1 3.41Å; R111-E115 HydrophobicContact CG-CG 4.36Å; R111-E115 WeakPolarHBondContact CG-OE1 3.34Å; R111-E115 IonicContact CZ-OE1 2.66Å; R111-E115 IonicContact NE-OE1 3.37Å; R111-E115 IonicContact NH1-OE1 3.92Å; R111-E115 WeakPolarHBondContact O-CG 3.38Å; R111-E115 PolarHBondContact O-N 3.19Å; R112-E115 IonicContact CZ-OE2 4Å; R112-E115 VanDerWaalsContact CZ-OE2 3.28Å; R112-E115 IonicContact NE-OE2 3.3Å; R112-E115 PolarHBondContact NE-OE2 3.3Å; R112-E115 IonicContact NH2-OE1 3.87Å; R112-E115 PolarHBondContact NH2-OE1 3.33Å; R112-E115 IonicContact NH2-OE2 2.75Å; R112-E115 PolarHBondContact NH2-OE2 3.11Å; R112-E115 PolarHBondContact O-N 3.13Å; L113-E115 PolarHBondContact O-N 3.08Å; E115-V119 CarbonylContact O-C 3.55Å; E115-V119 WeakPolarHBondContact O-CB 3.25Å; E115-V119 PolarHBondContact O-N 3.31Å; E115-S120 VanDerWaalsContact O-CB 3.28Å; E115-S120 WeakPolarHBondContact O-CB 3.3Å; E115-S120 PolarHBondContact O-N 3.24Å; E115-S120 PolarHBondContact O-OG 2.92Å; E115-D176 WeakPolarHBondContact OE1-CA 3.44Å; E115-F179 WeakPolarHBondContact OE2-CD2 3.31Å
116C92.8Very high90.6Very high12 Ų1251 Ų518%0.08126%0.257CS..Iπ-helixtrans-71.9-43.3176.2-74.20000113Y72 R112 L113 Y114 F122Y72-C116 HydrophobicContact CD2-CB 4.38Å; Y72-C116 VanDerWaalsContact CD2-SG 3.57Å; Y72-C116 WeakPolarHBondContact CE2-SG 3.45Å; R112-C116 PolarHBondContact O-N 2.78Å; R112-C116 PolarHBondContact O-SG 2.71Å; R112-C116 VanDerWaalsContact O-SG 3.33Å; L113-C116 WeakPolarHBondContact O-CB 3.32Å; L113-C116 PolarHBondContact O-N 3.48Å; L113-C116 VanDerWaalsContact O-N 3.14Å; Y114-C116 PolarHBondContact O-N 2.84Å; C116-F122 HydrophobicContact CB-CZ 4.38Å; C116-F122 WeakPolarHBondContact O-CE2 3.25Å
117E91.9Very high89.9Confident85 Ų8549.7 Ų49.740%0.39725%0.25SS..Iπ-helixtrans-76.1-39.6-176.7-69-6013500112.8K69 L113 Y114K69-E117 WeakPolarHBondContact CB-OE1 3.28Å; K69-E117 WeakPolarHBondContact CD-OE1 3.2Å; K69-E117 IonicContact NZ-OE1 3.96Å; L113-E117 HydrophobicContact CD1-CG 4.24Å; L113-E117 PolarHBondContact O-N 3.42Å; Y114-E117 PolarHBondContact O-N 3.24Å
118Y92.5Very high89.3Confident178 Ų17847.8 Ų47.870%0.69824%0.239SC*.Iπ-helixtrans-117.5-21.7-165.1-58.6-73.1000114.7Y114Y114-Y118 AromaticContact CD2-CD2 3.41Å; Y114-Y118 HydrophobicContact CD2-CD2 3.41Å; Y114-Y118 VanDerWaalsContact CD2-CD2 3.41Å; Y114-Y118 HydrophobicContact CD2-CE2 4.09Å; Y114-Y118 HydrophobicContact CD2-CG 4.19Å; Y114-Y118 AromaticContact CE2-CD2 3.72Å; Y114-Y118 HydrophobicContact CE2-CD2 3.72Å; Y114-Y118 HydrophobicContact CE2-CG 4.06Å; Y114-Y118 HydrophobicContact CG-CD2 4.16Å; Y114-Y118 PolarHBondContact O-N 3.39Å
119V90.4Very high88.7Confident17 Ų1751.3 Ų51.310%0.10326%0.255CS..Iπ-helixtrans-104.3-43.4-178.2-177.30000111.1Y114 E115 I121 R180 A183Y114-V119 HydrophobicContact CD1-CG2 4.3Å; Y114-V119 HydrophobicContact CE1-CG2 3.74Å; E115-V119 CarbonylContact O-C 3.55Å; E115-V119 WeakPolarHBondContact O-CB 3.25Å; E115-V119 PolarHBondContact O-N 3.31Å; V119-I121 PolarHBondContact O-N 2.98Å; V119-R180 HydrophobicContact CG1-CB 4.48Å; V119-R180 HydrophobicContact CG1-CG 3.82Å; V119-A183 HydrophobicContact CG1-CB 3.97Å; V119-A183 WeakPolarHBondContact O-CB 3.39Å
120S86.6Confident88.2Confident35 Ų3556.9 Ų56.925%0.24528%0.282CS..  trans-78.5115.5-170-64.90000112.6E115 F122E115-S120 VanDerWaalsContact O-CB 3.28Å; E115-S120 WeakPolarHBondContact O-CB 3.3Å; E115-S120 PolarHBondContact O-N 3.24Å; E115-S120 PolarHBondContact O-OG 2.92Å; S120-F122 PolarHBondContact O-N 3.48Å
121I84.1Confident87.6Confident75 Ų7555.4 Ų55.439%0.38527%0.27SS..  trans-85.996.5171.9-56.8176.2000108.6V119 R186V119-I121 PolarHBondContact O-N 2.98Å; I121-R186 HydrophobicContact CB-CB 3.97Å; I121-R186 HydrophobicContact CD1-CB 4.1Å; I121-R186 HydrophobicContact CG2-CB 4.06Å; I121-R186 WeakPolarHBondContact O-CD 3.1Å; I121-R186 PolarHBondContact O-NH1 2.95Å
122F79.8Confident87.3Confident60 Ų6055.3 Ų55.326%0.26327%0.27SS..  trans-75.1135.7179.2-66-81.9000112.3K65 R66 F68 C116 S120K65-F122 HydrophobicContact CB-CD1 4.25Å; K65-F122 HydrophobicContact CD-CD1 4.27Å; K65-F122 HydrophobicContact CG-CD1 3.95Å; K65-F122 HydrophobicContact CG-CE1 4.1Å; R66-F122 HydrophobicContact CB-CB 4.38Å; R66-F122 HydrophobicContact CB-CD2 4.19Å; R66-F122 HydrophobicContact CB-CG 4.2Å; F68-F122 HydrophobicContact CB-CZ 4.5Å; F68-F122 HydrophobicContact CD2-CE1 4.28Å; C116-F122 HydrophobicContact CB-CZ 4.38Å; C116-F122 WeakPolarHBondContact O-CE2 3.25Å; S120-F122 PolarHBondContact O-N 3.48Å
123S76Confident87.2Confident52 Ų5259.2 Ų59.236%0.36429%0.291SS..  trans-86.6177.1166.362.90000110.8S125S123-S125 PolarHBondContact O-N 3.22Å; S123-S125 PolarHBondContact OG-OG 2.85Å
124N75.8Confident87Confident169 Ų16958.4 Ų58.490%0.90429%0.286SS*.SBendtrans-65.115.8172.1-67.5-17.5000114.4
125S77.3Confident86.8Confident12 Ų1253.8 Ų53.88%0.08427%0.271CS..  trans-63.7145.4173.261.40000111.5K65 S123K65-S125 WeakPolarHBondContact CB-O 3.28Å; K65-S125 WeakPolarHBondContact CB-OG 3.31Å; K65-S125 VanDerWaalsContact CD-OG 3.23Å; K65-S125 WeakPolarHBondContact CD-OG 3.49Å; K65-S125 PolarHBondContact N-O 3.48Å; S123-S125 PolarHBondContact O-N 3.22Å; S123-S125 PolarHBondContact OG-OG 2.85Å
126Q82.4Confident86.9Confident63 Ų6355 Ų5529%0.29428%0.278SS..EExtended strand (participates in β ladder)trans-119161.4177.5-60.3173.1-33.800111R62 V63R62-Q126 HydrophobicContact CB-CB 3.91Å; R62-Q126 HydrophobicContact CB-CG 4.46Å; V63-Q126 CarbonylContact O-C 3.54Å; V63-Q126 VanDerWaalsContact O-CA 3.29Å; V63-Q126 WeakPolarHBondContact O-CA 3.34Å; V63-Q126 WeakPolarHBondContact O-CB 3.35Å
127M83.9Confident87.1Confident2 Ų255.5 Ų55.51%0.0128%0.284CS..EExtended strand (participates in β ladder)trans-122.5160.8169.268.7176.28600109.4F47 R62 V63 K65 F68 F71 H131 F132F47-M127 HydrophobicContact CB-CB 4.38Å; R62-M127 CarbonylContact C-O 3.59Å; R62-M127 VanDerWaalsContact CA-O 3.29Å; R62-M127 WeakPolarHBondContact CA-O 3.32Å; V63-M127 HydrophobicContact CG2-CG 3.62Å; V63-M127 HydrophobicContact CG2-SD 4.37Å; V63-M127 PolarHBondContact N-O 3.32Å; V63-M127 PolarHBondContact O-N 2.99Å; K65-M127 HydrophobicContact CG-CE 4.31Å; F68-M127 HydrophobicContact CB-CE 4.49Å; F68-M127 HydrophobicContact CD1-CE 3.96Å; F68-M127 HydrophobicContact CD2-CE 3.39Å; F68-M127 HydrophobicContact CE1-CE 3.95Å; F68-M127 HydrophobicContact CE2-CE 3.34Å; F68-M127 HydrophobicContact CG-CE 3.68Å; F68-M127 HydrophobicContact CZ-CE 3.62Å; F68-M127 HydrophobicContact CZ-SD 4.38Å; F71-M127 HydrophobicContact CE2-SD 4.37Å; F71-M127 HydrophobicContact CZ-CE 4.32Å; F71-M127 HydrophobicContact CZ-SD 3.75Å; M127-H131 HydrophobicContact CB-CB 4.44Å; M127-H131 HydrophobicContact SD-CB 4.4Å; M127-F132 HydrophobicContact SD-CB 4.45Å
128S85.8Confident87.3Confident14 Ų1452 Ų5210%0.09827%0.268CS..EExtended strand (participates in β ladder)trans-68.8150.9173.554.80000111.9H43 L61 M130 H131 F132H43-S128 VanDerWaalsContact O-CB 3.3Å; H43-S128 WeakPolarHBondContact O-CB 3.14Å; H43-S128 PolarHBondContact O-OG 3.49Å; L61-S128 CarbonylContact O-C 3.56Å; S128-M130 PolarHBondContact O-N 2.9Å; S128-H131 WeakPolarHBondContact O-CA 3.4Å; S128-H131 VanDerWaalsContact O-CB 3.3Å; S128-H131 WeakPolarHBondContact O-CB 3.25Å; S128-H131 PolarHBondContact O-N 3.42Å; S128-H131 PolarHBondContact OG-N 2.86Å; S128-H131 PolarHBondContact OG-ND1 3.09Å; S128-F132 PolarHBondContact O-N 2.87Å
129F86.7Confident87.6Confident75 Ų7544.3 Ų44.333%0.32924%0.238SC..Hα-helixtrans-62.9-31.1174.8-176.8-110.9000111.3L61 V63 F132 L133L61-F129 HydrophobicContact CB-CB 4.47Å; L61-F129 VanDerWaalsContact O-CB 3.23Å; L61-F129 WeakPolarHBondContact O-CB 3.48Å; L61-F129 PolarHBondContact O-N 3.02Å; V63-F129 HydrophobicContact CG1-CB 4.44Å; V63-F129 HydrophobicContact CG1-CD2 3.89Å; F129-F132 HydrophobicContact CD2-CB 4.44Å; F129-F132 HydrophobicContact CD2-CD1 4.09Å; F129-F132 AromaticContact CE2-CD1 3.89Å; F129-F132 HydrophobicContact CE2-CD1 3.89Å; F129-F132 HydrophobicContact CE2-CE1 4.44Å; F129-F132 CarbonylContact O-C 3.44Å; F129-F132 WeakPolarHBondContact O-CA 3.34Å; F129-F132 VanDerWaalsContact O-CB 3.31Å; F129-F132 WeakPolarHBondContact O-CB 3.25Å; F129-F132 PolarHBondContact O-N 3.44Å; F129-F132 VanDerWaalsContact O-N 3.08Å; F129-L133 HydrophobicContact CD1-CD1 3.99Å; F129-L133 HydrophobicContact CD1-CG 4.23Å; F129-L133 HydrophobicContact CE1-CD1 3.58Å; F129-L133 HydrophobicContact CE1-CD2 4.17Å; F129-L133 HydrophobicContact CE1-CG 3.85Å; F129-L133 HydrophobicContact CZ-CD1 4.21Å; F129-L133 HydrophobicContact CZ-CD2 3.93Å; F129-L133 HydrophobicContact CZ-CG 4.04Å; F129-L133 PolarHBondContact O-N 3.28Å
130M85.6Confident87.9Confident116 Ų11647.5 Ų47.557%0.57125%0.254SS*.Hα-helixtrans-62.6-40.9171.2-65-58.6-179.400112S128 F132 L133 M134S128-M130 PolarHBondContact O-N 2.9Å; M130-F132 VanDerWaalsContact C-N 3.27Å; M130-F132 PolarHBondContact O-N 2.83Å; M130-L133 PolarHBondContact O-N 3.23Å; M130-L133 HydrophobicContact SD-CD1 4.46Å; M130-M134 VanDerWaalsContact O-CB 3.27Å; M130-M134 WeakPolarHBondContact O-CB 3.41Å; M130-M134 PolarHBondContact O-N 3.44Å
131H87.4Confident88.4Confident16 Ų1646.7 Ų46.77%0.07425%0.247CC..Hα-helixtrans-61.8-37.9170.6-88.758.8000111.8F44 F47 M127 S128 G135F44-H131 VanDerWaalsContact C-CE1 3.43Å; F44-H131 AromaticContact CD1-CE1 3.6Å; F44-H131 AromaticContact CD2-CE1 3.65Å; F44-H131 AromaticContact CD2-ND1 3.84Å; F44-H131 AromaticContact CE1-CE1 3.68Å; F44-H131 AromaticContact CE2-CE1 3.72Å; F44-H131 AromaticContact CE2-ND1 3.96Å; F44-H131 AromaticContact CG-CE1 3.59Å; F44-H131 AromaticContact CZ-CE1 3.73Å; F44-H131 PolarHBondContact O-CE1 2.67Å; F44-H131 PolarHBondContact O-ND1 3.04Å; F44-H131 PolarHBondContact O-NE2 3.32Å; F47-H131 AromaticContact CE1-CD2 3.94Å; F47-H131 AromaticContact CE1-NE2 3.88Å; M127-H131 HydrophobicContact CB-CB 4.44Å; M127-H131 HydrophobicContact SD-CB 4.4Å; S128-H131 WeakPolarHBondContact O-CA 3.4Å; S128-H131 VanDerWaalsContact O-CB 3.3Å; S128-H131 WeakPolarHBondContact O-CB 3.25Å; S128-H131 PolarHBondContact O-N 3.42Å; S128-H131 PolarHBondContact OG-N 2.86Å; S128-H131 PolarHBondContact OG-ND1 3.09Å; H131-G135 PolarHBondContact O-N 3.41Å
132F90.9Very high89.1Confident29 Ų2943.1 Ų43.113%0.12723%0.229CC..Hα-helixtrans-62.9-46.5175.7-179.9-94.7000113.1V63 W67 Y70 F71 M127 S128 F129 M130 G135 N136V63-F132 HydrophobicContact CG2-CB 3.76Å; V63-F132 HydrophobicContact CG2-CD2 4.23Å; V63-F132 HydrophobicContact CG2-CG 4.14Å; W67-F132 HydrophobicContact CB-CD2 4.04Å; W67-F132 HydrophobicContact CB-CE2 3.91Å; W67-F132 HydrophobicContact CD2-CE2 4.45Å; W67-F132 AromaticContact CE3-CD2 3.99Å; W67-F132 HydrophobicContact CE3-CD2 3.99Å; W67-F132 HydrophobicContact CE3-CE1 4.49Å; W67-F132 AromaticContact CE3-CE2 3.78Å; W67-F132 HydrophobicContact CE3-CE2 3.78Å; W67-F132 HydrophobicContact CE3-CG 4.49Å; W67-F132 HydrophobicContact CE3-CZ 4.04Å; Y70-F132 HydrophobicContact CD2-CE2 4.18Å; F71-F132 HydrophobicContact CD1-CD2 4.27Å; F71-F132 HydrophobicContact CD1-CE2 4.29Å; F71-F132 HydrophobicContact CE1-CB 4.27Å; F71-F132 AromaticContact CE1-CD2 3.35Å; F71-F132 HydrophobicContact CE1-CD2 3.35Å; F71-F132 AromaticContact CE1-CE2 3.79Å; F71-F132 HydrophobicContact CE1-CE2 3.79Å; F71-F132 AromaticContact CE1-CG 3.99Å; F71-F132 HydrophobicContact CE1-CG 3.99Å; F71-F132 VanDerWaalsContact CE1-O 3.28Å; F71-F132 WeakPolarHBondContact CE1-O 3.43Å; F71-F132 HydrophobicContact CZ-CB 4.43Å; F71-F132 HydrophobicContact CZ-CD2 4.08Å; M127-F132 HydrophobicContact SD-CB 4.45Å; S128-F132 PolarHBondContact O-N 2.87Å; F129-F132 HydrophobicContact CD2-CB 4.44Å; F129-F132 HydrophobicContact CD2-CD1 4.09Å; F129-F132 AromaticContact CE2-CD1 3.89Å; F129-F132 HydrophobicContact CE2-CD1 3.89Å; F129-F132 HydrophobicContact CE2-CE1 4.44Å; F129-F132 CarbonylContact O-C 3.44Å; F129-F132 WeakPolarHBondContact O-CA 3.34Å; F129-F132 VanDerWaalsContact O-CB 3.31Å; F129-F132 WeakPolarHBondContact O-CB 3.25Å; F129-F132 PolarHBondContact O-N 3.44Å; F129-F132 VanDerWaalsContact O-N 3.08Å; M130-F132 VanDerWaalsContact C-N 3.27Å; M130-F132 PolarHBondContact O-N 2.83Å; F132-G135 PolarHBondContact O-N 3.4Å; F132-N136 WeakPolarHBondContact CE1-ND2 3.31Å; F132-N136 WeakPolarHBondContact CE2-ND2 3.31Å; F132-N136 VanDerWaalsContact CZ-ND2 3.26Å; F132-N136 WeakPolarHBondContact CZ-ND2 3.44Å; F132-N136 PolarHBondContact O-N 3.37Å; F132-N136 VanDerWaalsContact O-N 3.1Å; F132-N136 PolarHBondContact O-ND2 2.92Å
133L92.7Very high89.9Confident86 Ų8640.3 Ų40.345%0.4522%0.216SC..Hα-helixtrans-64.9-46.2176.1-69.6178.7000111.9F129 M130 G135 N136 G137F129-L133 HydrophobicContact CD1-CD1 3.99Å; F129-L133 HydrophobicContact CD1-CG 4.23Å; F129-L133 HydrophobicContact CE1-CD1 3.58Å; F129-L133 HydrophobicContact CE1-CD2 4.17Å; F129-L133 HydrophobicContact CE1-CG 3.85Å; F129-L133 HydrophobicContact CZ-CD1 4.21Å; F129-L133 HydrophobicContact CZ-CD2 3.93Å; F129-L133 HydrophobicContact CZ-CG 4.04Å; F129-L133 PolarHBondContact O-N 3.28Å; M130-L133 PolarHBondContact O-N 3.23Å; M130-L133 HydrophobicContact SD-CD1 4.46Å; L133-G135 VanDerWaalsContact C-N 3.32Å; L133-G135 PolarHBondContact O-N 3.33Å; L133-N136 PolarHBondContact O-N 3.05Å; L133-G137 PolarHBondContact O-N 2.93Å
134M92.7Very high90.9Very high22 Ų2239 Ų3911%0.10821%0.205CC..Hα-helixtrans-58.3-44.7177179.9175.87300111.5F16 L19 F44 M130 G137 F138 F244F16-M134 HydrophobicContact CE1-CG 4.27Å; L19-M134 HydrophobicContact CD1-CG 4.06Å; L19-M134 HydrophobicContact CD1-SD 4.29Å; F44-M134 HydrophobicContact CE2-SD 4.47Å; F44-M134 HydrophobicContact CZ-CE 4.11Å; F44-M134 HydrophobicContact CZ-SD 3.94Å; M130-M134 VanDerWaalsContact O-CB 3.27Å; M130-M134 WeakPolarHBondContact O-CB 3.41Å; M130-M134 PolarHBondContact O-N 3.44Å; M134-G137 PolarHBondContact O-N 2.94Å; M134-F138 VanDerWaalsContact O-CB 3.31Å; M134-F138 WeakPolarHBondContact O-CB 3.48Å; M134-F138 PolarHBondContact O-N 2.89Å; M134-F244 HydrophobicContact CE-CE2 4.43Å; M134-F244 HydrophobicContact CE-CZ 3.89Å; M134-F244 HydrophobicContact CG-CE2 4.33Å; M134-F244 HydrophobicContact CG-CZ 3.85Å; M134-F244 HydrophobicContact SD-CE2 3.65Å; M134-F244 HydrophobicContact SD-CZ 3.53Å; M134-F244 VanDerWaalsContact SD-CZ 3.53Å
135G93.9Very high91.9Very high9 Ų931 Ų319%0.09316%0.162CC..Hα-helixtrans-59.5-52176.400000112.3H131 F132 L133 G137 F138 Y139H131-G135 PolarHBondContact O-N 3.41Å; F132-G135 PolarHBondContact O-N 3.4Å; L133-G135 VanDerWaalsContact C-N 3.32Å; L133-G135 PolarHBondContact O-N 3.33Å; G135-G137 PolarHBondContact O-N 3.13Å; G135-F138 WeakPolarHBondContact O-CB 3.47Å; G135-F138 PolarHBondContact O-N 2.67Å; G135-Y139 VanDerWaalsContact O-CD2 3.23Å; G135-Y139 WeakPolarHBondContact O-CD2 3.36Å; G135-Y139 PolarHBondContact O-N 3.09Å; G135-Y139 VanDerWaalsContact O-N 3.09Å
