A6Z2S4_HUMAN Loading...

NADH-ubiquinone oxidoreductase chain 1

AlphaFold DB , UniProt , Accession A6Z2S4, Species HUMAN (Homo sapiens, Human), Gene ND1, Length 318 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
1M64.1Low88.8Confident185 Ų18589.2 Ų89.291%0.91149%0.489SS*.  0-51.10-61.8-48-15000114.1M3 A4 N5M1-M3 PolarHBondContact O-N 2.96Å; M1-A4 PolarHBondContact O-N 3.18Å; M1-N5 PolarHBondContact O-N 3.47Å; M1-N5 VanDerWaalsContact O-N 3.09Å
2P78.8Confident89.3Confident107 Ų10787.4 Ų87.470%0.69549%0.485SS*.Hα-helixtrans-65.3-39.8-176.725.2-33.7000112.9A4 N5 L6P2-A4 VanDerWaalsContact C-N 3.33Å; P2-A4 PolarHBondContact O-N 2.93Å; P2-N5 PolarHBondContact O-N 3.5Å; P2-L6 PolarHBondContact O-N 3.34Å
3M88.2Confident89.7Confident120 Ų12081.5 Ų81.559%0.59145%0.452SS*.Hα-helixtrans-65.5-35.4176.6-169.662.3-172.800112.8M1 L6 L7M1-M3 PolarHBondContact O-N 2.96Å; M3-L6 HydrophobicContact CE-CD2 4.42Å; M3-L6 PolarHBondContact O-N 3.14Å; M3-L6 HydrophobicContact SD-CD2 4.32Å; M3-L7 HydrophobicContact CE-CD1 4.41Å; M3-L7 HydrophobicContact CE-CD2 4.44Å; M3-L7 HydrophobicContact CE-CG 4.29Å; M3-L7 HydrophobicContact CG-CD1 4.47Å; M3-L7 WeakPolarHBondContact O-CG 3.37Å; M3-L7 PolarHBondContact O-N 3.07Å
4A92.2Very high90.1Very high45 Ų4579.7 Ų79.737%0.37244%0.441SS..Hα-helixtrans-67.3-43.8176.900000111M1 P2 L6 L7 L8M1-A4 PolarHBondContact O-N 3.18Å; P2-A4 VanDerWaalsContact C-N 3.33Å; P2-A4 PolarHBondContact O-N 2.93Å; A4-L6 VanDerWaalsContact C-N 3.33Å; A4-L6 PolarHBondContact O-N 3.29Å; A4-L7 PolarHBondContact O-N 2.75Å; A4-L8 WeakPolarHBondContact O-CB 3.37Å; A4-L8 VanDerWaalsContact O-CG 3.28Å; A4-L8 WeakPolarHBondContact O-CG 3.21Å; A4-L8 PolarHBondContact O-N 3.21Å
5N91.7Very high90.4Very high88 Ų8879.8 Ų79.847%0.47144%0.439SS..Hα-helixtrans-62.5-39.5175.5-69.73.1000112M1 P2 L8 L9 L95M1-N5 PolarHBondContact O-N 3.47Å; M1-N5 VanDerWaalsContact O-N 3.09Å; P2-N5 PolarHBondContact O-N 3.5Å; N5-L8 PolarHBondContact O-N 3.01Å; N5-L9 PolarHBondContact O-N 3.16Å; N5-L95 HydrophobicContact CB-CD1 3.72Å
6L92.5Very high90.7Very high66 Ų6677.7 Ų77.735%0.34644%0.435SS..Hα-helixtrans-63.5-43.5176.1-177.8145.9000111.7P2 M3 A4 L9 I10P2-L6 PolarHBondContact O-N 3.34Å; M3-L6 HydrophobicContact CE-CD2 4.42Å; M3-L6 PolarHBondContact O-N 3.14Å; M3-L6 HydrophobicContact SD-CD2 4.32Å; A4-L6 VanDerWaalsContact C-N 3.33Å; A4-L6 PolarHBondContact O-N 3.29Å; L6-L9 PolarHBondContact O-N 2.88Å; L6-I10 HydrophobicContact CD2-CD1 3.44Å; L6-I10 VanDerWaalsContact CD2-CD1 3.44Å; L6-I10 HydrophobicContact CD2-CG1 4.43Å; L6-I10 HydrophobicContact CG-CD1 3.88Å; L6-I10 WeakPolarHBondContact O-CG1 3.19Å; L6-I10 PolarHBondContact O-N 2.99Å
7L92.6Very high90.9Very high88 Ų8873.4 Ų73.446%0.46141%0.411SS..Hα-helixtrans-65.3-41175.1-72.7169.6000112M3 A4 L9 I10 V11M3-L7 HydrophobicContact CE-CD1 4.41Å; M3-L7 HydrophobicContact CE-CD2 4.44Å; M3-L7 HydrophobicContact CE-CG 4.29Å; M3-L7 HydrophobicContact CG-CD1 4.47Å; M3-L7 WeakPolarHBondContact O-CG 3.37Å; M3-L7 PolarHBondContact O-N 3.07Å; A4-L7