136N95.5Very high92.8Very high28 Ų2830.4 Ų30.415%0.1516%0.158CC..Hα-helixtrans-60.5-44.4177.6-79.4-79.8000112.5F71 T74 F132 L133 F138 Y139 L140F71-N136 WeakPolarHBondContact CD1-ND2 3.46Å; F71-N136 WeakPolarHBondContact CE1-ND2 3.45Å; T74-N136 PolarHBondContact OG1-OD1 3.35Å; T74-N136 VanDerWaalsContact OG1-OD1 3.08Å; F132-N136 WeakPolarHBondContact CE1-ND2 3.31Å; F132-N136 WeakPolarHBondContact CE2-ND2 3.31Å; F132-N136 VanDerWaalsContact CZ-ND2 3.26Å; F132-N136 WeakPolarHBondContact CZ-ND2 3.44Å; F132-N136 PolarHBondContact O-N 3.37Å; F132-N136 VanDerWaalsContact O-N 3.1Å; F132-N136 PolarHBondContact O-ND2 2.92Å; L133-N136 PolarHBondContact O-N 3.05Å; N136-F138 VanDerWaalsContact C-N 3.28Å; N136-F138 PolarHBondContact O-N 2.92Å; N136-Y139 PolarHBondContact O-N 3.37Å; N136-L140 WeakPolarHBondContact O-CB 3.35Å; N136-L140 PolarHBondContact O-N 2.97Å
137G96.8Very high93.4Very high22 Ų2227.6 Ų27.623%0.22715%0.145CC..Hα-helixtrans-59.4-40.2176.100000112.2L133 M134 G135 L140 I141L133-G137 PolarHBondContact O-N 2.93Å; M134-G137 PolarHBondContact O-N 2.94Å; G135-G137 PolarHBondContact O-N 3.13Å; G137-L140 PolarHBondContact O-N 3.39Å; G137-I141 WeakPolarHBondContact O-CB 3.35Å; G137-I141 WeakPolarHBondContact O-CG1 3.36Å; G137-I141 PolarHBondContact O-N 3.18Å
138F97.4Very high93.8Very high12 Ų1228.1 Ų28.15%0.05315%0.147CC..Hα-helixtrans-62.6-49.2179.5174.7-95.2000111F16 M134 G135 N136 L140 I141 T142 Y224 I241 F244 T245F16-F138 HydrophobicContact CD1-CB 4.28Å; F16-F138 AromaticContact CD1-CD2 3.93Å; F16-F138 HydrophobicContact CD1-CD2 3.93Å; F16-F138 HydrophobicContact CE1-CB 3.54Å; F16-F138 HydrophobicContact CE1-CD2 4.06Å; F16-F138 HydrophobicContact CE1-CG 4.31Å; F16-F138 HydrophobicContact CG-CD2 4.43Å; F16-F138 HydrophobicContact CZ-CB 3.79Å; M134-F138 VanDerWaalsContact O-CB 3.31Å; M134-F138 WeakPolarHBondContact O-CB 3.48Å; M134-F138 PolarHBondContact O-N 2.89Å; G135-F138 WeakPolarHBondContact O-CB 3.47Å; G135-F138 PolarHBondContact O-N 2.67Å; N136-F138 VanDerWaalsContact C-N 3.28Å; N136-F138 PolarHBondContact O-N 2.92Å; F138-L140 VanDerWaalsContact C-N 3.3Å; F138-L140 PolarHBondContact O-N 3.04Å; F138-I141 PolarHBondContact O-N 3.37Å; F138-T142 WeakPolarHBondContact O-CB 3.34Å; F138-T142 PolarHBondContact O-N 2.99Å; F138-T142 PolarHBondContact O-OG1 2.95Å; F138-Y224 HydrophobicContact CE1-CE1 4.25Å; F138-Y224 AromaticContact CE1-CZ 3.96Å; F138-Y224 WeakPolarHBondContact CE1-OH 3.47Å; F138-Y224 AromaticContact CZ-CE1 3.58Å; F138-Y224 HydrophobicContact CZ-CE1 3.58Å; F138-Y224 AromaticContact CZ-CZ 3.68Å; F138-Y224 WeakPolarHBondContact CZ-OH 3.23Å; F138-I241 HydrophobicContact CD2-CG2 4.35Å; F138-I241 HydrophobicContact CE2-CG2 3.45Å; F138-I241 VanDerWaalsContact CE2-CG2 3.45Å; F138-I241 HydrophobicContact CZ-CG2 3.74Å; F138-F244 AromaticContact CD2-CD1 3.42Å; F138-F244 HydrophobicContact CD2-CD1 3.42Å; F138-F244 VanDerWaalsContact CD2-CD1 3.42Å; F138-F244 AromaticContact CD2-CE1 3.58Å; F138-F244 HydrophobicContact CD2-CE1 3.58Å; F138-F244 AromaticContact CE2-CD1 3.47Å; F138-F244 HydrophobicContact CE2-CD1 3.47Å; F138-F244 VanDerWaalsContact CE2-CD1 3.47Å; F138-F244 AromaticContact CE2-CE1 3.95Å; F138-F244 HydrophobicContact CE2-CE1 3.95Å; F138-F244 HydrophobicContact CG-CD1 4.45Å; F138-F244 HydrophobicContact CG-CE1 4.2Å; F138-T245 WeakPolarHBondContact CZ-OG1 3.46Å
139Y97.6Very high94.3Very high16 Ų1627.5 Ų27.56%0.06314%0.143CC..Hα-helixtrans-69.4-27.9-179.8-77.9-77.3000113.1F71 Y72 S78 Y105 V109 G135 N136 P143F71-Y139 HydrophobicContact CB-CD2 3.53Å; F71-Y139 HydrophobicContact CB-CE2 3.71Å; F71-Y139 HydrophobicContact CB-CG 4.42Å; F71-Y139 HydrophobicContact CD2-CE2 4.25Å; F71-Y139 HydrophobicContact CG-CD2 4.34Å; F71-Y139 HydrophobicContact CG-CE2 4.41Å; F71-Y139 VanDerWaalsContact O-CB 3.3Å; F71-Y139 WeakPolarHBondContact O-CB 3.18Å; Y72-Y139 AromaticContact CD1-CE1 3.83Å; Y72-Y139 HydrophobicContact CD1-CE1 3.83Å; Y72-Y139 HydrophobicContact CD1-CE2 4.35Å; Y72-Y139 AromaticContact CD1-CZ 3.76Å; Y72-Y139 AromaticContact CE1-CE1 3.88Å; Y72-Y139 HydrophobicContact CE1-CE1 3.88Å; Y72-Y139 HydrophobicContact CE1-CE2 4.11Å; Y72-Y139 AromaticContact CE1-CZ 3.42Å; Y72-Y139 VanDerWaalsContact CE1-CZ 3.42Å; Y72-Y139 WeakPolarHBondContact CE1-OH 3.49Å; S78-Y139 PolarHBondContact OG-O 3.42Å; S78-Y139 VanDerWaalsContact OG-O 3.04Å; Y105-Y139 WeakPolarHBondContact OH-CD1 3.44Å; V109-Y139 HydrophobicContact CG1-CD1 3.95Å; V109-Y139 HydrophobicContact CG1-CE1 3.95Å; G135-Y139 VanDerWaalsContact O-CD2 3.23Å; G135-Y139 WeakPolarHBondContact O-CD2 3.36Å; G135-Y139 PolarHBondContact O-N 3.09Å; G135-Y139 VanDerWaalsContact O-N 3.09Å; N136-Y139 PolarHBondContact O-N 3.37Å; Y139-P143 WeakPolarHBondContact O-CD 3.44Å
140L97.2Very high94.5Very high85 Ų8525.5 Ų25.545%0.44514%0.135SC..Hα-helixtrans-71.1-45.6172.3-179.564000112.5T74 N136 G137 F138 P143T74-L140 HydrophobicContact CG2-CB 4.14Å; N136-L140 WeakPolarHBondContact O-CB 3.35Å; N136-L140 PolarHBondContact O-N 2.97Å; G137-L140 PolarHBondContact O-N 3.39Å; F138-L140 VanDerWaalsContact C-N 3.3Å; F138-L140 PolarHBondContact O-N 3.04Å; L140-P143 WeakPolarHBondContact O-CD 3.47Å
141I97.3Very high94.8Very high18 Ų1824.9 Ų24.99%0.09214%0.142CC..Hα-helixtrans-82-25-172.9-69.7166.1000111.7L12 P13 F16 G137 F138 I144 S145 I241L12-I141 HydrophobicContact CB-CD1 3.94Å; L12-I141 HydrophobicContact CB-CG1 4.24Å; L12-I141 HydrophobicContact CB-CG2 4.13Å; L12-I141 HydrophobicContact CD1-CG1 4.45Å; P13-I141 HydrophobicContact CB-CG2 4.44Å; P13-I141 HydrophobicContact CG-CG2 4.04Å; F16-I141 HydrophobicContact CD2-CB 4.5Å; F16-I141 HydrophobicContact CD2-CD1 4.5Å; F16-I141 HydrophobicContact CD2-CG2 4.26Å; F16-I141 HydrophobicContact CE2-CB 3.9Å; F16-I141 HydrophobicContact CE2-CD1 3.6Å; F16-I141 HydrophobicContact CE2-CG1 4.28Å; F16-I141 HydrophobicContact CE2-CG2 4.13Å; F16-I141 HydrophobicContact CZ-CD1 4.41Å; G137-I141 WeakPolarHBondContact O-CB 3.35Å; G137-I141 WeakPolarHBondContact O-CG1 3.36Å; G137-I141 PolarHBondContact O-N 3.18Å; F138-I141 PolarHBondContact O-N 3.37Å; I141-I144 WeakPolarHBondContact O-CB 3.38Å; I141-I144 PolarHBondContact O-N 2.7Å; I141-S145 WeakPolarHBondContact O-CB 3.32Å; I141-S145 PolarHBondContact O-N 3.37Å; I141-I241 HydrophobicContact CG2-CD1 4.24Å
142T98.3Very high95.1Very high0 Ų027.6 Ų27.60%016%0.157CC..Hα-helixtrans-56.1-55.1179.8-62.50000113.7Y105 F138 I144 S145 I146 Y224 F238 I241Y105-T142 HydrophobicContact CD1-CG2 4.43Å; Y105-T142 HydrophobicContact CD2-CG2 4.3Å; Y105-T142 HydrophobicContact CE1-CG2 3.74Å; Y105-T142 HydrophobicContact CE2-CG2 3.6Å; Y105-T142 WeakPolarHBondContact OH-CB 3.35Å; Y105-T142 VanDerWaalsContact OH-CG2 3.3Å; Y105-T142 WeakPolarHBondContact OH-CG2 3.49Å; F138-T142 WeakPolarHBondContact O-CB 3.34Å; F138-T142 PolarHBondContact O-N 2.99Å; F138-T142 PolarHBondContact O-OG1 2.95Å; T142-I144 VanDerWaalsContact C-N 3.29Å; T142-I144 PolarHBondContact O-N 3.42Å; T142-S145 WeakPolarHBondContact O-CB 3.41Å; T142-S145 PolarHBondContact O-N 3.14Å; T142-S145 VanDerWaalsContact O-N 3.1Å; T142-S145 PolarHBondContact O-OG 3.41Å; T142-I146 HydrophobicContact CG2-CD1 4.34Å; T142-I146 PolarHBondContact O-N 3.44Å; T142-I146 VanDerWaalsContact O-N 3.07Å; T142-Y224 HydrophobicContact CG2-CE1 4.31Å; T142-F238 HydrophobicContact CG2-CE2 3.94Å; T142-I241 HydrophobicContact CG2-CG2 3.96Å; T142-I241 WeakPolarHBondContact OG1-CG2 3.49Å
143P97.5Very high95.3Very high0 Ų027 Ų270%016%0.158CC..Hα-helixtrans-63.8-34.7178.325.4-33.5000112.5T79 V82 L102 Y139 L140 S145 I146 L147T79-P143 HydrophobicContact CG2-CB 4.37Å; V82-P143 HydrophobicContact CB-CB 4.05Å; V82-P143 HydrophobicContact CG1-CB 4.32Å; V82-P143 HydrophobicContact CG2-CB 4.01Å; V82-P143 HydrophobicContact CG2-CG 4.36Å; L102-P143 HydrophobicContact CD2-CB 4.16Å; Y139-P143 WeakPolarHBondContact O-CD 3.44Å; L140-P143 WeakPolarHBondContact O-CD 3.47Å; P143-S145 VanDerWaalsContact C-N 3.32Å; P143-S145 PolarHBondContact O-N 3.46Å; P143-I146 WeakPolarHBondContact O-CB 3.5Å; P143-I146 PolarHBondContact O-N 3.41Å; P143-L147 PolarHBondContact O-N 3.46Å
144I95.7Very high95.4Very high26 Ų2624.5 Ų24.513%0.13315%0.149CC..Hα-helixtrans-60.8-43.1172.9-62.2172.7000110.6L9 V82 I141 T142 I146 L147 L148L9-I144 HydrophobicContact CB-CG2 4.08Å; L9-I144 HydrophobicContact CD1-CG2 3.77Å; L9-I144 HydrophobicContact CG-CG2 4.49Å; V82-I144 HydrophobicContact CG2-CG1 4.13Å; I141-I144 WeakPolarHBondContact O-CB 3.38Å; I141-I144 PolarHBondContact O-N 2.7Å; T142-I144 VanDerWaalsContact C-N 3.29Å; T142-I144 PolarHBondContact O-N 3.42Å; I144-I146 VanDerWaalsContact C-N 3.3Å; I144-I146 PolarHBondContact O-N 3.08Å; I144-L147 PolarHBondContact O-N 3.19Å; I144-L148 HydrophobicContact CG2-CD1 3.84Å; I144-L148 HydrophobicContact CG2-CG 4.22Å; I144-L148 WeakPolarHBondContact O-CB 3.33Å; I144-L148 VanDerWaalsContact O-CG 3.29Å; I144-L148 WeakPolarHBondContact O-CG 3.35Å; I144-L148 PolarHBondContact O-N 2.89Å
145S97Very high95.5Very high0 Ų032.8 Ų32.80%019%0.188CC..Hα-helixtrans-66-31.8178.678.90000112.8I141 T142 P143 S149 F238 I241I141-S145 WeakPolarHBondContact O-CB 3.32Å; I141-S145 PolarHBondContact O-N 3.37Å; T142-S145 WeakPolarHBondContact O-CB 3.41Å; T142-S145 PolarHBondContact O-N 3.14Å; T142-S145 VanDerWaalsContact O-N 3.1Å; T142-S145 PolarHBondContact O-OG 3.41Å; P143-S145 VanDerWaalsContact C-N 3.32Å; P143-S145 PolarHBondContact O-N 3.46Å; S145-S149 WeakPolarHBondContact O-CB 3.4Å; S145-S149 PolarHBondContact O-N 2.86Å; S145-S149 PolarHBondContact O-OG 2.92Å; S145-F238 WeakPolarHBondContact OG-CD2 3.3Å; S145-I241 VanDerWaalsContact OG-CG1 3.28Å; S145-I241 WeakPolarHBondContact OG-CG1 3.44Å
146I96.9Very high95.6Very high0 Ų035.5 Ų35.50%020%0.195CC..Hα-helixtrans-64.3-50.4171.8-66.1164.8000109I98 V101 L102 Y105 T142 P143 I144 L148 S149 F238I98-I146 HydrophobicContact CD1-CG2 4.39Å; I98-I146 HydrophobicContact CG2-CG2 4.26Å; V101-I146 HydrophobicContact CB-CG2 4.21Å; V101-I146 HydrophobicContact CG1-CD1 3.92Å; V101-I146 HydrophobicContact CG1-CG1 4.15Å; V101-I146 HydrophobicContact CG1-CG2 3.72Å; L102-I146 HydrophobicContact CD2-CB 4.02Å; L102-I146 HydrophobicContact CD2-CD1 4.24Å; L102-I146 HydrophobicContact CD2-CG2 3.79Å; L102-I146 HydrophobicContact CG-CG2 3.87Å; Y105-I146 HydrophobicContact CD1-CD1 4.21Å; Y105-I146 HydrophobicContact CG-CD1 4.01Å; T142-I146 HydrophobicContact CG2-CD1 4.34Å; T142-I146 PolarHBondContact O-N 3.44Å; T142-I146 VanDerWaalsContact O-N 3.07Å; P143-I146 WeakPolarHBondContact O-CB 3.5Å; P143-I146 PolarHBondContact O-N 3.41Å; I144-I146 VanDerWaalsContact C-N 3.3Å; I144-I146 PolarHBondContact O-N 3.08Å; I146-L148 PolarHBondContact O-N 3.34Å; I146-S149 WeakPolarHBondContact O-CB 3.22Å; I146-S149 PolarHBondContact O-N 2.89Å; I146-F238 HydrophobicContact CD1-CD2 4.31Å; I146-F238 HydrophobicContact CD1-CE2 4Å; I146-F238 HydrophobicContact CG1-CD2 3.47Å; I146-F238 VanDerWaalsContact CG1-CD2 3.47Å; I146-F238 HydrophobicContact CG1-CE2 3.67Å; I146-F238 HydrophobicContact CG1-CG 4.38Å
147L94Very high95.7Very high4 Ų437.1 Ų37.12%0.02121%0.209CC..Hα-helixtrans-59.2-46177.8-177.166.6000112.1M1 F5 V82 E86 P143 I144 S149 Q150M1-L147 HydrophobicContact CE-CG 4.25Å; M1-L147 WeakPolarHBondContact CE-O 3.4Å; M1-L147 HydrophobicContact SD-CD2 4.27Å; M1-L147 HydrophobicContact SD-CG 4.11Å; F5-L147 HydrophobicContact CE1-CD2 4.33Å; V82-L147 HydrophobicContact CG1-CB 3.85Å; V82-L147 HydrophobicContact CG1-CD2 4.16Å; V82-L147 HydrophobicContact CG1-CG 4.45Å; E86-L147 HydrophobicContact CB-CD1 4.32Å; E86-L147 VanDerWaalsContact OE2-CD1 3.27Å; E86-L147 WeakPolarHBondContact OE2-CD1 3.35Å; P143-L147 PolarHBondContact O-N 3.46Å; I144-L147 PolarHBondContact O-N 3.19Å; L147-S149 PolarHBondContact O-N 3.39Å; L147-S149 VanDerWaalsContact O-N 3.08Å; L147-Q150 WeakPolarHBondContact O-CB 3.39Å; L147-Q150 PolarHBondContact O-N 3Å; L147-Q150 VanDerWaalsContact O-N 3.09Å
148L93.9Very high95.7Very high12 Ų1244.2 Ų44.26%0.06323%0.23CC..THydrogen-bonded Turntrans-63.9-13.7177-69.7171.7000113.7M1 V6 L9 P13 I144 I146M1-L148 HydrophobicContact SD-CD2 4.18Å; V6-L148 HydrophobicContact CG1-CD2 4.28Å; L9-L148 HydrophobicContact CB-CD1 4.07Å; P13-L148 HydrophobicContact CG-CD1 4.44Å; I144-L148 HydrophobicContact CG2-CD1 3.84Å; I144-L148 HydrophobicContact CG2-CG 4.22Å; I144-L148 WeakPolarHBondContact O-CB 3.33Å; I144-L148 VanDerWaalsContact O-CG 3.29Å; I144-L148 WeakPolarHBondContact O-CG 3.35Å; I144-L148 PolarHBondContact O-N 2.89Å; I146-L148 PolarHBondContact O-N 3.34Å
149S94.8Very high95.7Very high1 Ų149.6 Ų49.61%0.00726%0.258CS..THydrogen-bonded Turntrans-89.3-3.3177.9-58.10000113.4S145 I146 L147 S151 N152 A153 I236 F238S145-S149 WeakPolarHBondContact O-CB 3.4Å; S145-S149 PolarHBondContact O-N 2.86Å; S145-S149 PolarHBondContact O-OG 2.92Å; I146-S149 WeakPolarHBondContact O-CB 3.22Å; I146-S149 PolarHBondContact O-N 2.89Å; L147-S149 PolarHBondContact O-N 3.39Å; L147-S149 VanDerWaalsContact O-N 3.08Å; S149-S151 VanDerWaalsContact C-N 3.29Å; S149-S151 PolarHBondContact O-N 3.23Å; S149-N152 PolarHBondContact O-N 2.87Å; S149-N152 VanDerWaalsContact O-N 3.1Å; S149-A153 PolarHBondContact O-N 2.96Å; S149-I236 WeakPolarHBondContact OG-CD1 3.43Å; S149-F238 PolarHBondContact OG-N 3.37Å; S149-F238 VanDerWaalsContact OG-N 3.16Å
150Q92.5Very high95.7Very high34 Ų3451.2 Ų51.216%0.15927%0.27CS..G310 helixtrans-53.6-40.2-177.4-173.2-176.82800113.6M1 E86 L90 N95 I98 L147 N152 A153M1-Q150 HydrophobicContact CE-CB 4.48Å; E86-Q150 PolarHBondContact OE1-NE2 2.97Å; E86-Q150 PolarHBondContact OE2-NE2 2.83Å; L90-Q150 VanDerWaalsContact CD2-OE1 3.3Å; N95-Q150 HydrophobicContact CB-CG 3.91Å; N95-Q150 WeakPolarHBondContact ND2-CG 3.42Å; I98-Q150 HydrophobicContact CD1-CB 4.43Å; I98-Q150 HydrophobicContact CG1-CB 3.9Å; I98-Q150 HydrophobicContact CG1-CG 3.98Å; L147-Q150 WeakPolarHBondContact O-CB 3.39Å; L147-Q150 PolarHBondContact O-N 3Å; L147-Q150 VanDerWaalsContact O-N 3.09Å; Q150-N152 PolarHBondContact O-N 3.28Å; Q150-A153 WeakPolarHBondContact O-CB 3.47Å; Q150-A153 PolarHBondContact O-N 3.23Å
151S90.3Very high95.8Very high102 Ų10248.2 Ų48.271%0.71325%0.254SS*.G310 helixtrans-65-20.1-178.357.40000114.4S149S149-S151 VanDerWaalsContact C-N 3.29Å; S149-S151 PolarHBondContact O-N 3.23Å
152N93.9Very high95.8Very high73 Ų7349 Ų4939%0.3927%0.266SS..G310 helixtrans-113.72-180-71.8-78.4000112.7S149 Q150 T232 I236S149-N152 PolarHBondContact O-N 2.87Å; S149-N152 VanDerWaalsContact O-N 3.1Å; Q150-N152 PolarHBondContact O-N 3.28Å; N152-T232 WeakPolarHBondContact O-CB 3.43Å; N152-T232 PolarHBondContact O-OG1 3.46Å; N152-I236 HydrophobicContact CB-CG2 3.51Å
153A95.3Very high95.8Very high17 Ų1754.3 Ų54.314%0.1430%0.295CS..  trans-70.2132.2-178.400000110.4T97 I98 S149 Q150 I231T97-A153 HydrophobicContact CG2-CB 4.41Å; I98-A153 HydrophobicContact CD1-CB 3.9Å; I98-A153 HydrophobicContact CG1-CB 4.17Å; S149-A153 PolarHBondContact O-N 2.96Å; Q150-A153 WeakPolarHBondContact O-CB 3.47Å; Q150-A153 PolarHBondContact O-N 3.23Å; A153-I231 HydrophobicContact CB-CG2 3.88Å
154A95.6Very high95.9Very high33 Ų3355 Ų5527%0.27330%0.297SS..  trans-68.4141.5173.300000110.5T97 R156 I231T97-A154 WeakPolarHBondContact CB-O 3.26Å; T97-A154 PolarHBondContact OG1-O 3.29Å; A154-R156 PolarHBondContact O-N 3.35Å; A154-I231 PolarHBondContact N-O 3.19Å
155E94.6Very high96Very high196 Ų19655.9 Ų55.992%0.91630%0.304SS*.  trans-71109.8170.8-66.8-171.2-179.700109.7
156R96Very high96.1Very high66 Ų6659.8 Ų59.825%0.24933%0.328CS..  trans-95135.2-179.5-58.4-53.1-172.61750.5111T97 A154 V160 I161 L229 F230T97-R156 HydrophobicContact CG2-CG 3.79Å; T97-R156 WeakPolarHBondContact OG1-CG 3.36Å; T97-R156 PolarHBondContact OG1-N 2.89Å; A154-R156 PolarHBondContact O-N 3.35Å; R156-V160 HydrophobicContact CB-CB 4.48Å; R156-V160 HydrophobicContact CB-CG1 4.3Å; R156-V160 HydrophobicContact CG-CG1 4.38Å; R156-I161 HydrophobicContact CB-CD1 4.5Å; R156-I161 HydrophobicContact CB-CG1 4.06Å; R156-L229 PolarHBondContact NH2-O 3.33Å; R156-F230 HydrophobicContact CB-CE2 4.39Å; R156-F230 HydrophobicContact CB-CZ 4.08Å; R156-F230 HydrophobicContact CG-CE1 4.22Å; R156-F230 HydrophobicContact CG-CE2 4Å; R156-F230 HydrophobicContact CG-CZ 3.84Å; R156-F230 VanDerWaalsContact CZ-O 3.27Å; R156-F230 PolarHBondContact NE-O 3Å; R156-F230 PolarHBondContact NH2-O 2.87Å
157S97Very high96.2Very high63 Ų6363.6 Ų63.644%0.44135%0.345SS..  trans-69.8159.3170.7710000110.9L159 V160 I161S157-L159 PolarHBondContact O-N 3.35Å; S157-V160 PolarHBondContact O-N 2.99Å; S157-V160 VanDerWaalsContact O-N 3.12Å; S157-V160 WeakPolarHBondContact OG-CG2 3.41Å; S157-V160 PolarHBondContact OG-N 3.2Å; S157-I161 WeakPolarHBondContact O-CG1 3.46Å; S157-I161 PolarHBondContact O-N 3.16Å
158Y97.1Very high96.4Very high170 Ų17063.4 Ų63.467%0.66734%0.344SS*.Hα-helixtrans-59.7-34.4178-67.6-72.4000112.9K96 I161 G162K96-Y158 HydrophobicContact CD-CE1 3.86Å; K96-Y158 WeakPolarHBondContact CD-OH 3.07Å; K96-Y158 PolarHBondContact NZ-OH 2.81Å; Y158-I161 HydrophobicContact CD1-CD1 4.47Å; Y158-I161 PolarHBondContact O-N 3.16Å; Y158-G162 PolarHBondContact O-N 3.16Å
159L97.9Very high96.6Very high125 Ų12567 Ų6765%0.65436%0.363SS*.Hα-helixtrans-63.2-45174.8-179.1137.4000111.4S157 I161 G162 L163S157-L159 PolarHBondContact O-N 3.35Å; L159-I161 PolarHBondContact O-N 2.81Å; L159-G162 PolarHBondContact O-N 3.02Å; L159-L163 HydrophobicContact CD2-CD1 3.75Å; L159-L163 HydrophobicContact CD2-CG 4.44Å; L159-L163 WeakPolarHBondContact O-CG 3.23Å; L159-L163 PolarHBondContact O-N 3.43Å
160V98Very high96.8Very high51 Ų5171.4 Ų71.431%0.30939%0.386SS..Hα-helixtrans-66-38.1177.8175.30000111.3R156 S157 G162 L163 F164 F230R156-V160 HydrophobicContact CB-CB 4.48Å; R156-V160 HydrophobicContact CB-CG1 4.3Å; R156-V160 HydrophobicContact CG-CG1 4.38Å; S157-V160 PolarHBondContact O-N 2.99Å; S157-V160 VanDerWaalsContact O-N 3.12Å; S157-V160 WeakPolarHBondContact OG-CG2 3.41Å; S157-V160 PolarHBondContact OG-N 3.2Å; V160-G162 VanDerWaalsContact C-N 3.35Å; V160-L163 PolarHBondContact O-N 2.92Å; V160-F164 VanDerWaalsContact O-CB 3.27Å; V160-F164 WeakPolarHBondContact O-CB 3.31Å; V160-F164 PolarHBondContact O-N 2.81Å; V160-F230 HydrophobicContact CG1-CD2 4.46Å; V160-F230 HydrophobicContact CG1-CE2 3.9Å
161I98.2Very high97Very high21 Ų2170.6 Ų70.611%0.10838%0.382CS..Hα-helixtrans-61.4-42.5172.4-67.7161.7000111.2K96 S100 R156 S157 Y158 L159 F164 T165 F230K96-I161 HydrophobicContact CB-CD1 4.17Å; S100-I161 WeakPolarHBondContact OG-CG2 3.5Å; R156-I161 HydrophobicContact CB-CD1 4.5Å; R156-I161 HydrophobicContact CB-CG1 4.06Å; S157-I161 WeakPolarHBondContact O-CG1 3.46Å; S157-I161 PolarHBondContact O-N 3.16Å; Y158-I161 HydrophobicContact CD1-CD1 4.47Å; Y158-I161 PolarHBondContact O-N 3.16Å; L159-I161 PolarHBondContact O-N 2.81Å; I161-F164 PolarHBondContact O-N 2.66Å; I161-T165 WeakPolarHBondContact O-CB 3.23Å; I161-T165 PolarHBondContact O-N 3.38Å; I161-T165 PolarHBondContact O-OG1 2.92Å; I161-F230 HydrophobicContact CB-CZ 4.41Å; I161-F230 HydrophobicContact CG1-CZ 3.82Å
162G98.3Very high97.4Very high34 Ų3466 Ų6635%0.35135%0.35SS..Hα-helixtrans-62.4-49.2176.800000112.4Y158 L159 V160 F164 T165 V166Y158-G162 PolarHBondContact O-N 3.16Å; L159-G162 PolarHBondContact O-N 3.02Å; V160-G162 VanDerWaalsContact C-N 3.35Å; G162-F164 VanDerWaalsContact C-N 3.34Å; G162-F164 PolarHBondContact O-N 3.37Å; G162-T165 WeakPolarHBondContact O-CB 3.38Å; G162-T165 PolarHBondContact O-N 2.93Å; G162-V166 WeakPolarHBondContact O-CG2 3.49Å; G162-V166 PolarHBondContact O-N 3.26Å
163L98.4Very high97.6Very high113 Ų11369.5 Ų69.559%0.59236%0.359SS*.Hα-helixtrans-60.9-42.5176.8-68.2176.7000112L159 V160 V166 H167L159-L163 HydrophobicContact CD2-CD1 3.75Å; L159-L163 HydrophobicContact CD2-CG 4.44Å; L159-L163 WeakPolarHBondContact O-CG 3.23Å; L159-L163 PolarHBondContact O-N 3.43Å; V160-L163 PolarHBondContact O-N 2.92Å; L163-V166 PolarHBondContact O-N 3.36Å; L163-H167 WeakPolarHBondContact O-CB 3.39Å; L163-H167 PolarHBondContact O-N 2.71Å
164F98.5Very high97.7Very high13 Ų1371.1 Ų71.16%0.05737%0.365CS..Hα-helixtrans-61.2-45.5174.9169.1-106.7000112V101 M104 V160 I161 G162 V166 H167 M168 F227 F230V101-F164 HydrophobicContact CG2-CE1 4.48Å; V101-F164 HydrophobicContact CG2-CZ 4.45Å; M104-F164 HydrophobicContact CB-CE1 4.18Å; M104-F164 HydrophobicContact CG-CE1 3.84Å; V160-F164 VanDerWaalsContact O-CB 3.27Å; V160-F164 WeakPolarHBondContact O-CB 3.31Å; V160-F164 PolarHBondContact O-N 2.81Å; I161-F164 PolarHBondContact O-N 2.66Å; G162-F164 VanDerWaalsContact C-N 3.34Å; G162-F164 PolarHBondContact O-N 3.37Å; F164-V166 PolarHBondContact O-N 3.19Å; F164-H167 PolarHBondContact O-N 2.74Å; F164-M168 HydrophobicContact CD1-CG 4.35Å; F164-M168 HydrophobicContact CD2-CG 3.85Å; F164-M168 HydrophobicContact CD2-SD 4.36Å; F164-M168 HydrophobicContact CE1-CG 3.95Å; F164-M168 HydrophobicContact CE2-CG 3.39Å; F164-M168 HydrophobicContact CE2-SD 3.58Å; F164-M168 VanDerWaalsContact CE2-SD 3.58Å; F164-M168 HydrophobicContact CG-CG 4.3Å; F164-M168 HydrophobicContact CZ-CG 3.43Å; F164-M168 VanDerWaalsContact CZ-CG 3.43Å; F164-M168 HydrophobicContact CZ-SD 3.91Å; F164-M168 WeakPolarHBondContact O-CB 3.3Å; F164-M168 VanDerWaalsContact O-CG 3.25Å; F164-M168 WeakPolarHBondContact O-CG 3.48Å; F164-M168 PolarHBondContact O-N 3.3Å; F164-F227 HydrophobicContact CE2-CD1 4.36Å; F164-F227 AromaticContact CZ-CD1 3.67Å; F164-F227 HydrophobicContact CZ-CD1 3.67Å; F164-F227 AromaticContact CZ-CE1 3.88Å; F164-F227 HydrophobicContact CZ-CE1 3.88Å; F164-F230 HydrophobicContact CB-CD2 3.41Å; F164-F230 VanDerWaalsContact CB-CD2 3.41Å; F164-F230 HydrophobicContact CB-CE2 3.22Å; F164-F230 HydrophobicContact CB-CG 4.28Å; F164-F230 HydrophobicContact CB-CZ 3.99Å; F164-F230 AromaticContact CD1-CD1 3.97Å; F164-F230 HydrophobicContact CD1-CD1 3.97Å; F164-F230 AromaticContact CD1-CD2 3.88Å; F164-F230 HydrophobicContact CD1-CD2 3.88Å; F164-F230 AromaticContact CD1-CE1 3.84Å; F164-F230 HydrophobicContact CD1-CE1 3.84Å; F164-F230 AromaticContact CD1-CE2 3.75Å; F164-F230 HydrophobicContact CD1-CE2 3.75Å; F164-F230 AromaticContact CD1-CG 3.96Å; F164-F230 HydrophobicContact CD1-CG 3.96Å; F164-F230 AromaticContact CD1-CZ 3.72Å; F164-F230 HydrophobicContact CD1-CZ 3.72Å; F164-F230 HydrophobicContact CD2-CB 3.66Å; F164-F230 HydrophobicContact CD2-CD1 4.27Å; F164-F230 AromaticContact CD2-CD2 3.41Å; F164-F230 HydrophobicContact CD2-CD2 3.41Å; F164-F230 VanDerWaalsContact CD2-CD2 3.41Å; F164-F230 HydrophobicContact CD2-CE2 4.06Å; F164-F230 AromaticContact CD2-CG 3.51Å; F164-F230 HydrophobicContact CD2-CG 3.51Å; F164-F230 AromaticContact CE1-CD1 3.94Å; F164-F230 HydrophobicContact CE1-CD1 3.94Å; F164-F230 HydrophobicContact CE1-CE1 4.07Å; F164-F230 HydrophobicContact CE1-CG 4.15Å; F164-F230 HydrophobicContact CE1-CZ 4.41Å; F164-F230 HydrophobicContact CE2-CB 3.56Å; F164-F230 HydrophobicContact CE2-CD1 4.24Å; F164-F230 HydrophobicContact CE2-CD2 4.12Å; F164-F230 AromaticContact CE2-CG 3.72Å; F164-F230 HydrophobicContact CE2-CG 3.72Å; F164-F230 HydrophobicContact CG-CB 4.31Å; F164-F230 HydrophobicContact CG-CD1 4.14Å; F164-F230 AromaticContact CG-CD2 3.27Å; F164-F230 HydrophobicContact CG-CD2 3.27Å; F164-F230 HydrophobicContact CG-CE1 4.25Å; F164-F230 AromaticContact CG-CE2 3.41Å; F164-F230 HydrophobicContact CG-CE2 3.41Å; F164-F230 VanDerWaalsContact CG-CE2 3.41Å; F164-F230 AromaticContact CG-CG 3.64Å; F164-F230 HydrophobicContact CG-CG 3.64Å; F164-F230 AromaticContact CG-CZ 3.9Å; F164-F230 HydrophobicContact CG-CZ 3.9Å; F164-F230 HydrophobicContact CZ-CB 4.15Å; F164-F230 HydrophobicContact CZ-CD1 4.09Å; F164-F230 HydrophobicContact CZ-CG 4.04Å
165T98.5Very high97.7Very high46 Ų4669.7 Ų69.728%0.28235%0.352SS..Hα-helixtrans-57.6-48176.9-58.80000111.2M104 I161 G162 H167 M168 L169M104-T165 HydrophobicContact SD-CG2 3.98Å; I161-T165 WeakPolarHBondContact O-CB 3.23Å; I161-T165 PolarHBondContact O-N 3.38Å; I161-T165 PolarHBondContact O-OG1 2.92Å; G162-T165 WeakPolarHBondContact O-CB 3.38Å; G162-T165 PolarHBondContact O-N 2.93Å; T165-H167 PolarHBondContact O-N 3.49Å; T165-M168 PolarHBondContact O-N 3.01Å; T165-L169 HydrophobicContact CG2-CD1 4.06Å; T165-L169 HydrophobicContact CG2-CG 4.46Å; T165-L169 VanDerWaalsContact O-CG 3.27Å; T165-L169 WeakPolarHBondContact O-CG 3.14Å; T165-L169 PolarHBondContact O-N 3.5Å
166V98.5Very high97.8Very high82 Ų8261.4 Ų61.450%0.49731%0.314SS..Hα-helixtrans-60.2-47.3177.5173.30000111.2G162 L163 F164 M168 L169 I170G162-V166 WeakPolarHBondContact O-CG2 3.49Å; G162-V166 PolarHBondContact O-N 3.26Å; L163-V166 PolarHBondContact O-N 3.36Å; F164-V166 PolarHBondContact O-N 3.19Å; V166-M168 PolarHBondContact O-N 3.19Å; V166-L169 PolarHBondContact O-N 2.68Å; V166-I170 HydrophobicContact CG1-CD1 3.95Å; V166-I170 WeakPolarHBondContact O-CG1 3.28Å; V166-I170 PolarHBondContact O-N 3.39Å
167H98.4Very high97.8Very high79 Ų7960.8 Ų60.837%0.36632%0.316SS..Hα-helixtrans-57.4-46.5176.6171.970000112.4L163 F164 T165 L169 I170 L171 S226L163-H167 WeakPolarHBondContact O-CB 3.39Å; L163-H167 PolarHBondContact O-N 2.71Å; F164-H167 PolarHBondContact O-N 2.74Å; T165-H167 PolarHBondContact O-N 3.49Å; H167-L169 PolarHBondContact O-N 3.03Å; H167-I170 PolarHBondContact O-N 3.33Å; H167-L171 WeakPolarHBondContact NE2-CD1 3.43Å; H167-L171 PolarHBondContact O-N 2.95Å; H167-S226 PolarHBondContact NE2-OG 3.37Å
168M98.4Very high97.7Very high0 Ų057.8 Ų57.80%030%0.295CS..Hα-helixtrans-64.3-39.4178-68.5-56.4-64.100112.2M104 F164 T165 V166 L171 Q172 I223 S226 F227M104-M168 HydrophobicContact SD-CB 3.99Å; F164-M168 HydrophobicContact CD1-CG 4.35Å; F164-M168 HydrophobicContact CD2-CG 3.85Å; F164-M168 HydrophobicContact CD2-SD 4.36Å; F164-M168 HydrophobicContact CE1-CG 3.95Å; F164-M168 HydrophobicContact CE2-CG 3.39Å; F164-M168 HydrophobicContact CE2-SD 3.58Å; F164-M168 VanDerWaalsContact CE2-SD 3.58Å; F164-M168 HydrophobicContact CG-CG 4.3Å; F164-M168 HydrophobicContact CZ-CG 3.43Å; F164-M168 VanDerWaalsContact CZ-CG 3.43Å; F164-M168 HydrophobicContact CZ-SD 3.91Å; F164-M168 WeakPolarHBondContact O-CB 3.3Å; F164-M168 VanDerWaalsContact O-CG 3.25Å; F164-M168 WeakPolarHBondContact O-CG 3.48Å; F164-M168 PolarHBondContact O-N 3.3Å; T165-M168 PolarHBondContact O-N 3.01Å; V166-M168 PolarHBondContact O-N 3.19Å; M168-L171 PolarHBondContact O-N 3.11Å; M168-Q172 WeakPolarHBondContact O-CB 3.36Å; M168-Q172 VanDerWaalsContact O-CG 3.23Å; M168-Q172 WeakPolarHBondContact O-CG 3.27Å; M168-Q172 PolarHBondContact O-N 2.92Å; M168-I223 HydrophobicContact CE-CB 4.34Å; M168-I223 HydrophobicContact CE-CG1 4.43Å; M168-I223 HydrophobicContact CE-CG2 3.75Å; M168-S226 VanDerWaalsContact SD-CB 3.53Å; M168-F227 HydrophobicContact CE-CD1 3.97Å; M168-F227 HydrophobicContact CE-CD2 4.25Å; M168-F227 HydrophobicContact CE-CE1 3.39Å; M168-F227 HydrophobicContact CE-CE2 3.71Å; M168-F227 HydrophobicContact CE-CG 4.36Å; M168-F227 HydrophobicContact CE-CZ 3.24Å; M168-F227 HydrophobicContact SD-CE1 4.38Å
169L98.3Very high97.5Very high88 Ų8851.7 Ų51.746%0.46127%0.272SS..Hα-helixtrans-65-39.2176.1-69.9173.6000111.8T165 V166 H167 Q172 Y173T165-L169 HydrophobicContact CG2-CD1 4.06Å; T165-L169 HydrophobicContact CG2-CG 4.46Å; T165-L169 VanDerWaalsContact O-CG 3.27Å; T165-L169 WeakPolarHBondContact O-CG 3.14Å; T165-L169 PolarHBondContact O-N 3.5Å; V166-L169 PolarHBondContact O-N 2.68Å; H167-L169 PolarHBondContact O-N 3.03Å; L169-Q172 PolarHBondContact O-N 2.82Å; L169-Y173 WeakPolarHBondContact O-CB 3.36Å; L169-Y173 PolarHBondContact O-N 3.46Å
170I98.4Very high97.3Very high93 Ų9350.9 Ų50.948%0.47726%0.26SS..Hα-helixtrans-62.3-51.7175.1-67.9165.8000110.6V166 H167 Q172 Y173 L174V166-I170 HydrophobicContact CG1-CD1 3.95Å; V166-I170 WeakPolarHBondContact O-CG1 3.28Å; V166-I170 PolarHBondContact O-N 3.39Å; H167-I170 PolarHBondContact O-N 3.33Å; I170-Q172 PolarHBondContact O-N 3.47Å; I170-Y173 PolarHBondContact O-N 2.8Å; I170-L174 HydrophobicContact CG2-CD1 4.08Å; I170-L174 HydrophobicContact CG2-CG 4.42Å; I170-L174 WeakPolarHBondContact O-CG 3.34Å; I170-L174 PolarHBondContact O-N 3.46Å
171L98.3Very high97Very high17 Ų1750.2 Ų50.29%0.08925%0.253CS..Hα-helixtrans-57.8-39.6177.6-71.9-178.3000111.6H167 M168 Q175 L219 I223H167-L171 WeakPolarHBondContact NE2-CD1 3.43Å; H167-L171 PolarHBondContact O-N 2.95Å; M168-L171 PolarHBondContact O-N 3.11Å; L171-Q175 WeakPolarHBondContact O-CB 3.44Å; L171-Q175 PolarHBondContact O-N 2.86Å; L171-Q175 VanDerWaalsContact O-N 3.16Å; L171-L219 HydrophobicContact CD2-CD2 4.11Å; L171-I223 HydrophobicContact CB-CD1 4.43Å; L171-I223 HydrophobicContact CB-CG1 3.83Å; L171-I223 HydrophobicContact CD1-CG1 4.08Å
172Q97.6Very high96.7Very high7 Ų751 Ų513%0.03326%0.258CS..Hα-helixtrans-68.8-41.2179.7-76.4-171.57900113R111 M168 L169 I170 Q175 D176 I223R111-Q172 PolarHBondContact NH1-O 3.44Å; M168-Q172 WeakPolarHBondContact O-CB 3.36Å; M168-Q172 VanDerWaalsContact O-CG 3.23Å; M168-Q172 WeakPolarHBondContact O-CG 3.27Å; M168-Q172 PolarHBondContact O-N 2.92Å; L169-Q172 PolarHBondContact O-N 2.82Å; I170-Q172 PolarHBondContact O-N 3.47Å; Q172-Q175 PolarHBondContact O-N 3.26Å; Q172-D176 PolarHBondContact O-N 3.35Å; Q172-I223 HydrophobicContact CG-CD1 4.17Å
173Y97.4Very high96.3Very high145 Ų14550 Ų5057%0.56925%0.246SC*.Hα-helixtrans-62.1-46.9175.1171.5-101.2000111.8L169 I170 Q175 D176 L177L169-Y173 WeakPolarHBondContact O-CB 3.36Å; L169-Y173 PolarHBondContact O-N 3.46Å; I170-Y173 PolarHBondContact O-N 2.8Å; Y173-Q175 PolarHBondContact O-N 2.81Å; Y173-D176 PolarHBondContact O-N 3.32Å; Y173-L177 WeakPolarHBondContact O-CB 3.35Å; Y173-L177 PolarHBondContact O-N 2.99Å
174L97.5Very high95.8Very high52 Ų5247.3 Ų47.327%0.27224%0.24SC..Hα-helixtrans-58.5-37.5177.7-70175.5000111.7I170 V178 M208 L219I170-L174 HydrophobicContact CG2-CD1 4.08Å; I170-L174 HydrophobicContact CG2-CG 4.42Å; I170-L174 WeakPolarHBondContact O-CG 3.34Å; I170-L174 PolarHBondContact O-N 3.46Å; L174-V178 WeakPolarHBondContact O-CG2 3.28Å; L174-V178 PolarHBondContact O-N 3.37Å; L174-V178 VanDerWaalsContact O-N 3.14Å; L174-M208 HydrophobicContact CB-SD 4.4Å; L174-L219 HydrophobicContact CB-CD1 4.03Å; L174-L219 HydrophobicContact CB-CD2 4.02Å; L174-L219 HydrophobicContact CD1-CD2 4.3Å
175Q97.2Very high95.3Very high2 Ų249.2 Ų49.21%0.00925%0.251CS..Hα-helixtrans-74.9-39.1-179.4-157.3179.830.600112.4R112 L171 Q172 Y173 L177 V178 F179 H216 L219 E220R112-Q175 VanDerWaalsContact CZ-CD 3.45Å; R112-Q175 VanDerWaalsContact NH2-CG 3.3Å; L171-Q175 WeakPolarHBondContact O-CB 3.44Å; L171-Q175 PolarHBondContact O-N 2.86Å; L171-Q175 VanDerWaalsContact O-N 3.16Å; Q172-Q175 PolarHBondContact O-N 3.26Å; Y173-Q175 PolarHBondContact O-N 2.81Å; Q175-L177 VanDerWaalsContact C-N 3.33Å; Q175-V178 PolarHBondContact O-N 3.43Å; Q175-F179 HydrophobicContact CG-CD2 4.18Å; Q175-F179 HydrophobicContact CG-CE2 3.99Å; Q175-F179 VanDerWaalsContact O-CD2 3.27Å; Q175-F179 WeakPolarHBondContact O-CD2 3.31Å; Q175-F179 PolarHBondContact O-N 3Å; Q175-H216 HydrophobicContact CG-CB 4.38Å; Q175-H216 PolarHBondContact NE2-O 2.76Å; Q175-L219 HydrophobicContact CB-CB 4.07Å; Q175-L219 HydrophobicContact CB-CD1 3.81Å; Q175-L219 HydrophobicContact CG-CB 3.87Å; Q175-L219 HydrophobicContact CG-CD1 4.06Å; Q175-E220 PolarHBondContact NE2-OE2 2.81Å; Q175-E220 PolarHBondContact OE1-OE2 3.11Å
176D95.7Very high94.4Very high22 Ų2251.2 Ų51.212%0.11825%0.253CS..Hα-helixtrans-60.6-43.7172.3176.161.5000110.6E115 Q172 Y173 V178 F179 R180E115-D176 WeakPolarHBondContact OE1-CA 3.44Å; Q172-D176 PolarHBondContact O-N 3.35Å; Y173-D176 PolarHBondContact O-N 3.32Å; D176-V178 VanDerWaalsContact C-N 3.34Å; D176-V178 PolarHBondContact O-N 2.89Å; D176-F179 PolarHBondContact O-N 3.32Å; D176-F179 VanDerWaalsContact O-N 3.14Å; D176-R180 WeakPolarHBondContact O-CG 3.49Å; D176-R180 PolarHBondContact O-N 2.69Å; D176-R180 IonicContact OD1-CZ 3.9Å; D176-R180 IonicContact OD1-NE 2.7Å; D176-R180 PolarHBondContact OD1-NE 3.1Å; D176-R180 IonicContact OD1-NH2 2.87Å; D176-R180 PolarHBondContact OD1-NH2 3.43Å; D176-R180 IonicContact OD2-CZ 3.64Å; D176-R180 IonicContact OD2-NE 2.99Å; D176-R180 PolarHBondContact OD2-NE 3.34Å; D176-R180 IonicContact OD2-NH2 3.73Å; D176-R180 PolarHBondContact OD2-NH2 3.49Å
177L95.5Very high93Very high53 Ų5350.7 Ų50.728%0.27725%0.253SS..Hα-helixtrans-54.9-49174.7178.866.5000111.5Y173 Q175 F179 R180 Q181Y173-L177 WeakPolarHBondContact O-CB 3.35Å; Y173-L177 PolarHBondContact O-N 2.99Å; Q175-L177 VanDerWaalsContact C-N 3.33Å; L177-F179 VanDerWaalsContact C-N 3.35Å; L177-F179 PolarHBondContact O-N 2.8Å; L177-R180 PolarHBondContact O-N 3.22Å; L177-Q181 WeakPolarHBondContact O-CG 3.29Å; L177-Q181 PolarHBondContact O-N 3.42Å
178V94.9Very high91.2Very high0 Ų049.6 Ų49.60%026%0.264CS..Hα-helixtrans-61.4-41177.5168.10000111.7L174 Q175 D176 Q181 L182 M208 F209 P215 H216 L219L174-V178 WeakPolarHBondContact O-CG2 3.28Å; L174-V178 PolarHBondContact O-N 3.37Å; L174-V178 VanDerWaalsContact O-N 3.14Å; Q175-V178 PolarHBondContact O-N 3.43Å; D176-V178 VanDerWaalsContact C-N 3.34Å; D176-V178 PolarHBondContact O-N 2.89Å; V178-Q181 PolarHBondContact O-N 3.44Å; V178-L182 WeakPolarHBondContact O-CG 3.14Å; V178-L182 PolarHBondContact O-N 3.26Å; V178-L182 VanDerWaalsContact O-N 3.07Å; V178-M208 HydrophobicContact CG2-CB 4.41Å; V178-M208 HydrophobicContact CG2-SD 4.24Å; V178-F209 HydrophobicContact CB-CE2 4.31Å; V178-F209 HydrophobicContact CG1-CE1 4.48Å; V178-F209 HydrophobicContact CG1-CE2 3.61Å; V178-F209 HydrophobicContact CG1-CZ 3.51Å; V178-F209 HydrophobicContact CG2-CE2 4.46Å; V178-P215 HydrophobicContact CG1-CG 3.86Å; V178-P215 HydrophobicContact CG2-CB 4.23Å; V178-P215 HydrophobicContact CG2-CG 3.93Å; V178-H216 HydrophobicContact CG1-CB 3.66Å; V178-L219 HydrophobicContact CG2-CD1 4.22Å
179F93.9Very high89Confident43 Ų4358.2 Ų58.219%0.18930%0.301CS..Hα-helixtrans-67.5-38.8177.1-86-64.6000112.9E115 Q175 D176 L177 Q181 L182 A183 H216E115-F179 WeakPolarHBondContact OE2-CD2 3.31Å; Q175-F179 HydrophobicContact CG-CD2 4.18Å; Q175-F179 HydrophobicContact CG-CE2 3.99Å; Q175-F179 VanDerWaalsContact O-CD2 3.27Å; Q175-F179 WeakPolarHBondContact O-CD2 3.31Å; Q175-F179 PolarHBondContact O-N 3Å; D176-F179 PolarHBondContact O-N 3.32Å; D176-F179 VanDerWaalsContact O-N 3.14Å; L177-F179 VanDerWaalsContact C-N 3.35Å; L177-F179 PolarHBondContact O-N 2.8Å; F179-Q181 VanDerWaalsContact C-N 3.35Å; F179-L182 HydrophobicContact CD1-CD1 4.35Å; F179-L182 PolarHBondContact O-N 2.83Å; F179-A183 WeakPolarHBondContact O-CB 3.46Å; F179-A183 PolarHBondContact O-N 3.29Å; F179-H216 HydrophobicContact CE2-CB 4.07Å; F179-H216 HydrophobicContact CZ-CB 4.09Å
180R93Very high86.7Confident107 Ų10758 Ų5840%0.40430%0.3SS..Hα-helixtrans-62.3-41.4173.4-69.9177-167.6-83.3-7.4111.9V119 D176 L177 L182 A183 A184V119-R180 HydrophobicContact CG1-CB 4.48Å; V119-R180 HydrophobicContact CG1-CG 3.82Å; D176-R180 WeakPolarHBondContact O-CG 3.49Å; D176-R180 PolarHBondContact O-N 2.69Å; D176-R180 IonicContact OD1-CZ 3.9Å; D176-R180 IonicContact OD1-NE 2.7Å; D176-R180 PolarHBondContact OD1-NE 3.1Å; D176-R180 IonicContact OD1-NH2 2.87Å; D176-R180 PolarHBondContact OD1-NH2 3.43Å; D176-R180 IonicContact OD2-CZ 3.64Å; D176-R180 IonicContact OD2-NE 2.99Å; D176-R180 PolarHBondContact OD2-NE 3.34Å; D176-R180 IonicContact OD2-NH2 3.73Å; D176-R180 PolarHBondContact OD2-NH2 3.49Å; L177-R180 PolarHBondContact O-N 3.22Å; R180-L182 VanDerWaalsContact C-N 3.35Å; R180-L182 PolarHBondContact O-N 3.16Å; R180-A183 PolarHBondContact O-N 2.89Å; R180-A184 WeakPolarHBondContact O-CB 3.47Å; R180-A184 PolarHBondContact O-N 3.18Å
181Q92.7Very high84.5Confident37 Ų3762.3 Ų62.317%0.17332%0.318CS..Hα-helixtrans-59.8-44.5173.5-70.1176.4-65.200111.4L177 V178 F179 A183 A184 L185 E205 G206 F209L177-Q181 WeakPolarHBondContact O-CG 3.29Å; L177-Q181 PolarHBondContact O-N 3.42Å; V178-Q181 PolarHBondContact O-N 3.44Å; F179-Q181 VanDerWaalsContact C-N 3.35Å; Q181-A183 VanDerWaalsContact C-N 3.34Å; Q181-A183 PolarHBondContact O-N 2.87Å; Q181-A184 PolarHBondContact O-N 3.46Å; Q181-L185 PolarHBondContact O-N 2.91Å; Q181-E205 PolarHBondContact NE2-O 2.86Å; Q181-E205 VanDerWaalsContact NE2-O 3.07Å; Q181-G206 PolarHBondContact NE2-O 3.34Å; Q181-F209 HydrophobicContact CB-CD2 4.43Å; Q181-F209 HydrophobicContact CB-CE2 4.05Å
182L91.4Very high82.3Confident38 Ų3868.8 Ų68.820%0.19935%0.353CS..Hα-helixtrans-64.4-37176.3-71.4173.2000113.1V178 F179 R180 L185 P204 F209V178-L182 WeakPolarHBondContact O-CG 3.14Å; V178-L182 PolarHBondContact O-N 3.26Å; V178-L182 VanDerWaalsContact O-N 3.07Å; F179-L182 HydrophobicContact CD1-CD1 4.35Å; F179-L182 PolarHBondContact O-N 2.83Å; R180-L182 VanDerWaalsContact C-N 3.35Å; R180-L182 PolarHBondContact O-N 3.16Å; L182-L185 HydrophobicContact CD2-CD1 4.31Å; L182-P204 HydrophobicContact CD2-CB 4.2Å; L182-P204 HydrophobicContact CD2-CG 4.34Å; L182-F209 HydrophobicContact CD1-CZ 4.07Å; L182-F209 HydrophobicContact CD2-CE1 4.17Å; L182-F209 HydrophobicContact CD2-CE2 4.37Å; L182-F209 HydrophobicContact CD2-CZ 3.6Å; L182-F209 HydrophobicContact CG-CE2 4.22Å; L182-F209 HydrophobicContact CG-CZ 3.64Å
183A89.4Confident80.3Confident12 Ų1272.3 Ų72.310%0.09938%0.375CS..Hα-helixtrans-66.6-41.4175.400000111.8V119 F179 R180 Q181 L185 R186 S187V119-A183 HydrophobicContact CG1-CB 3.97Å; V119-A183 WeakPolarHBondContact O-CB 3.39Å; F179-A183 WeakPolarHBondContact O-CB 3.46Å; F179-A183 PolarHBondContact O-N 3.29Å; R180-A183 PolarHBondContact O-N 2.89Å; Q181-A183 VanDerWaalsContact C-N 3.34Å; Q181-A183 PolarHBondContact O-N 2.87Å; A183-L185 PolarHBondContact O-N 3.34Å; A183-R186 WeakPolarHBondContact O-CB 3.4Å; A183-R186 PolarHBondContact O-N 3.42Å; A183-S187 PolarHBondContact O-N 2.71Å
184A88.7Confident78Confident58 Ų5869.4 Ų69.448%0.47939%0.389SS..Hα-helixtrans-59.7-32.7178.700000112.9R180 Q181 R186 S187R180-A184 WeakPolarHBondContact O-CB 3.47Å; R180-A184 PolarHBondContact O-N 3.18Å; Q181-A184 PolarHBondContact O-N 3.46Å; A184-R186 PolarHBondContact O-N 2.91Å; A184-S187 WeakPolarHBondContact CA-OG 3.49Å; A184-S187 PolarHBondContact O-N 3.43Å; A184-S187 PolarHBondContact O-OG 3.22Å
185L86.4Confident75.4Confident52 Ų5274.9 Ų74.927%0.27241%0.411SS..THydrogen-bonded Turntrans-63.5-22.8174.2-62.1172.4000113.5Q181 L182 A183 P204Q181-L185 PolarHBondContact O-N 2.91Å; L182-L185 HydrophobicContact CD2-CD1 4.31Å; A183-L185 PolarHBondContact O-N 3.34Å; L185-P204 HydrophobicContact CD1-CB 3.76Å
186R79.8Confident73.1Confident88 Ų8882.1 Ų82.133%0.33245%0.449SS..THydrogen-bonded Turntrans-95.8-19.6179.1-66.3-175.2171.9-177.1-5.6112.8I121 A183 A184 G188I121-R186 HydrophobicContact CB-CB 3.97Å; I121-R186 HydrophobicContact CD1-CB 4.1Å; I121-R186 HydrophobicContact CG2-CB 4.06Å; I121-R186 WeakPolarHBondContact O-CD 3.1Å; I121-R186 PolarHBondContact O-NH1 2.95Å; A183-R186 WeakPolarHBondContact O-CB 3.4Å; A183-R186 PolarHBondContact O-N 3.42Å; A184-R186 PolarHBondContact O-N 2.91Å; R186-G188 VanDerWaalsContact C-N 3.25Å; R186-G188 PolarHBondContact O-N 3.02Å
187S70.4Confident70.7Confident71 Ų7183.4 Ų83.450%0.49746%0.459SS..  trans-79.6-5.4178.4620000113.7A183 A184 K189A183-S187 PolarHBondContact O-N 2.71Å; A184-S187 WeakPolarHBondContact CA-OG 3.49Å; A184-S187 PolarHBondContact O-N 3.43Å; A184-S187 PolarHBondContact O-OG 3.22Å; S187-K189 PolarHBondContact O-N 3.23Å
188G60.7Low68.4Low57 Ų5789.3 Ų89.359%0.58849%0.486SS*.  trans-61.679.417200000111.8R186R186-G188 VanDerWaalsContact C-N 3.25Å; R186-G188 PolarHBondContact O-N 3.02Å
189K51.3Low66.5Low181 Ų18198.4 Ų98.479%0.78753%0.525SS*.  trans-64.7133.3167.4-83.8178.9173.3177.70108S187 E191S187-K189 PolarHBondContact O-N 3.23Å; K189-E191 PolarHBondContact O-N 3.06Å
190N51.1Low65.2Low82 Ų82103.8 Ų103.844%0.43955%0.548SS..  trans-64103.9155.7-103.7-19.4000106.8N192 T193N190-N192 PolarHBondContact O-N 3.45Å; N190-N192 VanDerWaalsContact O-N 3.07Å; N190-T193 WeakPolarHBondContact CB-OG1 3.45Å; N190-T193 PolarHBondContact O-N 3.41Å
191E51.5Low64.4Low184 Ų184102.6 Ų102.686%0.8654%0.544SS*.THydrogen-bonded Turntrans-56.5-22.5176.5-68-174.5156.400112K189K189-E191 PolarHBondContact O-N 3.06Å
192N51.8Low64Low154 Ų154106.3 Ų106.382%0.82456%0.558SS**THydrogen-bonded Turntrans-93.8-5.7-173.3-64.3-19.2000115.6N190N190-N192 PolarHBondContact O-N 3.45Å; N190-N192 VanDerWaalsContact O-N 3.07Å
193T55.8Low63.8Low81 Ų81106 Ų10650%0.49756%0.558SS.*THydrogen-bonded Turntrans-133.3-9.6-17562.70000115.9N190 K195N190-T193 WeakPolarHBondContact CB-OG1 3.45Å; N190-T193 PolarHBondContact O-N 3.41Å; T193-K195 PolarHBondContact O-N 2.92Å
194G48.5Very low63.9Low83 Ų83105.4 Ų105.486%0.85655%0.553SS**SBendtrans59.9-2.8-17800000115.1
195K43.8Very low63.8Low168 Ų168107.2 Ų107.273%0.7355%0.552SS**SBendtrans-100134.2177.6-72.7-179.1176.71800108.3T193 S197T193-K195 PolarHBondContact O-N 2.92Å; K195-S197 PolarHBondContact O-N 3.39Å; K195-S197 VanDerWaalsContact O-N 3.12Å
196L48.6Very low63.8Low154 Ų154105.6 Ų105.681%0.80655%0.548SS*.PPolyproline II helixtrans-51.2121.9166.7-85.9124.8000108E198L196-E198 PolarHBondContact O-N 3.43Å; L196-E198 VanDerWaalsContact O-N 3.07Å
197S45.8Very low64.4Low49 Ų49103.5 Ų103.534%0.34355%0.547SS..PPolyproline II helixtrans-51118.9174.1-178.10000108.5K195 K199K195-S197 PolarHBondContact O-N 3.39Å; K195-S197 VanDerWaalsContact O-N 3.12Å; S197-K199 PolarHBondContact O-N 2.87Å
198E47.7Very low65.4Low177 Ų177101.9 Ų101.983%0.82753%0.532SS*.SBendtrans-61.6104.9177.6-77.2-175.8147.800109.2L196 K200L196-E198 PolarHBondContact O-N 3.43Å; L196-E198 VanDerWaalsContact O-N 3.07Å; E198-K200 PolarHBondContact O-N 2.89Å
199K54.5Low67Low191 Ų19199.2 Ų99.283%0.8350%0.504SS*.SBendtrans68.620.8151.9-57.4178.8179.8172.90119.3S197 Y201S197-K199 PolarHBondContact O-N 2.87Å; K199-Y201 PolarHBondContact O-N 3.12Å
200K65.9Low68.8Low155 Ų15595 Ų9567%0.67449%0.487SS*.  trans-85.8104165.3-74-171.8-179.6-179.20110.7E198 Y202E198-K200 PolarHBondContact O-N 2.89Å; K200-Y202 HydrophobicContact CB-CE1 4.4Å; K200-Y202 HydrophobicContact CB-CE2 4.27Å; K200-Y202 WeakPolarHBondContact O-CD2 3.47Å; K200-Y202 VanDerWaalsContact O-CE2 3.22Å; K200-Y202 WeakPolarHBondContact O-CE2 3.27Å
201Y76.9Confident70.7Confident82 Ų8297.6 Ų97.632%0.32249%0.49SS..  trans-66.6142.9162.9-74.8-83.7000109K49 K199 W259 F264K49-Y201 HydrophobicContact CB-CE1 4.36Å; K49-Y201 HydrophobicContact CD-CD1 3.9Å; K49-Y201 HydrophobicContact CD-CE1 3.69Å; K49-Y201 HydrophobicContact CG-CD1 4.31Å; K49-Y201 HydrophobicContact CG-CE1 3.58Å; K199-Y201 PolarHBondContact O-N 3.12Å; Y201-W259 HydrophobicContact CD1-CH2 4.03Å; Y201-W259 HydrophobicContact CD1-CZ2 4.46Å; Y201-W259 AromaticContact CD2-CH2 3.75Å; Y201-W259 HydrophobicContact CD2-CH2 3.75Å; Y201-W259 AromaticContact CD2-CZ2 3.66Å; Y201-W259 HydrophobicContact CD2-CZ2 3.66Å; Y201-W259 HydrophobicContact CE2-CH2 4.45Å; Y201-W259 HydrophobicContact CE2-CZ2 4.02Å; Y201-W259 AromaticContact CG-CH2 3.5Å; Y201-W259 HydrophobicContact CG-CH2 3.5Å; Y201-W259 AromaticContact CG-CZ2 3.91Å; Y201-W259 HydrophobicContact CG-CZ2 3.91Å; Y201-F264 WeakPolarHBondContact O-CZ 3.33Å
202Y84.3Confident72.7Confident115 Ų11589.5 Ų89.545%0.45145%0.453SS..  trans-115.1141.7174.1-61.4-78.2000110K200K200-Y202 HydrophobicContact CB-CE1 4.4Å; K200-Y202 HydrophobicContact CB-CE2 4.27Å; K200-Y202 WeakPolarHBondContact O-CD2 3.47Å; K200-Y202 VanDerWaalsContact O-CE2 3.22Å; K200-Y202 WeakPolarHBondContact O-CE2 3.27Å
203P87.6Confident74.6Confident31 Ų3182.2 Ų82.220%0.20141%0.414CS..  trans-72.7135.8173.131.5-33.4000110.1F264 W267P203-F264 HydrophobicContact CB-CD1 4.49Å; P203-F264 HydrophobicContact CB-CG 4.3Å; P203-F264 HydrophobicContact CG-CD1 4.06Å; P203-F264 HydrophobicContact CG-CE1 4.4Å; P203-F264 HydrophobicContact CG-CG 4.36Å; P203-W267 HydrophobicContact CB-CB 4.36Å; P203-W267 HydrophobicContact CB-CD2 3.56Å; P203-W267 HydrophobicContact CB-CE3 4.22Å; P203-W267 HydrophobicContact CB-CG 3.58Å; P203-W267 HydrophobicContact CB-CZ2 4.28Å; P203-W267 HydrophobicContact CG-CG 4.11Å
204P90.2Very high76.3Confident1 Ų178.4 Ų78.41%0.00639%0.391CS..  trans-67.9146.3178.725.1-31.1000111.9L182 L185 F209 Y260 W267L182-P204 HydrophobicContact CD2-CB 4.2Å; L182-P204 HydrophobicContact CD2-CG 4.34Å; L185-P204 HydrophobicContact CD1-CB 3.76Å; P204-F209 HydrophobicContact CB-CB 4.2Å; P204-F209 HydrophobicContact CB-CD1 3.56Å; P204-F209 HydrophobicContact CB-CD2 3.77Å; P204-F209 HydrophobicContact CB-CE1 3.68Å; P204-F209 HydrophobicContact CB-CE2 3.89Å; P204-F209 HydrophobicContact CB-CG 3.59Å; P204-F209 HydrophobicContact CB-CZ 3.85Å; P204-F209 HydrophobicContact CG-CB 4.46Å; P204-F209 HydrophobicContact CG-CD1 3.29Å; P204-F209 HydrophobicContact CG-CD2 4.44Å; P204-F209 HydrophobicContact CG-CE1 3.39Å; P204-F209 HydrophobicContact CG-CG 3.85Å; P204-F209 HydrophobicContact CG-CZ 4.04Å; P204-Y260 WeakPolarHBondContact CD-OH 3.43Å; P204-W267 HydrophobicContact CG-CH2 3.96Å; P204-W267 HydrophobicContact CG-CZ2 3.73Å; P204-W267 VanDerWaalsContact O-CE2 3.32Å; P204-W267 WeakPolarHBondContact O-CZ2 3.49Å; P204-W267 PolarHBondContact O-NE1 2.93Å
205E86.8Confident78.6Confident96 Ų9674.5 Ų74.545%0.44935%0.35SS..  trans-132.7157.4177.1-74.1-65165.600110.5Q181 H210 W267 R271Q181-E205 PolarHBondContact NE2-O 2.86Å; Q181-E205 VanDerWaalsContact NE2-O 3.07Å; E205-H210 IonicContact OE2-CE1 3.11Å; E205-H210 IonicContact OE2-ND1 3.75Å; E205-W267 PolarHBondContact OE1-NE1 3.26Å; E205-R271 IonicContact OE1-CZ 3.61Å; E205-R271 IonicContact OE1-NH1 3.9Å; E205-R271 IonicContact OE1-NH2 3.3Å; E205-R271 PolarHBondContact OE1-NH2 3.21Å; E205-R271 IonicContact OE2-NH2 2.89Å; E205-R271 PolarHBondContact OE2-NH2 3.39Å
206G87.8Confident81Confident18 Ų1867.5 Ų67.519%0.18632%0.32CS..SBendtrans92155.2177.200000114.5Q181 M208 F209 H210Q181-G206 PolarHBondContact NE2-O 3.34Å; G206-M208 PolarHBondContact O-N 3.42Å; G206-F209 WeakPolarHBondContact O-CB 3.36Å; G206-F209 PolarHBondContact O-N 3.14Å; G206-F209 VanDerWaalsContact O-N 3.13Å; G206-H210 VanDerWaalsContact CA-NE2 3.29Å; G206-H210 WeakPolarHBondContact CA-NE2 3.48Å
207S90.7Very high83.2Confident44 Ų4461.7 Ų61.731%0.30829%0.288SS..G310 helixtrans53.4-133.9174.1-167.30000111.4F209 H210 W211S207-F209 PolarHBondContact O-N 3.22Å; S207-H210 PolarHBondContact O-CD2 3Å; S207-H210 PolarHBondContact O-N 3.18Å; S207-H210 VanDerWaalsContact O-N 3.14Å; S207-W211 WeakPolarHBondContact O-CZ3 3.4Å
208M92.7Very high85.5Confident37 Ų3760.7 Ų60.718%0.18228%0.278CS..G310 helixtrans-63.9-20.7-178.5-60.4-179.873.900114.1L174 V178 G206 H210 W211 I212 P215 L219L174-M208 HydrophobicContact CB-SD 4.4Å; V178-M208 HydrophobicContact CG2-CB 4.41Å; V178-M208 HydrophobicContact CG2-SD 4.24Å; G206-M208 PolarHBondContact O-N 3.42Å; M208-H210 PolarHBondContact O-N 3.13Å; M208-W211 PolarHBondContact O-N 2.93Å; M208-I212 PolarHBondContact O-N 3.26Å; M208-P215 HydrophobicContact CB-CB 3.52Å; M208-P215 HydrophobicContact CB-CG 3.78Å; M208-P215 HydrophobicContact CE-CB 3.93Å; M208-P215 HydrophobicContact CG-CB 4.43Å; M208-P215 HydrophobicContact SD-CB 4.13Å; M208-L219 HydrophobicContact CE-CD1 4.21Å; M208-L219 HydrophobicContact CE-CD2 4.02Å; M208-L219 HydrophobicContact CE-CG 4.07Å; M208-L219 HydrophobicContact SD-CD1 3.74Å; M208-L219 HydrophobicContact SD-CD2 4.23Å; M208-L219 HydrophobicContact SD-CG 4.24Å
209F92.8Very high87.9Confident1 Ų152.5 Ų52.50%0.00424%0.24CC..G310 helixtrans-67.9-12.1176.1-71.2-72.8000112.9V178 Q181 L182 P204 G206 S207 W211 I212 P215 R271V178-F209 HydrophobicContact CB-CE2 4.31Å; V178-F209 HydrophobicContact CG1-CE1 4.48Å; V178-F209 HydrophobicContact CG1-CE2 3.61Å; V178-F209 HydrophobicContact CG1-CZ 3.51Å; V178-F209 HydrophobicContact CG2-CE2 4.46Å; Q181-F209 HydrophobicContact CB-CD2 4.43Å; Q181-F209 HydrophobicContact CB-CE2 4.05Å; L182-F209 HydrophobicContact CD1-CZ 4.07Å; L182-F209 HydrophobicContact CD2-CE1 4.17Å; L182-F209 HydrophobicContact CD2-CE2 4.37Å; L182-F209 HydrophobicContact CD2-CZ 3.6Å; L182-F209 HydrophobicContact CG-CE2 4.22Å; L182-F209 HydrophobicContact CG-CZ 3.64Å; P204-F209 HydrophobicContact CB-CB 4.2Å; P204-F209 HydrophobicContact CB-CD1 3.56Å; P204-F209 HydrophobicContact CB-CD2 3.77Å; P204-F209 HydrophobicContact CB-CE1 3.68Å; P204-F209 HydrophobicContact CB-CE2 3.89Å; P204-F209 HydrophobicContact CB-CG 3.59Å; P204-F209 HydrophobicContact CB-CZ 3.85Å; P204-F209 HydrophobicContact CG-CB 4.46Å; P204-F209 HydrophobicContact CG-CD1 3.29Å; P204-F209 HydrophobicContact CG-CD2 4.44Å; P204-F209 HydrophobicContact CG-CE1 3.39Å; P204-F209 HydrophobicContact CG-CG 3.85Å; P204-F209 HydrophobicContact CG-CZ 4.04Å; G206-F209 WeakPolarHBondContact O-CB 3.36Å; G206-F209 PolarHBondContact O-N 3.14Å; G206-F209 VanDerWaalsContact O-N 3.13Å; S207-F209 PolarHBondContact O-N 3.22Å; F209-W211 VanDerWaalsContact C-N 3.31Å; F209-I212 WeakPolarHBondContact CA-O 3.35Å; F209-P215 HydrophobicContact CD1-CG 3.79Å; F209-P215 HydrophobicContact CD2-CG 4.34Å; F209-P215 VanDerWaalsContact CE1-CD 3.43Å; F209-P215 HydrophobicContact CE1-CG 3.77Å; F209-P215 HydrophobicContact CE2-CG 4.31Å; F209-P215 HydrophobicContact CG-CG 4.1Å; F209-P215 HydrophobicContact CZ-CG 4.02Å; F209-R271 WeakPolarHBondContact O-CD 3.2Å; F209-R271 PolarHBondContact O-NE 2.92Å; F209-R271 PolarHBondContact O-NH2 3.46Å
210H90.8Very high89.9Confident92 Ų9244 Ų4443%0.42620%0.203SC..G310 helixtrans-67.6-31.7173.2-73.6-54.6000113.4E205 G206 S207 M208E205-H210 IonicContact OE2-CE1 3.11Å; E205-H210 IonicContact OE2-ND1 3.75Å; G206-H210 VanDerWaalsContact CA-NE2 3.29Å; G206-H210 WeakPolarHBondContact CA-NE2 3.48Å; S207-H210 PolarHBondContact O-CD2 3Å; S207-H210 PolarHBondContact O-N 3.18Å; S207-H210 VanDerWaalsContact O-N 3.14Å; M208-H210 PolarHBondContact O-N 3.13Å
211W90.3Very high91.4Very high137 Ų13737.4 Ų37.452%0.51918%0.175SC..THydrogen-bonded Turntrans-106.7-27.7-173.9-49.7-69.6000112.9S207 M208 F209 R271 A272 P276S207-W211 WeakPolarHBondContact O-CZ3 3.4Å; M208-W211 PolarHBondContact O-N 2.93Å; F209-W211 VanDerWaalsContact C-N 3.31Å; W211-R271 WeakPolarHBondContact O-CA 3.4Å; W211-A272 PolarHBondContact O-N 2.73Å; W211-P276 HydrophobicContact CB-CG 4.07Å
212I92.9Very high92.4Very high14 Ų1435.3 Ų35.37%0.07217%0.173CC..BIsolated β-bridgetrans-134.8139.5-168.5-58.8177.4000110.3M208 F209 I218 A272 P276M208-I212 PolarHBondContact O-N 3.26Å; F209-I212 WeakPolarHBondContact CA-O 3.35Å; I212-I218 HydrophobicContact CD1-CD1 3.63Å; I212-I218 HydrophobicContact CG1-CD1 4.49Å; I212-I218 HydrophobicContact CG2-CD1 3.5Å; I212-A272 WeakPolarHBondContact CA-O 3.47Å; I212-P276 HydrophobicContact CD1-CG 4.11Å; I212-P276 HydrophobicContact CG1-CG 4.01Å
213T92.2Very high93.1Very high0 Ų029.9 Ų29.90%015%0.151CC..SBendtrans-68.9-38.5-179-56.70000113.8H257 Y260 W267 A272T213-H257 HydrophobicContact CG2-CB 4.28Å; T213-H257 PolarHBondContact OG1-CE1 2.95Å; T213-H257 PolarHBondContact OG1-ND1 3.48Å; T213-Y260 HydrophobicContact CG2-CD2 3.36Å; T213-Y260 HydrophobicContact CG2-CE2 4Å; T213-Y260 HydrophobicContact CG2-CG 3.98Å; T213-W267 HydrophobicContact CG2-CH2 4.01Å; T213-W267 HydrophobicContact CG2-CZ3 3.78Å; T213-A272 PolarHBondContact N-O 3.29Å
214C92.4Very high93.6Very high2 Ų228.4 Ų28.41%0.01414%0.141CC..  trans-136.465.3-175.8-64.80000113.1H216 Y217 I253 N256C214-H216 VanDerWaalsContact C-N 3.25Å; C214-H216 PolarHBondContact O-N 3.26Å; C214-H216 VanDerWaalsContact O-N 3.16Å; C214-Y217 HydrophobicContact CB-CD2 3.45Å; C214-Y217 VanDerWaalsContact CB-CD2 3.45Å; C214-Y217 HydrophobicContact CB-CE2 4Å; C214-Y217 HydrophobicContact CB-CG 4.42Å; C214-Y217 PolarHBondContact O-N 3.07Å; C214-Y217 VanDerWaalsContact O-N 3.16Å; C214-I253 HydrophobicContact CB-CG1 4.36Å; C214-N256 VanDerWaalsContact SG-CB 3.56Å
215P95.2Very high94Very high0 Ų031.7 Ų31.70%016%0.159CC..Hα-helixtrans-58.7-30.6-175.821.5-33.1000114.3V178 M208 F209 Y217 I218 L219V178-P215 HydrophobicContact CG1-CG 3.86Å; V178-P215 HydrophobicContact CG2-CB 4.23Å; V178-P215 HydrophobicContact CG2-CG 3.93Å; M208-P215 HydrophobicContact CB-CB 3.52Å; M208-P215 HydrophobicContact CB-CG 3.78Å; M208-P215 HydrophobicContact CE-CB 3.93Å; M208-P215 HydrophobicContact CG-CB 4.43Å; M208-P215 HydrophobicContact SD-CB 4.13Å; F209-P215 HydrophobicContact CD1-CG 3.79Å; F209-P215 HydrophobicContact CD2-CG 4.34Å; F209-P215 VanDerWaalsContact CE1-CD 3.43Å; F209-P215 HydrophobicContact CE1-CG 3.77Å; F209-P215 HydrophobicContact CE2-CG 4.31Å; F209-P215 HydrophobicContact CG-CG 4.1Å; F209-P215 HydrophobicContact CZ-CG 4.02Å; P215-Y217 VanDerWaalsContact C-N 3.25Å; P215-Y217 PolarHBondContact O-N 3.05Å; P215-I218 PolarHBondContact O-N 2.65Å; P215-I218 VanDerWaalsContact O-N 3.13Å; P215-L219 WeakPolarHBondContact O-CG 3.43Å; P215-L219 PolarHBondContact O-N 3.3Å
216H94.5Very high94.6Very high21 Ų2128 Ų2810%0.09714%0.144CC..Hα-helixtrans-60.8-31.4178.857.4-77.7000113.5Q175 V178 F179 C214 E220Q175-H216 HydrophobicContact CG-CB 4.38Å; Q175-H216 PolarHBondContact NE2-O 2.76Å; V178-H216 HydrophobicContact CG1-CB 3.66Å; F179-H216 HydrophobicContact CE2-CB 4.07Å; F179-H216 HydrophobicContact CZ-CB 4.09Å; C214-H216 VanDerWaalsContact C-N 3.25Å; C214-H216 PolarHBondContact O-N 3.26Å; C214-H216 VanDerWaalsContact O-N 3.16Å; H216-E220 PolarHBondContact O-N 3.14Å; H216-E220 VanDerWaalsContact O-N 3.11Å
217Y95.1Very high95.1Very high33 Ų3327.1 Ų27.113%0.12914%0.135CC..Hα-helixtrans-72.3-38.4176-68.5-44000111.9C214 P215 E220 I221 Q249 C252 I253 N256C214-Y217 HydrophobicContact CB-CD2 3.45Å; C214-Y217 VanDerWaalsContact CB-CD2 3.45Å; C214-Y217 HydrophobicContact CB-CE2 4Å; C214-Y217 HydrophobicContact CB-CG 4.42Å; C214-Y217 PolarHBondContact O-N 3.07Å; C214-Y217 VanDerWaalsContact O-N 3.16Å; P215-Y217 VanDerWaalsContact C-N 3.25Å; P215-Y217 PolarHBondContact O-N 3.05Å; Y217-E220 WeakPolarHBondContact O-CB 3.5Å; Y217-E220 PolarHBondContact O-N 3.47Å; Y217-I221 WeakPolarHBondContact O-CG1 3.37Å; Y217-I221 PolarHBondContact O-N 2.87Å; Y217-I221 VanDerWaalsContact O-N 3.08Å; Y217-Q249 VanDerWaalsContact CE1-OE1 3.32Å; Y217-C252 HydrophobicContact CD1-CB 4.34Å; Y217-C252 HydrophobicContact CD2-CB 4.16Å; Y217-C252 HydrophobicContact CE1-CB 3.85Å; Y217-C252 HydrophobicContact CE2-CB 3.72Å; Y217-C252 HydrophobicContact CG-CB 4.48Å; Y217-I253 VanDerWaalsContact CB-CG1 3.49Å; Y217-I253 HydrophobicContact CD2-CG1 3.65Å; Y217-I253 HydrophobicContact CG-CG1 3.97Å; Y217-N256 PolarHBondContact OH-ND2 3.13Å
218I95.2Very high95.5Very high27 Ų2725.5 Ų25.514%0.13812%0.122CC..Hα-helixtrans-68.4-42.6176.7-53.8-176.6000110.8I212 P215 E220 I221 S222 I253 L274I212-I218 HydrophobicContact CD1-CD1 3.63Å; I212-I218 HydrophobicContact CG1-CD1 4.49Å; I212-I218 HydrophobicContact CG2-CD1 3.5Å; P215-I218 PolarHBondContact O-N 2.65Å; P215-I218 VanDerWaalsContact O-N 3.13Å; I218-E220 PolarHBondContact O-N 2.99Å; I218-I221 PolarHBondContact O-N 3.45Å; I218-S222 WeakPolarHBondContact O-CB 3.49Å; I218-S222 PolarHBondContact O-N 3.14Å; I218-S222 PolarHBondContact O-OG 3.43Å; I218-I253 HydrophobicContact CG1-CD1 3.85Å; I218-L274 HydrophobicContact CD1-CD1 3.82Å; I218-L274 VanDerWaalsContact CD1-O 3.31Å; I218-L274 WeakPolarHBondContact CD1-O 3.09Å; I218-L274 HydrophobicContact CG1-CD1 3.74Å; I218-L274 HydrophobicContact CG2-CD1 4.37Å
219L97Very high95.7Very high6 Ų628.2 Ų28.23%0.03114%0.137CC..Hα-helixtrans-61.3-36175-70.6169000111.3L171 L174 Q175 V178 M208 P215 S222 I223L171-L219 HydrophobicContact CD2-CD2 4.11Å; L174-L219 HydrophobicContact CB-CD1 4.03Å; L174-L219 HydrophobicContact CB-CD2 4.02Å; L174-L219 HydrophobicContact CD1-CD2 4.3Å; Q175-L219 HydrophobicContact CB-CB 4.07Å; Q175-L219 HydrophobicContact CB-CD1 3.81Å; Q175-L219 HydrophobicContact CG-CB 3.87Å; Q175-L219 HydrophobicContact CG-CD1 4.06Å; V178-L219 HydrophobicContact CG2-CD1 4.22Å; M208-L219 HydrophobicContact CE-CD1 4.21Å; M208-L219 HydrophobicContact CE-CD2 4.02Å; M208-L219 HydrophobicContact CE-CG 4.07Å; M208-L219 HydrophobicContact SD-CD1 3.74Å; M208-L219 HydrophobicContact SD-CD2 4.23Å; M208-L219 HydrophobicContact SD-CG 4.24Å; P215-L219 WeakPolarHBondContact O-CG 3.43Å; P215-L219 PolarHBondContact O-N 3.3Å; L219-S222 WeakPolarHBondContact O-CB 3.15Å; L219-S222 PolarHBondContact O-N 2.99Å; L219-I223 VanDerWaalsContact O-CG1 3.3Å; L219-I223 WeakPolarHBondContact O-CG1 3.41Å; L219-I223 PolarHBondContact O-N 3.16Å
220E97.5Very high96Very high11 Ų1128.9 Ų28.95%0.05114%0.14CC..Hα-helixtrans-64.4-48174.2-164.769.417800111.7H108 R112 Q175 H216 Y217 I218 S222 I223 Y224 T245 Q249H108-E220 IonicContact CE1-OE1 3.28Å; H108-E220 PolarHBondContact CE1-OE1 3.28Å; H108-E220 VanDerWaalsContact CE1-OE1 3.3Å; H108-E220 IonicContact CE1-OE2 3.06Å; H108-E220 PolarHBondContact CE1-OE2 2.96Å; H108-E220 IonicContact NE2-OE1 3.24Å; H108-E220 PolarHBondContact NE2-OE1 3.38Å; H108-E220 VanDerWaalsContact NE2-OE1 3.11Å; H108-E220 IonicContact NE2-OE2 2.8Å; R112-E220 IonicContact CZ-OE2 3.35Å; R112-E220 IonicContact NH1-OE1 3.92Å; R112-E220 IonicContact NH1-OE2 3.61Å; R112-E220 PolarHBondContact NH1-OE2 3.27Å; Q175-E220 PolarHBondContact NE2-OE2 2.81Å; Q175-E220 PolarHBondContact OE1-OE2 3.11Å; H216-E220 PolarHBondContact O-N 3.14Å; H216-E220 VanDerWaalsContact O-N 3.11Å; Y217-E220 WeakPolarHBondContact O-CB 3.5Å; Y217-E220 PolarHBondContact O-N 3.47Å; I218-E220 PolarHBondContact O-N 2.99Å; E220-S222 PolarHBondContact O-N 2.7Å; E220-I223 PolarHBondContact O-N 3.38Å; E220-Y224 HydrophobicContact CG-CD2 4.3Å; E220-Y224 HydrophobicContact CG-CE2 4.21Å; E220-Y224 WeakPolarHBondContact O-CD2 3.46Å; E220-Y224 PolarHBondContact O-N 2.8Å; E220-Y224 VanDerWaalsContact O-N 3.12Å; E220-Y224 WeakPolarHBondContact OE1-CE2 3.44Å; E220-T245 HydrophobicContact CG-CG2 4.19Å; E220-Q249 HydrophobicContact CB-CG 4.23Å; E220-Q249 HydrophobicContact CG-CG 4.34Å
221I97.4Very high96.3Very high18 Ų1824.5 Ų24.59%0.09212%0.119CC..Hα-helixtrans-56.5-43.9174.2-65.6168.9000110.1Y217 I218 I223 Y224 L225 M246 Q249 L250Y217-I221 WeakPolarHBondContact O-CG1 3.37Å; Y217-I221 PolarHBondContact O-N 2.87Å; Y217-I221 VanDerWaalsContact O-N 3.08Å; I218-I221 PolarHBondContact O-N 3.45Å; I221-I223 PolarHBondContact O-N 3.3Å; I221-Y224 PolarHBondContact O-N 2.95Å; I221-L225 VanDerWaalsContact O-CB 3.28Å; I221-L225 WeakPolarHBondContact O-CB 3.17Å; I221-L225 PolarHBondContact O-N 2.95Å; I221-M246 HydrophobicContact CG1-CG 4.48Å; I221-M246 HydrophobicContact CG2-CG 3.86Å; I221-Q249 HydrophobicContact CD1-CB 3.79Å; I221-Q249 HydrophobicContact CG1-CB 3.74Å; I221-Q249 HydrophobicContact CG1-CG 4.02Å; I221-L250 HydrophobicContact CD1-CD2 4.11Å; I221-L250 HydrophobicContact CD1-CG 4.11Å
222S97.8Very high96.7Very high38 Ų3818.3 Ų18.327%0.26610%0.097SC..Hα-helixtrans-62.6-40.8-178.8-570000112.1I218 L219 E220 S226I218-S222 WeakPolarHBondContact O-CB 3.49Å; I218-S222 PolarHBondContact O-N 3.14Å; I218-S222 PolarHBondContact O-OG 3.43Å; L219-S222 WeakPolarHBondContact O-CB 3.15Å; L219-S222 PolarHBondContact O-N 2.99Å; E220-S222 PolarHBondContact O-N 2.7Å; S222-S226 VanDerWaalsContact O-CB 3.29Å; S222-S226 WeakPolarHBondContact O-CB 3.27Å; S222-S226 PolarHBondContact O-N 3.29Å; S222-S226 PolarHBondContact O-OG 3.42Å
223I98.5Very high96.9Very high0 Ų022.8 Ų22.80%013%0.127CC..Hα-helixtrans-61.5-50175.3-75.7169000110.6M168 L171 Q172 L219 E220 I221 S226 F227M168-I223 HydrophobicContact CE-CB 4.34Å; M168-I223 HydrophobicContact CE-CG1 4.43Å; M168-I223 HydrophobicContact CE-CG2 3.75Å; L171-I223 HydrophobicContact CB-CD1 4.43Å; L171-I223 HydrophobicContact CB-CG1 3.83Å; L171-I223 HydrophobicContact CD1-CG1 4.08Å; Q172-I223 HydrophobicContact CG-CD1 4.17Å; L219-I223 VanDerWaalsContact O-CG1 3.3Å; L219-I223 WeakPolarHBondContact O-CG1 3.41Å; L219-I223 PolarHBondContact O-N 3.16Å; E220-I223 PolarHBondContact O-N 3.38Å; I221-I223 PolarHBondContact O-N 3.3Å; I223-S226 WeakPolarHBondContact O-CB 3.49Å; I223-S226 PolarHBondContact O-N 3.25Å; I223-F227 HydrophobicContact CG2-CD2 4.05Å; I223-F227 HydrophobicContact CG2-CE2 3.51Å; I223-F227 HydrophobicContact CG2-CZ 4.26Å; I223-F227 VanDerWaalsContact O-CD2 3.31Å; I223-F227 WeakPolarHBondContact O-CD2 3.24Å; I223-F227 PolarHBondContact O-N 3.42Å
224Y98.5Very high97.1Very high0 Ų029.1 Ų29.10%016%0.155CC..Hα-helixtrans-67.8-38.3-179.5-81.4-105.2000112.4Y105 H108 F138 T142 E220 I221 S226 F227 Q228 F238 I241 T245Y105-Y224 HydrophobicContact CE2-CE1 4.44Å; H108-Y224 AromaticContact NE2-CE2 3.86Å; F138-Y224 HydrophobicContact CE1-CE1 4.25Å; F138-Y224 AromaticContact CE1-CZ 3.96Å; F138-Y224 WeakPolarHBondContact CE1-OH 3.47Å; F138-Y224 AromaticContact CZ-CE1 3.58Å; F138-Y224 HydrophobicContact CZ-CE1 3.58Å; F138-Y224 AromaticContact CZ-CZ 3.68Å; F138-Y224 WeakPolarHBondContact CZ-OH 3.23Å; T142-Y224 HydrophobicContact CG2-CE1 4.31Å; E220-Y224 HydrophobicContact CG-CD2 4.3Å; E220-Y224 HydrophobicContact CG-CE2 4.21Å; E220-Y224 WeakPolarHBondContact O-CD2 3.46Å; E220-Y224 PolarHBondContact O-N 2.8Å; E220-Y224 VanDerWaalsContact O-N 3.12Å; E220-Y224 WeakPolarHBondContact OE1-CE2 3.44Å; I221-Y224 PolarHBondContact O-N 2.95Å; Y224-S226 VanDerWaalsContact C-N 3.3Å; Y224-S226 PolarHBondContact O-N 3.04Å; Y224-F227 PolarHBondContact O-N 2.77Å; Y224-Q228 PolarHBondContact O-N 3.07Å; Y224-F238 HydrophobicContact CD1-CE2 4.43Å; Y224-F238 AromaticContact CD1-CZ 3.82Å; Y224-F238 HydrophobicContact CD1-CZ 3.82Å; Y224-F238 HydrophobicContact CE1-CZ 4.38Å; Y224-F238 WeakPolarHBondContact O-CE1 3.49Å; Y224-I241 HydrophobicContact CD1-CG2 3.97Å; Y224-I241 HydrophobicContact CE1-CG2 3.64Å; Y224-T245 HydrophobicContact CD1-CG2 4.47Å; Y224-T245 HydrophobicContact CD2-CG2 3.93Å; Y224-T245 HydrophobicContact CE2-CG2 4.38Å; Y224-T245 HydrophobicContact CG-CG2 3.98Å
225L98.5Very high97.3Very high71 Ų7136.5 Ų36.537%0.37218%0.182SC..Hα-helixtrans-64.2-38.7175.1-178.561.4000111I221 Q228 L229 L242I221-L225 VanDerWaalsContact O-CB 3.28Å; I221-L225 WeakPolarHBondContact O-CB 3.17Å; I221-L225 PolarHBondContact O-N 2.95Å; L225-Q228 PolarHBondContact O-N 2.87Å; L225-L229 HydrophobicContact CD1-CD1 4.22Å; L225-L229 HydrophobicContact CD1-CG 4.16Å; L225-L229 HydrophobicContact CG-CD1 4.06Å; L225-L229 HydrophobicContact CG-CG 4.4Å; L225-L229 WeakPolarHBondContact O-CG 3.47Å; L225-L229 PolarHBondContact O-N 3.36Å; L225-L242 HydrophobicContact CB-CD1 4.22Å; L225-L242 HydrophobicContact CD1-CD2 3.93Å
226S98.5Very high97.3Very high18 Ų1836.9 Ų36.913%0.12618%0.184CC..Hα-helixtrans-63.7-41.8176-58.50000111.7H167 M168 S222 I223 Y224 F230H167-S226 PolarHBondContact NE2-OG 3.37Å; M168-S226 VanDerWaalsContact SD-CB 3.53Å; S222-S226 VanDerWaalsContact O-CB 3.29Å; S222-S226 WeakPolarHBondContact O-CB 3.27Å; S222-S226 PolarHBondContact O-N 3.29Å; S222-S226 PolarHBondContact O-OG 3.42Å; I223-S226 WeakPolarHBondContact O-CB 3.49Å; I223-S226 PolarHBondContact O-N 3.25Å; Y224-S226 VanDerWaalsContact C-N 3.3Å; Y224-S226 PolarHBondContact O-N 3.04Å; S226-F230 WeakPolarHBondContact O-CB 3.43Å; S226-F230 PolarHBondContact O-N 3.04Å
227F98.6Very high97.4Very high0 Ų037.1 Ų37.10%019%0.188CC..Hα-helixtrans-58.9-49.8171.5-71.4-49000111.9V101 M104 Y105 F164 M168 I223 Y224 F230 I231 F238V101-F227 HydrophobicContact CG1-CB 4.47Å; V101-F227 HydrophobicContact CG1-CD1 3.73Å; V101-F227 HydrophobicContact CG1-CE1 4.28Å; V101-F227 HydrophobicContact CG1-CG 4.32Å; M104-F227 HydrophobicContact CB-CE1 3.71Å; M104-F227 HydrophobicContact CB-CZ 4.23Å; Y105-F227 AromaticContact CD2-CE2 3.87Å; Y105-F227 HydrophobicContact CD2-CE2 3.87Å; Y105-F227 HydrophobicContact CD2-CZ 4.27Å; F164-F227 HydrophobicContact CE2-CD1 4.36Å; F164-F227 AromaticContact CZ-CD1 3.67Å; F164-F227 HydrophobicContact CZ-CD1 3.67Å; F164-F227 AromaticContact CZ-CE1 3.88Å; F164-F227 HydrophobicContact CZ-CE1 3.88Å; M168-F227 HydrophobicContact CE-CD1 3.97Å; M168-F227 HydrophobicContact CE-CD2 4.25Å; M168-F227 HydrophobicContact CE-CE1 3.39Å; M168-F227 HydrophobicContact CE-CE2 3.71Å; M168-F227 HydrophobicContact CE-CG 4.36Å; M168-F227 HydrophobicContact CE-CZ 3.24Å; M168-F227 HydrophobicContact SD-CE1 4.38Å; I223-F227 HydrophobicContact CG2-CD2 4.05Å; I223-F227 HydrophobicContact CG2-CE2 3.51Å; I223-F227 HydrophobicContact CG2-CZ 4.26Å; I223-F227 VanDerWaalsContact O-CD2 3.31Å; I223-F227 WeakPolarHBondContact O-CD2 3.24Å; I223-F227 PolarHBondContact O-N 3.42Å; Y224-F227 PolarHBondContact O-N 2.77Å; F227-F230 PolarHBondContact O-N 2.94Å; F227-I231 VanDerWaalsContact O-CG1 3.3Å; F227-I231 WeakPolarHBondContact O-CG1 3.15Å; F227-I231 PolarHBondContact O-N 3.34Å; F227-F238 HydrophobicContact CB-CE1 3.53Å; F227-F238 HydrophobicContact CB-CZ 3.59Å; F227-F238 HydrophobicContact CD2-CZ 4.12Å; F227-F238 HydrophobicContact CG-CZ 4.22Å
228Q98.4Very high97.6Very high10 Ų1035.5 Ų35.55%0.04718%0.182CC..Hα-helixtrans-57.4-55.1179.5173.166.850.900111.2Y224 L225 F230 I231 T232 K234 F238 S239 L242Y224-Q228 PolarHBondContact O-N 3.07Å; L225-Q228 PolarHBondContact O-N 2.87Å; Q228-F230 VanDerWaalsContact C-N 3.26Å; Q228-F230 PolarHBondContact O-N 3.12Å; Q228-I231 PolarHBondContact O-N 3.29Å; Q228-I231 VanDerWaalsContact O-N 3.14Å; Q228-T232 CarbonylContact C-O 3.6Å; Q228-T232 PolarHBondContact NE2-O 3.08Å; Q228-T232 CarbonylContact O-C 3.34Å; Q228-T232 PolarHBondContact O-N 3.2Å; Q228-K234 PolarHBondContact NE2-O 3.14Å; Q228-F238 HydrophobicContact CB-CD1 4.09Å; Q228-F238 HydrophobicContact CB-CE1 4.17Å; Q228-S239 VanDerWaalsContact CD-OG 3.25Å; Q228-S239 PolarHBondContact NE2-OG 3.45Å; Q228-S239 VanDerWaalsContact OE1-CA 3.25Å; Q228-S239 PolarHBondContact OE1-OG 2.98Å; Q228-L242 HydrophobicContact CB-CD2 3.66Å; Q228-L242 HydrophobicContact CG-CD2 3.74Å
229L98.1Very high97.7Very high94 Ų9434.5 Ų34.549%0.49218%0.177SC..Hα-helixtrans-62.9-33.9-177.7-67.9176.8000112.4R156 L225R156-L229 PolarHBondContact NH2-O 3.33Å; L225-L229 HydrophobicContact CD1-CD1 4.22Å; L225-L229 HydrophobicContact CD1-CG 4.16Å; L225-L229 HydrophobicContact CG-CD1 4.06Å; L225-L229 HydrophobicContact CG-CG 4.4Å; L225-L229 WeakPolarHBondContact O-CG 3.47Å; L225-L229 PolarHBondContact O-N 3.36Å
230F98.4Very high97.8Very high14 Ų1435.5 Ų35.56%0.06118%0.182CC..Hα-helixtrans-67.6-42175-173.1-99.3000112.1T97 V101 R156 V160 I161 F164 S226 F227 Q228T97-F230 HydrophobicContact CG2-CD1 3.96Å; T97-F230 HydrophobicContact CG2-CE1 3.74Å; V101-F230 HydrophobicContact CG2-CD1 3.48Å; V101-F230 VanDerWaalsContact CG2-CD1 3.48Å; V101-F230 HydrophobicContact CG2-CE1 3.96Å; R156-F230 HydrophobicContact CB-CE2 4.39Å; R156-F230 HydrophobicContact CB-CZ 4.08Å; R156-F230 HydrophobicContact CG-CE1 4.22Å; R156-F230 HydrophobicContact CG-CE2 4Å; R156-F230 HydrophobicContact CG-CZ 3.84Å; R156-F230 VanDerWaalsContact CZ-O 3.27Å; R156-F230 PolarHBondContact NE-O 3Å; R156-F230 PolarHBondContact NH2-O 2.87Å; V160-F230 HydrophobicContact CG1-CD2 4.46Å; V160-F230 HydrophobicContact CG1-CE2 3.9Å; I161-F230 HydrophobicContact CB-CZ 4.41Å; I161-F230 HydrophobicContact CG1-CZ 3.82Å; F164-F230 HydrophobicContact CB-CD2 3.41Å; F164-F230 VanDerWaalsContact CB-CD2 3.41Å; F164-F230 HydrophobicContact CB-CE2 3.22Å; F164-F230 HydrophobicContact CB-CG 4.28Å; F164-F230 HydrophobicContact CB-CZ 3.99Å; F164-F230 AromaticContact CD1-CD1 3.97Å; F164-F230 HydrophobicContact CD1-CD1 3.97Å; F164-F230 AromaticContact CD1-CD2 3.88Å; F164-F230 HydrophobicContact CD1-CD2 3.88Å; F164-F230 AromaticContact CD1-CE1 3.84Å; F164-F230 HydrophobicContact CD1-CE1 3.84Å; F164-F230 AromaticContact CD1-CE2 3.75Å; F164-F230 HydrophobicContact CD1-CE2 3.75Å; F164-F230 AromaticContact CD1-CG 3.96Å; F164-F230 HydrophobicContact CD1-CG 3.96Å; F164-F230 AromaticContact CD1-CZ 3.72Å; F164-F230 HydrophobicContact CD1-CZ 3.72Å; F164-F230 HydrophobicContact CD2-CB 3.66Å; F164-F230 HydrophobicContact CD2-CD1 4.27Å; F164-F230 AromaticContact CD2-CD2 3.41Å; F164-F230 HydrophobicContact CD2-CD2 3.41Å; F164-F230 VanDerWaalsContact CD2-CD2 3.41Å; F164-F230 HydrophobicContact CD2-CE2 4.06Å; F164-F230 AromaticContact CD2-CG 3.51Å; F164-F230 HydrophobicContact CD2-CG 3.51Å; F164-F230 AromaticContact CE1-CD1 3.94Å; F164-F230 HydrophobicContact CE1-CD1 3.94Å; F164-F230 HydrophobicContact CE1-CE1 4.07Å; F164-F230 HydrophobicContact CE1-CG 4.15Å; F164-F230 HydrophobicContact CE1-CZ 4.41Å; F164-F230 HydrophobicContact CE2-CB 3.56Å; F164-F230 HydrophobicContact CE2-CD1 4.24Å; F164-F230 HydrophobicContact CE2-CD2 4.12Å; F164-F230 AromaticContact CE2-CG 3.72Å; F164-F230 HydrophobicContact CE2-CG 3.72Å; F164-F230 HydrophobicContact CG-CB 4.31Å; F164-F230 HydrophobicContact CG-CD1 4.14Å; F164-F230 AromaticContact CG-CD2 3.27Å; F164-F230 HydrophobicContact CG-CD2 3.27Å; F164-F230 HydrophobicContact CG-CE1 4.25Å; F164-F230 AromaticContact CG-CE2 3.41Å; F164-F230 HydrophobicContact CG-CE2 3.41Å; F164-F230 VanDerWaalsContact CG-CE2 3.41Å; F164-F230 AromaticContact CG-CG 3.64Å; F164-F230 HydrophobicContact CG-CG 3.64Å; F164-F230 AromaticContact CG-CZ 3.9Å; F164-F230 HydrophobicContact CG-CZ 3.9Å; F164-F230 HydrophobicContact CZ-CB 4.15Å; F164-F230 HydrophobicContact CZ-CD1 4.09Å; F164-F230 HydrophobicContact CZ-CG 4.04Å; S226-F230 WeakPolarHBondContact O-CB 3.43Å; S226-F230 PolarHBondContact O-N 3.04Å; F227-F230 PolarHBondContact O-N 2.94Å; Q228-F230 VanDerWaalsContact C-N 3.26Å; Q228-F230 PolarHBondContact O-N 3.12Å
231I98Very high97.8Very high0 Ų035 Ų350%018%0.179CC..Hα-helixtrans-63.5-61.1172-60.4165.4000109.5I98 V101 A153 A154 F227 Q228 I236 F238I98-I231 HydrophobicContact CD1-CG2 4.41Å; V101-I231 HydrophobicContact CG1-CD1 4.26Å; V101-I231 HydrophobicContact CG1-CG1 4.45Å; V101-I231 HydrophobicContact CG2-CG1 3.91Å; A153-I231 HydrophobicContact CB-CG2 3.88Å; A154-I231 PolarHBondContact N-O 3.19Å; F227-I231 VanDerWaalsContact O-CG1 3.3Å; F227-I231 WeakPolarHBondContact O-CG1 3.15Å; F227-I231 PolarHBondContact O-N 3.34Å; Q228-I231 PolarHBondContact O-N 3.29Å; Q228-I231 VanDerWaalsContact O-N 3.14Å; I231-I236 HydrophobicContact CB-CD1 4.04Å; I231-I236 HydrophobicContact CD1-CD1 4.21Å; I231-I236 HydrophobicContact CG2-CD1 3.54Å; I231-F238 HydrophobicContact CD1-CB 4.23Å; I231-F238 HydrophobicContact CD1-CD1 4.14Å; I231-F238 HydrophobicContact CD1-CG 4.13Å
232T97.7Very high97.9Very high7 Ų734.9 Ų34.94%0.04318%0.178CC..  trans-174.1148.9-178.8-173.20000111.5N152 Q228 K234 I236N152-T232 WeakPolarHBondContact O-CB 3.43Å; N152-T232 PolarHBondContact O-OG1 3.46Å; Q228-T232 CarbonylContact C-O 3.6Å; Q228-T232 PolarHBondContact NE2-O 3.08Å; Q228-T232 CarbonylContact O-C 3.34Å; Q228-T232 PolarHBondContact O-N 3.2Å; T232-K234 HydrophobicContact CG2-CB 4.04Å; T232-K234 PolarHBondContact O-N 2.9Å; T232-K234 PolarHBondContact OG1-N 3.48Å; T232-I236 HydrophobicContact CG2-CD1 3.71Å; T232-I236 HydrophobicContact CG2-CG1 4.14Å; T232-I236 HydrophobicContact CG2-CG2 3.59Å
233P96.4Very high97.9Very high109 Ų10936.1 Ų36.171%0.70818%0.179SC*.SBendtrans-72.4-10.9170.130.8-36.4000113.5
234K96.7Very high97.9Very high133 Ų13336.8 Ų36.858%0.57818%0.182SC*.SBendtrans-72.4154.7179.4-64.8178.9179.3179.30112Q228 T232 I236Q228-K234 PolarHBondContact NE2-O 3.14Å; T232-K234 HydrophobicContact CG2-CB 4.04Å; T232-K234 PolarHBondContact O-N 2.9Å; T232-K234 PolarHBondContact OG1-N 3.48Å; K234-I236 PolarHBondContact O-N 3.33Å
235W96.7Very high97.8Very high156 Ų15636.9 Ų36.959%0.59118%0.183SC*.  trans-68.5123.7169.8-168.3-87000110.9H240 F243W235-H240 AromaticContact CE2-CE1 3.95Å; W235-H240 AromaticContact CZ2-CE1 3.76Å; W235-H240 AromaticContact CZ2-ND1 3.75Å; W235-H240 AromaticContact NE1-CD2 3.88Å; W235-H240 AromaticContact NE1-CE1 3.5Å; W235-H240 PolarHBondContact NE1-CE1 3.08Å; W235-H240 AromaticContact NE1-NE2 3.24Å; W235-H240 PolarHBondContact NE1-NE2 2.95Å; W235-F243 HydrophobicContact CH2-CB 4.1Å; W235-F243 HydrophobicContact CH2-CG 4.44Å
236I96.3Very high97.7Very high9 Ų936.9 Ų36.95%0.04618%0.182CC..  trans-138.7177.2-175.251.8168.2000110.5S149 N152 I231 T232 K234 F238 S239S149-I236 WeakPolarHBondContact OG-CD1 3.43Å; N152-I236 HydrophobicContact CB-CG2 3.51Å; I231-I236 HydrophobicContact CB-CD1 4.04Å; I231-I236 HydrophobicContact CD1-CD1 4.21Å; I231-I236 HydrophobicContact CG2-CD1 3.54Å; T232-I236 HydrophobicContact CG2-CD1 3.71Å; T232-I236 HydrophobicContact CG2-CG1 4.14Å; T232-I236 HydrophobicContact CG2-CG2 3.59Å; K234-I236 PolarHBondContact O-N 3.33Å; I236-F238 HydrophobicContact CD1-CB 3.96Å; I236-F238 HydrophobicContact CG1-CB 4.28Å; I236-F238 PolarHBondContact O-N 2.83Å; I236-S239 WeakPolarHBondContact CG1-OG 3.47Å; I236-S239 PolarHBondContact N-OG 2.97Å; I236-S239 WeakPolarHBondContact O-CB 3.37Å; I236-S239 PolarHBondContact O-N 3.08Å; I236-S239 PolarHBondContact O-OG 3.15Å
237S97Very high97.6Very high25 Ų2536.8 Ų36.818%0.17518%0.181CC..Hα-helixtrans-52.3-42.2176.2-63.20000112.7P13 S239 H240P13-S237 VanDerWaalsContact CB-O 3.31Å; P13-S237 WeakPolarHBondContact CB-O 3.2Å; S237-S239 VanDerWaalsContact C-N 3.27Å; S237-S239 PolarHBondContact O-N 3.04Å; S237-H240 PolarHBondContact O-N 2.75Å
238F97.9Very high97.4Very high0 Ų038.7 Ų38.70%019%0.191CC..Hα-helixtrans-67.1-22.9176.6-172.1-101.4000113.6T142 S145 I146 S149 Y224 F227 Q228 I231 I236 H240 I241 L242T142-F238 HydrophobicContact CG2-CE2 3.94Å; S145-F238 WeakPolarHBondContact OG-CD2 3.3Å; I146-F238 HydrophobicContact CD1-CD2 4.31Å; I146-F238 HydrophobicContact CD1-CE2 4Å; I146-F238 HydrophobicContact CG1-CD2 3.47Å; I146-F238 VanDerWaalsContact CG1-CD2 3.47Å; I146-F238 HydrophobicContact CG1-CE2 3.67Å; I146-F238 HydrophobicContact CG1-CG 4.38Å; S149-F238 PolarHBondContact OG-N 3.37Å; S149-F238 VanDerWaalsContact OG-N 3.16Å; Y224-F238 HydrophobicContact CD1-CE2 4.43Å; Y224-F238 AromaticContact CD1-CZ 3.82Å; Y224-F238 HydrophobicContact CD1-CZ 3.82Å; Y224-F238 HydrophobicContact CE1-CZ 4.38Å; Y224-F238 WeakPolarHBondContact O-CE1 3.49Å; F227-F238 HydrophobicContact CB-CE1 3.53Å; F227-F238 HydrophobicContact CB-CZ 3.59Å; F227-F238 HydrophobicContact CD2-CZ 4.12Å; F227-F238 HydrophobicContact CG-CZ 4.22Å; Q228-F238 HydrophobicContact CB-CD1 4.09Å; Q228-F238 HydrophobicContact CB-CE1 4.17Å; I231-F238 HydrophobicContact CD1-CB 4.23Å; I231-F238 HydrophobicContact CD1-CD1 4.14Å; I231-F238 HydrophobicContact CD1-CG 4.13Å; I236-F238 HydrophobicContact CD1-CB 3.96Å; I236-F238 HydrophobicContact CG1-CB 4.28Å; I236-F238 PolarHBondContact O-N 2.83Å; F238-H240 PolarHBondContact O-N 2.89Å; F238-I241 HydrophobicContact CD2-CB 4.36Å; F238-I241 HydrophobicContact CE2-CG2 4.28Å; F238-I241 WeakPolarHBondContact O-CB 3.48Å; F238-I241 PolarHBondContact O-N 3.19Å; F238-L242 PolarHBondContact O-N 3.08Å
239S98.3Very high97.2Very high5 Ų539.4 Ų39.44%0.03520%0.195CC..Hα-helixtrans-63.4-30.5178.5-52.40000112.1Q228 I236 S237 I241 L242 F243Q228-S239 VanDerWaalsContact CD-OG 3.25Å; Q228-S239 PolarHBondContact NE2-OG 3.45Å; Q228-S239 VanDerWaalsContact OE1-CA 3.25Å; Q228-S239 PolarHBondContact OE1-OG 2.98Å; I236-S239 WeakPolarHBondContact CG1-OG 3.47Å; I236-S239 PolarHBondContact N-OG 2.97Å; I236-S239 WeakPolarHBondContact O-CB 3.37Å; I236-S239 PolarHBondContact O-N 3.08Å; I236-S239 PolarHBondContact O-OG 3.15Å; S237-S239 VanDerWaalsContact C-N 3.27Å; S237-S239 PolarHBondContact O-N 3.04Å; S239-I241 VanDerWaalsContact C-N 3.32Å; S239-I241 PolarHBondContact O-N 3.34Å; S239-L242 PolarHBondContact O-N 2.8Å; S239-F243 VanDerWaalsContact O-CB 3.28Å; S239-F243 WeakPolarHBondContact O-CB 3.31Å; S239-F243 PolarHBondContact O-N 2.71Å
240H98.2Very high97Very high28 Ų2837.3 Ų37.313%0.1318%0.184CC..Hα-helixtrans-65.1-36.3173.8-66.1-76.5000112.6P13 S17 W235 S237 F238 F244P13-H240 HydrophobicContact CB-CB 3.93Å; P13-H240 WeakPolarHBondContact O-CB 3.41Å; S17-H240 WeakPolarHBondContact OG-CA 3.49Å; S17-H240 WeakPolarHBondContact OG-CB 3.26Å; S17-H240 PolarHBondContact OG-ND1 3.1Å; W235-H240 AromaticContact CE2-CE1 3.95Å; W235-H240 AromaticContact CZ2-CE1 3.76Å; W235-H240 AromaticContact CZ2-ND1 3.75Å; W235-H240 AromaticContact NE1-CD2 3.88Å; W235-H240 AromaticContact NE1-CE1 3.5Å; W235-H240 PolarHBondContact NE1-CE1 3.08Å; W235-H240 AromaticContact NE1-NE2 3.24Å; W235-H240 PolarHBondContact NE1-NE2 2.95Å; S237-H240 PolarHBondContact O-N 2.75Å; F238-H240 PolarHBondContact O-N 2.89Å; H240-F244 PolarHBondContact O-N 3.05Å; H240-F244 VanDerWaalsContact O-N 3.07Å
241I98.3Very high96.7Very high0 Ų037.6 Ų37.60%019%0.187CC..Hα-helixtrans-69.5-48175.2-59.5-52.6000110.3P13 F16 F138 I141 T142 S145 Y224 F238 S239 F243 F244 T245P13-I241 HydrophobicContact CB-CD1 4.5Å; F16-I241 HydrophobicContact CB-CD1 4.17Å; F16-I241 HydrophobicContact CD2-CD1 3.78Å; F16-I241 HydrophobicContact CG-CD1 4.06Å; F138-I241 HydrophobicContact CD2-CG2 4.35Å; F138-I241 HydrophobicContact CE2-CG2 3.45Å; F138-I241 VanDerWaalsContact CE2-CG2 3.45Å; F138-I241 HydrophobicContact CZ-CG2 3.74Å; I141-I241 HydrophobicContact CG2-CD1 4.24Å; T142-I241 HydrophobicContact CG2-CG2 3.96Å; T142-I241 WeakPolarHBondContact OG1-CG2 3.49Å; S145-I241 VanDerWaalsContact OG-CG1 3.28Å; S145-I241 WeakPolarHBondContact OG-CG1 3.44Å; Y224-I241 HydrophobicContact CD1-CG2 3.97Å; Y224-I241 HydrophobicContact CE1-CG2 3.64Å; F238-I241 HydrophobicContact CD2-CB 4.36Å; F238-I241 HydrophobicContact CE2-CG2 4.28Å; F238-I241 WeakPolarHBondContact O-CB 3.48Å; F238-I241 PolarHBondContact O-N 3.19Å; S239-I241 VanDerWaalsContact C-N 3.32Å; S239-I241 PolarHBondContact O-N 3.34Å; I241-F243 VanDerWaalsContact C-N 3.31Å; I241-F243 PolarHBondContact O-N 3.42Å; I241-F244 PolarHBondContact O-N 3.07Å; I241-T245 PolarHBondContact O-N 3.48Å; I241-T245 PolarHBondContact O-OG1 3.03Å; I241-T245 VanDerWaalsContact O-OG1 3.09Å
242L98.4Very high96.4Very high15 Ų1538 Ų388%0.07919%0.189CC..Hα-helixtrans-55.9-47.6174.6169.661.4000111.3L225 Q228 F238 S239 F244 T245 M246L225-L242 HydrophobicContact CB-CD1 4.22Å; L225-L242 HydrophobicContact CD1-CD2 3.93Å; Q228-L242 HydrophobicContact CB-CD2 3.66Å; Q228-L242 HydrophobicContact CG-CD2 3.74Å; F238-L242 PolarHBondContact O-N 3.08Å; S239-L242 PolarHBondContact O-N 2.8Å; L242-F244 PolarHBondContact O-N 3.07Å; L242-T245 WeakPolarHBondContact O-CB 3.3Å; L242-T245 PolarHBondContact O-N 3.24Å; L242-M246 HydrophobicContact CD1-CG 3.97Å; L242-M246 HydrophobicContact CD1-SD 4Å; L242-M246 HydrophobicContact CG-CG 4.46Å; L242-M246 HydrophobicContact CG-SD 4.09Å; L242-M246 WeakPolarHBondContact O-CG 3.38Å; L242-M246 PolarHBondContact O-N 3.31Å
243F98.3Very high96.2Very high65 Ų6537.6 Ų37.629%0.28519%0.187SC..Hα-helixtrans-59.7-46.6-179.9177.8-94000111.7I21 W235 S239 I241 T245 M246 C247I21-F243 HydrophobicContact CG1-CE1 3.91Å; I21-F243 HydrophobicContact CG1-CZ 4.08Å; W235-F243 HydrophobicContact CH2-CB 4.1Å; W235-F243 HydrophobicContact CH2-CG 4.44Å; S239-F243 VanDerWaalsContact O-CB 3.28Å; S239-F243 WeakPolarHBondContact O-CB 3.31Å; S239-F243 PolarHBondContact O-N 2.71Å; I241-F243 VanDerWaalsContact C-N 3.31Å; I241-F243 PolarHBondContact O-N 3.42Å; F243-T245 PolarHBondContact O-N 2.86Å; F243-M246 PolarHBondContact O-N 2.89Å; F243-C247 VanDerWaalsContact CZ-SG 3.59Å; F243-C247 PolarHBondContact O-N 3.3Å; F243-C247 PolarHBondContact O-SG 2.77Å; F243-C247 VanDerWaalsContact O-SG 3.39Å
244F97.9Very high95.9Very high13 Ų1334.8 Ų34.86%0.05716%0.163CC..Hα-helixtrans-59.5-46.4174.2173.4-97.9000112.4F16 L19 M134 F138 H240 I241 L242 M246 C247 N248F16-F244 HydrophobicContact CB-CB 3.78Å; F16-F244 HydrophobicContact CB-CD2 4.33Å; F16-F244 HydrophobicContact CB-CG 3.99Å; F16-F244 AromaticContact CD1-CD1 3.87Å; F16-F244 HydrophobicContact CD1-CD1 3.87Å; F16-F244 AromaticContact CD1-CD2 3.99Å; F16-F244 HydrophobicContact CD1-CD2 3.99Å; F16-F244 HydrophobicContact CD1-CE1 4.01Å; F16-F244 HydrophobicContact CD1-CE2 4.14Å; F16-F244 AromaticContact CD1-CG 3.84Å; F16-F244 HydrophobicContact CD1-CG 3.84Å; F16-F244 HydrophobicContact CD1-CZ 4.15Å; F16-F244 HydrophobicContact CE1-CE1 4.45Å; F16-F244 HydrophobicContact CG-CG 4.37Å; F16-F244 WeakPolarHBondContact O-CB 3.42Å; F16-F244 VanDerWaalsContact O-CD2 3.24Å; F16-F244 WeakPolarHBondContact O-CD2 3.39Å; L19-F244 HydrophobicContact CB-CD2 4.07Å; L19-F244 HydrophobicContact CB-CE2 3.91Å; M134-F244 HydrophobicContact CE-CE2 4.43Å; M134-F244 HydrophobicContact CE-CZ 3.89Å; M134-F244 HydrophobicContact CG-CE2 4.33Å; M134-F244 HydrophobicContact CG-CZ 3.85Å; M134-F244 HydrophobicContact SD-CE2 3.65Å; M134-F244 HydrophobicContact SD-CZ 3.53Å; M134-F244 VanDerWaalsContact SD-CZ 3.53Å; F138-F244 AromaticContact CD2-CD1 3.42Å; F138-F244 HydrophobicContact CD2-CD1 3.42Å; F138-F244 VanDerWaalsContact CD2-CD1 3.42Å; F138-F244 AromaticContact CD2-CE1 3.58Å; F138-F244 HydrophobicContact CD2-CE1 3.58Å; F138-F244 AromaticContact CE2-CD1 3.47Å; F138-F244 HydrophobicContact CE2-CD1 3.47Å; F138-F244 VanDerWaalsContact CE2-CD1 3.47Å; F138-F244 AromaticContact CE2-CE1 3.95Å; F138-F244 HydrophobicContact CE2-CE1 3.95Å; F138-F244 HydrophobicContact CG-CD1 4.45Å; F138-F244 HydrophobicContact CG-CE1 4.2Å; H240-F244 PolarHBondContact O-N 3.05Å; H240-F244 VanDerWaalsContact O-N 3.07Å; I241-F244 PolarHBondContact O-N 3.07Å; L242-F244 PolarHBondContact O-N 3.07Å; F244-M246 VanDerWaalsContact C-N 3.32Å; F244-M246 PolarHBondContact O-N 3.06Å; F244-C247 PolarHBondContact O-N 3.4Å; F244-N248 HydrophobicContact CZ-CB 4.46Å; F244-N248 WeakPolarHBondContact O-CB 3.4Å; F244-N248 PolarHBondContact O-N 2.89Å
245T97.6Very high95.6Very high2 Ų229.4 Ų29.41%0.01214%0.14CC..Hα-helixtrans-56.3-48.2176.2-62.50000110.4F138 E220 Y224 I241 L242 F243 N248 Q249F138-T245 WeakPolarHBondContact CZ-OG1 3.46Å; E220-T245 HydrophobicContact CG-CG2 4.19Å; Y224-T245 HydrophobicContact CD1-CG2 4.47Å; Y224-T245 HydrophobicContact CD2-CG2 3.93Å; Y224-T245 HydrophobicContact CE2-CG2 4.38Å; Y224-T245 HydrophobicContact CG-CG2 3.98Å; I241-T245 PolarHBondContact O-N 3.48Å; I241-T245 PolarHBondContact O-OG1 3.03Å; I241-T245 VanDerWaalsContact O-OG1 3.09Å; L242-T245 WeakPolarHBondContact O-CB 3.3Å; L242-T245 PolarHBondContact O-N 3.24Å; F243-T245 PolarHBondContact O-N 2.86Å; T245-N248 PolarHBondContact O-N 3.24Å; T245-Q249 HydrophobicContact CG2-CG 3.96Å; T245-Q249 VanDerWaalsContact O-CB 3.32Å; T245-Q249 WeakPolarHBondContact O-CB 3.23Å; T245-Q249 WeakPolarHBondContact O-CG 3.4Å; T245-Q249 PolarHBondContact O-N 3.4Å
246M96.8Very high95.3Very high71 Ų7123.6 Ų23.635%0.3512%0.12SC..Hα-helixtrans-58.2-52.6177.4-72.917968.100111.9I221 L242 F243 F244 N248 Q249 L250I221-M246 HydrophobicContact CG1-CG 4.48Å; I221-M246 HydrophobicContact CG2-CG 3.86Å; L242-M246 HydrophobicContact CD1-CG 3.97Å; L242-M246 HydrophobicContact CD1-SD 4Å; L242-M246 HydrophobicContact CG-CG 4.46Å; L242-M246 HydrophobicContact CG-SD 4.09Å; L242-M246 WeakPolarHBondContact O-CG 3.38Å; L242-M246 PolarHBondContact O-N 3.31Å; F243-M246 PolarHBondContact O-N 2.89Å; F244-M246 VanDerWaalsContact C-N 3.32Å; F244-M246 PolarHBondContact O-N 3.06Å; M246-N248 PolarHBondContact O-N 3.24Å; M246-Q249 PolarHBondContact O-N 2.75Å; M246-L250 VanDerWaalsContact O-CB 3.26Å; M246-L250 WeakPolarHBondContact O-CB 3.45Å; M246-L250 WeakPolarHBondContact O-CG 3.39Å; M246-L250 PolarHBondContact O-N 3.47Å
247C95.7Very high95Very high16 Ų1624 Ų2411%0.10812%0.122CC..Hα-helixtrans-56.2-49.4178.3-71.50000112.2V24 F243 F244 C251V24-C247 HydrophobicContact CG2-CB 3.8Å; F243-C247 VanDerWaalsContact CZ-SG 3.59Å; F243-C247 PolarHBondContact O-N 3.3Å; F243-C247 PolarHBondContact O-SG 2.77Å; F243-C247 VanDerWaalsContact O-SG 3.39Å; F244-C247 PolarHBondContact O-N 3.4Å; C247-C251 WeakPolarHBondContact O-CB 3.33Å; C247-C251 PolarHBondContact O-N 2.71Å
248N93.8Very high94.7Very high41 Ų4125.3 Ų25.322%0.21913%0.127CC..Hα-helixtrans-64.1-49.2-178.7-178.676.4000111.6F244 T245 M246 C251 C252F244-N248 HydrophobicContact CZ-CB 4.46Å; F244-N248 WeakPolarHBondContact O-CB 3.4Å; F244-N248 PolarHBondContact O-N 2.89Å; T245-N248 PolarHBondContact O-N 3.24Å; M246-N248 PolarHBondContact O-N 3.24Å; N248-C251 PolarHBondContact O-N 3.23Å; N248-C252 PolarHBondContact O-N 2.76Å; N248-C252 PolarHBondContact O-SG 3.23Å; N248-C252 VanDerWaalsContact O-SG 3.35Å
249Q94.9Very high94.3Very high25 Ų2526.8 Ų26.812%0.11713%0.133CC..Hα-helixtrans-67.7-40.1-177.9-63.3-36.5-26.100112.3Y217 E220 I221 T245 M246 C252 I253Y217-Q249 VanDerWaalsContact CE1-OE1 3.32Å; E220-Q249 HydrophobicContact CB-CG 4.23Å; E220-Q249 HydrophobicContact CG-CG 4.34Å; I221-Q249 HydrophobicContact CD1-CB 3.79Å; I221-Q249 HydrophobicContact CG1-CB 3.74Å; I221-Q249 HydrophobicContact CG1-CG 4.02Å; T245-Q249 HydrophobicContact CG2-CG 3.96Å; T245-Q249 VanDerWaalsContact O-CB 3.32Å; T245-Q249 WeakPolarHBondContact O-CB 3.23Å; T245-Q249 WeakPolarHBondContact O-CG 3.4Å; T245-Q249 PolarHBondContact O-N 3.4Å; M246-Q249 PolarHBondContact O-N 2.75Å; Q249-C252 PolarHBondContact O-N 2.84Å; Q249-I253 VanDerWaalsContact O-CG1 3.29Å; Q249-I253 WeakPolarHBondContact O-CG1 3.46Å; Q249-I253 PolarHBondContact O-N 3.48Å
250L94.2Very high94Very high50 Ų5027 Ų2726%0.26213%0.133SC..Hα-helixtrans-63.9-41.2175.7-69.4172.6000111.5I221 M246 C252 I253 W254 L274 W279I221-L250 HydrophobicContact CD1-CD2 4.11Å; I221-L250 HydrophobicContact CD1-CG 4.11Å; M246-L250 VanDerWaalsContact O-CB 3.26Å; M246-L250 WeakPolarHBondContact O-CB 3.45Å; M246-L250 WeakPolarHBondContact O-CG 3.39Å; M246-L250 PolarHBondContact O-N 3.47Å; L250-C252 VanDerWaalsContact C-N 3.35Å; L250-C252 PolarHBondContact O-N 2.89Å; L250-I253 HydrophobicContact CD2-CD1 4.41Å; L250-I253 PolarHBondContact O-N 3.26Å; L250-W254 PolarHBondContact O-N 3.31Å; L250-L274 HydrophobicContact CD2-CD1 4.07Å; L250-L274 HydrophobicContact CD2-CD2 3.95Å; L250-W279 HydrophobicContact CD2-CZ3 4.32Å
251C91.9Very high93.7Very high20 Ų2030.8 Ų30.814%0.13515%0.151CC..Hα-helixtrans-61.9-42.9173.3-1720000111.6C247 N248 W254 L255C247-C251 WeakPolarHBondContact O-CB 3.33Å; C247-C251 PolarHBondContact O-N 2.71Å; N248-C251 PolarHBondContact O-N 3.23Å; C251-W254 PolarHBondContact O-N 3.38Å; C251-L255 WeakPolarHBondContact O-CG 3.4Å; C251-L255 PolarHBondContact O-N 3.01Å
252C91.7Very high93.3Very high7 Ų739.4 Ų39.45%0.04719%0.188CC..Hα-helixtrans-64.4-39.7175.8-72.70000112.7Y217 N248 Q249 L250 N256Y217-C252 HydrophobicContact CD1-CB 4.34Å; Y217-C252 HydrophobicContact CD2-CB 4.16Å; Y217-C252 HydrophobicContact CE1-CB 3.85Å; Y217-C252 HydrophobicContact CE2-CB 3.72Å; Y217-C252 HydrophobicContact CG-CB 4.48Å; N248-C252 PolarHBondContact O-N 2.76Å; N248-C252 PolarHBondContact O-SG 3.23Å; N248-C252 VanDerWaalsContact O-SG 3.35Å; Q249-C252 PolarHBondContact O-N 2.84Å; L250-C252 VanDerWaalsContact C-N 3.35Å; L250-C252 PolarHBondContact O-N 2.89Å; C252-N256 WeakPolarHBondContact O-CB 3.39Å; C252-N256 PolarHBondContact O-N 3.16Å; C252-N256 PolarHBondContact O-ND2 2.75Å
253I92.7Very high92.9Very high0 Ų042.4 Ų42.40%020%0.204CC..Hα-helixtrans-58.2-51.7174.4-73168.2000109.4C214 Y217 I218 Q249 L250 L255 N256 H257 M273 L274C214-I253 HydrophobicContact CB-CG1 4.36Å; Y217-I253 VanDerWaalsContact CB-CG1 3.49Å; Y217-I253 HydrophobicContact CD2-CG1 3.65Å; Y217-I253 HydrophobicContact CG-CG1 3.97Å; I218-I253 HydrophobicContact CG1-CD1 3.85Å; Q249-I253 VanDerWaalsContact O-CG1 3.29Å; Q249-I253 WeakPolarHBondContact O-CG1 3.46Å; Q249-I253 PolarHBondContact O-N 3.48Å; L250-I253 HydrophobicContact CD2-CD1 4.41Å; L250-I253 PolarHBondContact O-N 3.26Å; I253-L255 PolarHBondContact O-N 3Å; I253-N256 PolarHBondContact O-N 3.14Å; I253-H257 VanDerWaalsContact O-CB 3.26Å; I253-H257 WeakPolarHBondContact O-CB 3.35Å; I253-H257 PolarHBondContact O-N 3.29Å; I253-M273 HydrophobicContact CG2-CB 3.73Å; I253-M273 HydrophobicContact CG2-CG 4.29Å; I253-M273 WeakPolarHBondContact CG2-O 3.48Å; I253-L274 HydrophobicContact CD1-CD1 4.16Å
254W91.1Very high92.6Very high50 Ų5041.9 Ų41.919%0.18920%0.202CC..Hα-helixtrans-59.1-48.6-179.5175.979.8000112.1Y30 H31 L250 C251 N256 H257 N258Y30-W254 AromaticContact CD1-CH2 3.81Å; Y30-W254 HydrophobicContact CD1-CH2 3.81Å; Y30-W254 AromaticContact CD1-CZ3 3.83Å; Y30-W254 HydrophobicContact CD1-CZ3 3.83Å; Y30-W254 HydrophobicContact CE1-CH2 4.44Å; H31-W254 HydrophobicContact CB-CH2 3.82Å; H31-W254 HydrophobicContact CB-CZ2 3.75Å; H31-W254 AromaticContact CG-CZ2 3.92Å; H31-W254 AromaticContact ND1-CZ2 3.5Å; H31-W254 WeakPolarHBondContact ND1-CZ2 3.49Å; L250-W254 PolarHBondContact O-N 3.31Å; C251-W254 PolarHBondContact O-N 3.38Å; W254-N256 PolarHBondContact O-N 3.09Å; W254-H257 PolarHBondContact O-N 3.02Å; W254-N258 WeakPolarHBondContact CZ2-ND2 3.15Å; W254-N258 PolarHBondContact NE1-ND2 3.02Å; W254-N258 VanDerWaalsContact NE1-ND2 3.13Å; W254-N258 WeakPolarHBondContact O-CB 3.41Å; W254-N258 VanDerWaalsContact O-CG 3.25Å; W254-N258 PolarHBondContact O-N 2.9Å; W254-N258 PolarHBondContact O-ND2 3.46Å
255L89.4Confident92.3Very high20 Ų2045 Ų4511%0.10522%0.224CC..Hα-helixtrans-60.3-45.8177.8-74.2170.6000112.4Y30 L45 L46 C251 I253 W259Y30-L255 HydrophobicContact CD1-CD2 4Å; Y30-L255 HydrophobicContact CE1-CD2 3.99Å; L45-L255 HydrophobicContact CB-CD1 4.29Å; L46-L255 HydrophobicContact CD2-CD2 3.93Å; C251-L255 WeakPolarHBondContact O-CG 3.4Å; C251-L255 PolarHBondContact O-N 3.01Å; I253-L255 PolarHBondContact O-N 3Å; L255-W259 WeakPolarHBondContact O-CB 3.29Å; L255-W259 PolarHBondContact O-N 2.89Å; L255-W259 VanDerWaalsContact O-N 3.12Å
256N90Very high92Very high33 Ų3352.8 Ų52.818%0.17626%0.26CS..Hα-helixtrans-71.5-40.1-178.5-80-83.4000111.8C214 Y217 C252 I253 W254 W259 Y260C214-N256 VanDerWaalsContact SG-CB 3.56Å; Y217-N256 PolarHBondContact OH-ND2 3.13Å; C252-N256 WeakPolarHBondContact O-CB 3.39Å; C252-N256 PolarHBondContact O-N 3.16Å; C252-N256 PolarHBondContact O-ND2 2.75Å; I253-N256 PolarHBondContact O-N 3.14Å; W254-N256 PolarHBondContact O-N 3.09Å; N256-W259 WeakPolarHBondContact O-CB 3.28Å; N256-W259 PolarHBondContact O-N 3.49Å; N256-Y260 WeakPolarHBondContact O-CD2 3.25Å; N256-Y260 PolarHBondContact O-N 3.03Å
257H91.5Very high91.7Very high18 Ų1850.4 Ų50.48%0.08325%0.247CC..Hα-helixtrans-63.4-46178.2-174.495.4000111.2T213 I253 W254 W259 Y260 Q261 T268 M273T213-H257 HydrophobicContact CG2-CB 4.28Å; T213-H257 PolarHBondContact OG1-CE1 2.95Å; T213-H257 PolarHBondContact OG1-ND1 3.48Å; I253-H257 VanDerWaalsContact O-CB 3.26Å; I253-H257 WeakPolarHBondContact O-CB 3.35Å; I253-H257 PolarHBondContact O-N 3.29Å; W254-H257 PolarHBondContact O-N 3.02Å; H257-W259 VanDerWaalsContact C-N 3.28Å; H257-W259 PolarHBondContact O-N 3.19Å; H257-Y260 CarbonylContact O-C 3.55Å; H257-Y260 PolarHBondContact O-N 2.87Å; H257-Q261 WeakPolarHBondContact O-CB 3.44Å; H257-Q261 PolarHBondContact O-N 2.93Å; H257-T268 WeakPolarHBondContact CE1-CG2 3.34Å; H257-T268 WeakPolarHBondContact NE2-CG2 3.17Å; H257-M273 HydrophobicContact CB-CG 3.56Å; H257-M273 HydrophobicContact CB-SD 4.13Å; H257-M273 VanDerWaalsContact CD2-CG 3.47Å; H257-M273 WeakPolarHBondContact CD2-CG 3.49Å; H257-M273 WeakPolarHBondContact ND1-CG 3.23Å
258N89.9Confident91.5Very high53 Ų5349.8 Ų49.828%0.28324%0.243SC..Hα-helixtrans-61.2-38.6175.5-69.1-16.7000112.2W254 Q261 K262W254-N258 WeakPolarHBondContact CZ2-ND2 3.15Å; W254-N258 PolarHBondContact NE1-ND2 3.02Å; W254-N258 VanDerWaalsContact NE1-ND2 3.13Å; W254-N258 WeakPolarHBondContact O-CB 3.41Å; W254-N258 VanDerWaalsContact O-CG 3.25Å; W254-N258 PolarHBondContact O-N 2.9Å; W254-N258 PolarHBondContact O-ND2 3.46Å; N258-Q261 PolarHBondContact O-N 3.31Å; N258-K262 WeakPolarHBondContact O-CB 2.84Å; N258-K262 PolarHBondContact O-N 2.98Å
259W90.2Very high91.2Very high31 Ų3152.4 Ų52.412%0.11726%0.264CS..Hα-helixtrans-62.5-44.6173.4-175.496.3000111.1K49 Y201 L255 N256 H257 K262 N263 F264K49-W259 HydrophobicContact CB-CD2 4.05Å; K49-W259 HydrophobicContact CB-CG 4.34Å; K49-W259 HydrophobicContact CB-CZ2 4.06Å; K49-W259 HydrophobicContact CD-CD2 3.78Å; K49-W259 HydrophobicContact CD-CE3 3.6Å; K49-W259 HydrophobicContact CD-CH2 3.72Å; K49-W259 HydrophobicContact CD-CZ2 3.82Å; K49-W259 HydrophobicContact CD-CZ3 3.59Å; K49-W259 PolarHBondContact O-NE1 3.37Å; Y201-W259 HydrophobicContact CD1-CH2 4.03Å; Y201-W259 HydrophobicContact CD1-CZ2 4.46Å; Y201-W259 AromaticContact CD2-CH2 3.75Å; Y201-W259 HydrophobicContact CD2-CH2 3.75Å; Y201-W259 AromaticContact CD2-CZ2 3.66Å; Y201-W259 HydrophobicContact CD2-CZ2 3.66Å; Y201-W259 HydrophobicContact CE2-CH2 4.45Å; Y201-W259 HydrophobicContact CE2-CZ2 4.02Å; Y201-W259 AromaticContact CG-CH2 3.5Å; Y201-W259 HydrophobicContact CG-CH2 3.5Å; Y201-W259 AromaticContact CG-CZ2 3.91Å; Y201-W259 HydrophobicContact CG-CZ2 3.91Å; L255-W259 WeakPolarHBondContact O-CB 3.29Å; L255-W259 PolarHBondContact O-N 2.89Å; L255-W259 VanDerWaalsContact O-N 3.12Å; N256-W259 WeakPolarHBondContact O-CB 3.28Å; N256-W259 PolarHBondContact O-N 3.49Å; H257-W259 VanDerWaalsContact C-N 3.28Å; H257-W259 PolarHBondContact O-N 3.19Å; W259-K262 PolarHBondContact O-N 3.2Å; W259-N263 VanDerWaalsContact CE2-ND2 3.33Å; W259-N263 HydrophobicContact CH2-CB 4.34Å; W259-N263 HydrophobicContact CZ3-CB 4.43Å; W259-N263 PolarHBondContact O-N 3.1Å; W259-N263 VanDerWaalsContact O-N 3.16Å; W259-N263 PolarHBondContact O-ND2 2.79Å; W259-F264 AromaticContact CH2-CE2 3.93Å; W259-F264 HydrophobicContact CH2-CE2 3.93Å; W259-F264 HydrophobicContact CZ3-CD2 4.31Å; W259-F264 AromaticContact CZ3-CE2 3.85Å; W259-F264 HydrophobicContact CZ3-CE2 3.85Å
260Y91Very high91Very high9 Ų959.1 Ų59.14%0.03529%0.293CS..Hα-helixtrans-65.2-40.4175.9-82.7-68.1000112.2K49 P204 T213 N256 H257 K262 N263 F264 W267 T268K49-Y260 PolarHBondContact NZ-OH 3.24Å; P204-Y260 WeakPolarHBondContact CD-OH 3.43Å; T213-Y260 HydrophobicContact CG2-CD2 3.36Å; T213-Y260 HydrophobicContact CG2-CE2 4Å; T213-Y260 HydrophobicContact CG2-CG 3.98Å; N256-Y260 WeakPolarHBondContact O-CD2 3.25Å; N256-Y260 PolarHBondContact O-N 3.03Å; H257-Y260 CarbonylContact O-C 3.55Å; H257-Y260 PolarHBondContact O-N 2.87Å; Y260-K262 VanDerWaalsContact C-N 3.3Å; Y260-K262 PolarHBondContact O-N 3.28Å; Y260-N263 PolarHBondContact O-N 3.48Å; Y260-F264 AromaticContact CD1-CD2 3.82Å; Y260-F264 HydrophobicContact CD1-CD2 3.82Å; Y260-F264 HydrophobicContact CD1-CE2 4.39Å; Y260-F264 HydrophobicContact CE1-CD2 4.4Å; Y260-F264 CarbonylContact O-C 3.5Å; Y260-F264 WeakPolarHBondContact O-CA 3.33Å; Y260-F264 PolarHBondContact O-N 3.33Å; Y260-W267 HydrophobicContact CD1-CE3 4.25Å; Y260-W267 AromaticContact CD1-CZ3 3.92Å; Y260-W267 HydrophobicContact CD1-CZ3 3.92Å; Y260-W267 HydrophobicContact CD2-CZ3 4.36Å; Y260-W267 HydrophobicContact CE1-CZ3 4.43Å; Y260-W267 HydrophobicContact CG-CE3 4.47Å; Y260-W267 AromaticContact CG-CZ3 3.88Å; Y260-W267 HydrophobicContact CG-CZ3 3.88Å; Y260-T268 PolarHBondContact O-OG1 3.35Å; Y260-T268 VanDerWaalsContact O-OG1 3.11Å
261Q91.4Very high90.8Very high107 Ų10757.9 Ų57.950%0.529%0.285SS..Hα-helixtrans-59.9-41177.2-169.1179.111.400111.6H257 N258 P265 T268H257-Q261 WeakPolarHBondContact O-CB 3.44Å; H257-Q261 PolarHBondContact O-N 2.93Å; N258-Q261 PolarHBondContact O-N 3.31Å; Q261-P265 WeakPolarHBondContact O-CA 3.29Å; Q261-P265 WeakPolarHBondContact O-CB 3.38Å; Q261-T268 HydrophobicContact CB-CG2 3.97Å; Q261-T268 HydrophobicContact CG-CG2 4.49Å; Q261-T268 PolarHBondContact N-OG1 3.36Å
262K90.7Very high90.6Very high182 Ų18257.5 Ų57.579%0.79128%0.283SS*.Hα-helixtrans-69.2-35.7177.7-175.8175.6179177.10113.4N258 W259 Y260N258-K262 WeakPolarHBondContact O-CB 2.84Å; N258-K262 PolarHBondContact O-N 2.98Å; W259-K262 PolarHBondContact O-N 3.2Å; Y260-K262 VanDerWaalsContact C-N 3.3Å; Y260-K262 PolarHBondContact O-N 3.28Å
263N89.8Confident90.2Very high78 Ų7858.4 Ų58.442%0.41729%0.287SS..Hα-helixtrans-98.5-25.5-173-68.7-85.9000113.7W259 Y260W259-N263 VanDerWaalsContact CE2-ND2 3.33Å; W259-N263 HydrophobicContact CH2-CB 4.34Å; W259-N263 HydrophobicContact CZ3-CB 4.43Å; W259-N263 PolarHBondContact O-N 3.1Å; W259-N263 VanDerWaalsContact O-N 3.16Å; W259-N263 PolarHBondContact O-ND2 2.79Å; Y260-N263 PolarHBondContact O-N 3.48Å
264F91.6Very high89.5Confident53 Ų5360.5 Ų60.523%0.23230%0.298CS..  trans-143.964.5-175.2-52.5-80.3000110.4Y201 P203 W259 Y260 E266 W267 T268Y201-F264 WeakPolarHBondContact O-CZ 3.33Å; P203-F264 HydrophobicContact CB-CD1 4.49Å; P203-F264 HydrophobicContact CB-CG 4.3Å; P203-F264 HydrophobicContact CG-CD1 4.06Å; P203-F264 HydrophobicContact CG-CE1 4.4Å; P203-F264 HydrophobicContact CG-CG 4.36Å; W259-F264 AromaticContact CH2-CE2 3.93Å; W259-F264 HydrophobicContact CH2-CE2 3.93Å; W259-F264 HydrophobicContact CZ3-CD2 4.31Å; W259-F264 AromaticContact CZ3-CE2 3.85Å; W259-F264 HydrophobicContact CZ3-CE2 3.85Å; Y260-F264 AromaticContact CD1-CD2 3.82Å; Y260-F264 HydrophobicContact CD1-CD2 3.82Å; Y260-F264 HydrophobicContact CD1-CE2 4.39Å; Y260-F264 HydrophobicContact CE1-CD2 4.4Å; Y260-F264 CarbonylContact O-C 3.5Å; Y260-F264 WeakPolarHBondContact O-CA 3.33Å; Y260-F264 PolarHBondContact O-N 3.33Å; F264-E266 PolarHBondContact O-N 3.35Å; F264-W267 HydrophobicContact CB-CB 3.92Å; F264-W267 PolarHBondContact O-N 3.47Å; F264-T268 WeakPolarHBondContact O-CB 3.14Å; F264-T268 PolarHBondContact O-N 3.22Å; F264-T268 PolarHBondContact O-OG1 2.67Å
265P91.4Very high88.8Confident80 Ų8062 Ų6252%0.51931%0.309SS..Hα-helixtrans-60.8-42.6-173.322.4-33.1000113Q261 W267 T268 S269Q261-P265 WeakPolarHBondContact O-CA 3.29Å; Q261-P265 WeakPolarHBondContact O-CB 3.38Å; P265-W267 VanDerWaalsContact C-N 3.32Å; P265-W267 PolarHBondContact O-N 3.26Å; P265-T268 PolarHBondContact O-N 3.33Å; P265-S269 WeakPolarHBondContact O-CB 3.47Å; P265-S269 PolarHBondContact O-N 2.91Å
266E91.6Very high87.8Confident165 Ų16563.2 Ų63.277%0.77132%0.318SS*.Hα-helixtrans-65.5-33.6178.7-64.3-175.7173.900113.4F264 S269F264-E266 PolarHBondContact O-N 3.35Å; E266-S269 PolarHBondContact O-OG 3.29Å; E266-S269 VanDerWaalsContact O-OG 3.07Å
267W92Very high86.5Confident21 Ų2172.2 Ų72.28%0.0835%0.351CS..Hα-helixtrans-72.8-42.3175.5179.291.8000110.5P203 P204 E205 T213 Y260 F264 P265 R271P203-W267 HydrophobicContact CB-CB 4.36Å; P203-W267 HydrophobicContact CB-CD2 3.56Å; P203-W267 HydrophobicContact CB-CE3 4.22Å; P203-W267 HydrophobicContact CB-CG 3.58Å; P203-W267 HydrophobicContact CB-CZ2 4.28Å; P203-W267 HydrophobicContact CG-CG 4.11Å; P204-W267 HydrophobicContact CG-CH2 3.96Å; P204-W267 HydrophobicContact CG-CZ2 3.73Å; P204-W267 VanDerWaalsContact O-CE2 3.32Å; P204-W267 WeakPolarHBondContact O-CZ2 3.49Å; P204-W267 PolarHBondContact O-NE1 2.93Å; E205-W267 PolarHBondContact OE1-NE1 3.26Å; T213-W267 HydrophobicContact CG2-CH2 4.01Å; T213-W267 HydrophobicContact CG2-CZ3 3.78Å; Y260-W267 HydrophobicContact CD1-CE3 4.25Å; Y260-W267 AromaticContact CD1-CZ3 3.92Å; Y260-W267 HydrophobicContact CD1-CZ3 3.92Å; Y260-W267 HydrophobicContact CD2-CZ3 4.36Å; Y260-W267 HydrophobicContact CE1-CZ3 4.43Å; Y260-W267 HydrophobicContact CG-CE3 4.47Å; Y260-W267 AromaticContact CG-CZ3 3.88Å; Y260-W267 HydrophobicContact CG-CZ3 3.88Å; F264-W267 HydrophobicContact CB-CB 3.92Å; F264-W267 PolarHBondContact O-N 3.47Å; P265-W267 VanDerWaalsContact C-N 3.32Å; P265-W267 PolarHBondContact O-N 3.26Å; W267-R271 VanDerWaalsContact CD1-CZ 3.5Å; W267-R271 VanDerWaalsContact CH2-CD 3.48Å; W267-R271 PolarHBondContact O-NH1 3.25Å
268T90.1Very high85.4Confident3 Ų377.8 Ų77.82%0.01838%0.38CS..Hα-helixtrans-72.7-33.3-174.8-50.30000112H257 Y260 Q261 F264 P265 K270 R271H257-T268 WeakPolarHBondContact CE1-CG2 3.34Å; H257-T268 WeakPolarHBondContact NE2-CG2 3.17Å; Y260-T268 PolarHBondContact O-OG1 3.35Å; Y260-T268 VanDerWaalsContact O-OG1 3.11Å; Q261-T268 HydrophobicContact CB-CG2 3.97Å; Q261-T268 HydrophobicContact CG-CG2 4.49Å; Q261-T268 PolarHBondContact N-OG1 3.36Å; F264-T268 WeakPolarHBondContact O-CB 3.14Å; F264-T268 PolarHBondContact O-N 3.22Å; F264-T268 PolarHBondContact O-OG1 2.67Å; P265-T268 PolarHBondContact O-N 3.33Å; T268-K270 PolarHBondContact O-N 3.41Å; T268-R271 PolarHBondContact O-N 2.83Å; T268-R271 VanDerWaalsContact O-O 3.11Å
269S88.6Confident83.6Confident95 Ų9581.1 Ų81.166%0.66439%0.389SS*.THydrogen-bonded Turntrans-60.5-19.6-177.9650000114.9P265 E266P265-S269 WeakPolarHBondContact O-CB 3.47Å; P265-S269 PolarHBondContact O-N 2.91Å; E266-S269 PolarHBondContact O-OG 3.29Å; E266-S269 VanDerWaalsContact O-OG 3.07Å
270K89.5Confident83.3Confident167 Ų16783.7 Ų83.773%0.72640%0.402SS*.THydrogen-bonded Turntrans-93.11179-59.7-178.5-175.5176.90113.6T268T268-K270 PolarHBondContact O-N 3.41Å
271R91.1Very high82.9Confident24 Ų2487.6 Ų87.69%0.09142%0.421CS..  trans-131.2141.4-168.2-68.8162.6174.489.8-0.3111E205 F209 W211 W267 T268E205-R271 IonicContact OE1-CZ 3.61Å; E205-R271 IonicContact OE1-NH1 3.9Å; E205-R271 IonicContact OE1-NH2 3.3Å; E205-R271 PolarHBondContact OE1-NH2 3.21Å; E205-R271 IonicContact OE2-NH2 2.89Å; E205-R271 PolarHBondContact OE2-NH2 3.39Å; F209-R271 WeakPolarHBondContact O-CD 3.2Å; F209-R271 PolarHBondContact O-NE 2.92Å; F209-R271 PolarHBondContact O-NH2 3.46Å; W211-R271 WeakPolarHBondContact O-CA 3.4Å; W267-R271 VanDerWaalsContact CD1-CZ 3.5Å; W267-R271 VanDerWaalsContact CH2-CD 3.48Å; W267-R271 PolarHBondContact O-NH1 3.25Å; T268-R271 PolarHBondContact O-N 2.83Å; T268-R271 VanDerWaalsContact O-O 3.11Å
272A86.9Confident82.4Confident11 Ų1186.5 Ų86.59%0.09142%0.417CS..BIsolated β-bridgetrans-85.8160.8173.200000112.1W211 I212 T213 I275W211-A272 PolarHBondContact O-N 2.73Å; I212-A272 WeakPolarHBondContact CA-O 3.47Å; T213-A272 PolarHBondContact N-O 3.29Å; A272-I275 VanDerWaalsContact CB-O 3.26Å; A272-I275 WeakPolarHBondContact CB-O 3.07Å
273M83.3Confident81.9Confident26 Ų2680.9 Ų80.913%0.12840%0.395CS..SBendtrans-71.2-48.1167.4-75.5-179.6-88.100111.4I253 H257 W279I253-M273 HydrophobicContact CG2-CB 3.73Å; I253-M273 HydrophobicContact CG2-CG 4.29Å; I253-M273 WeakPolarHBondContact CG2-O 3.48Å; H257-M273 HydrophobicContact CB-CG 3.56Å; H257-M273 HydrophobicContact CB-SD 4.13Å; H257-M273 VanDerWaalsContact CD2-CG 3.47Å; H257-M273 WeakPolarHBondContact CD2-CG 3.49Å; H257-M273 WeakPolarHBondContact ND1-CG 3.23Å; M273-W279 WeakPolarHBondContact CA-O 3.22Å; M273-W279 WeakPolarHBondContact CB-O 3.4Å; M273-W279 VanDerWaalsContact CE-CD1 3.47Å; M273-W279 HydrophobicContact CE-CD2 4.35Å; M273-W279 HydrophobicContact CE-CG 4.21Å; M273-W279 HydrophobicContact CE-CZ2 4.35Å; M273-W279 PolarHBondContact N-O 3.35Å; M273-W279 HydrophobicContact SD-CZ2 4.13Å
274L78.8Confident81.4Confident44 Ų4481.1 Ų81.123%0.2339%0.394CS..SBendtrans-132.5-60.5-171.3-174.468.1000112.7I218 L250 I253 W279I218-L274 HydrophobicContact CD1-CD1 3.82Å; I218-L274 VanDerWaalsContact CD1-O 3.31Å; I218-L274 WeakPolarHBondContact CD1-O 3.09Å; I218-L274 HydrophobicContact CG1-CD1 3.74Å; I218-L274 HydrophobicContact CG2-CD1 4.37Å; L250-L274 HydrophobicContact CD2-CD1 4.07Å; L250-L274 HydrophobicContact CD2-CD2 3.95Å; I253-L274 HydrophobicContact CD1-CD1 4.16Å; L274-W279 WeakPolarHBondContact CA-OXT 3.43Å; L274-W279 HydrophobicContact CB-CE3 3.84Å; L274-W279 HydrophobicContact CB-CZ3 4.23Å; L274-W279 HydrophobicContact CD2-CE3 4.01Å; L274-W279 HydrophobicContact CD2-CZ3 4.07Å; L274-W279 PolarHBondContact N-OXT 2.78Å
275I75.4Confident80.8Confident82 Ų8282.9 Ų82.942%0.42140%0.404SS..SBendtrans-110.8114.4-176.4-54.5174.4000107.7A272 Y277 I278 W279A272-I275 VanDerWaalsContact CB-O 3.26Å; A272-I275 WeakPolarHBondContact CB-O 3.07Å; I275-Y277 PolarHBondContact O-N 2.91Å; I275-I278 HydrophobicContact CB-CB 4.06Å; I275-I278 HydrophobicContact CB-CD1 4.49Å; I275-I278 HydrophobicContact CB-CG1 4.44Å; I275-I278 HydrophobicContact CG2-CB 4.04Å; I275-I278 HydrophobicContact CG2-CD1 3.71Å; I275-I278 HydrophobicContact CG2-CG1 3.86Å; I275-I278 PolarHBondContact O-N 3.12Å; I275-W279 PolarHBondContact N-OXT 3.03Å; I275-W279 PolarHBondContact O-N 3.07Å
276P68.3Low80Confident45 Ų4583.1 Ų83.129%0.29240%0.396SS..THydrogen-bonded Turntrans-46.3129.3173.2-28.336000110.5W211 I212 I278W211-P276 HydrophobicContact CB-CG 4.07Å; I212-P276 HydrophobicContact CD1-CG 4.11Å; I212-P276 HydrophobicContact CG1-CG 4.01Å; P276-I278 VanDerWaalsContact C-N 3.29Å; P276-I278 PolarHBondContact O-N 3.07Å
277Y63.8Low79.1Confident222 Ų22276.8 Ų76.887%0.87137%0.367SS*.THydrogen-bonded Turntrans71.42.7178.6-39.9-76.5000117.3I275I275-Y277 PolarHBondContact O-N 2.91Å
278I67.8Low78Confident136 Ų13681.5 Ų81.570%0.69739%0.391SS*.THydrogen-bonded Turntrans-119.6-59.6176.1-54-175.3000111.6I275 P276I275-I278 HydrophobicContact CB-CB 4.06Å; I275-I278 HydrophobicContact CB-CD1 4.49Å; I275-I278 HydrophobicContact CB-CG1 4.44Å; I275-I278 HydrophobicContact CG2-CB 4.04Å; I275-I278 HydrophobicContact CG2-CD1 3.71Å; I275-I278 HydrophobicContact CG2-CG1 3.86Å; I275-I278 PolarHBondContact O-N 3.12Å; P276-I278 VanDerWaalsContact C-N 3.29Å; P276-I278 PolarHBondContact O-N 3.07Å
279W53Low76.9Confident123 Ų12388.6 Ų88.647%0.46643%0.425SS..  trans-1540-176.9-173.960.5000109.1L250 M273 L274 I275L250-W279 HydrophobicContact CD2-CZ3 4.32Å; M273-W279 WeakPolarHBondContact CA-O 3.22Å; M273-W279 WeakPolarHBondContact CB-O 3.4Å; M273-W279 VanDerWaalsContact CE-CD1 3.47Å; M273-W279 HydrophobicContact CE-CD2 4.35Å; M273-W279 HydrophobicContact CE-CG 4.21Å; M273-W279 HydrophobicContact CE-CZ2 4.35Å; M273-W279 PolarHBondContact N-O 3.35Å; M273-W279 HydrophobicContact SD-CZ2 4.13Å; L274-W279 WeakPolarHBondContact CA-OXT 3.43Å; L274-W279 HydrophobicContact CB-CE3 3.84Å; L274-W279 HydrophobicContact CB-CZ3 4.23Å; L274-W279 HydrophobicContact CD2-CE3 4.01Å; L274-W279 HydrophobicContact CD2-CZ3 4.07Å; L274-W279 PolarHBondContact N-OXT 2.78Å; I275-W279 PolarHBondContact N-OXT 3.03Å; I275-W279 PolarHBondContact O-N 3.07Å

Retrieved 279 of 279 residues in 187.3 ms (Link to these results)

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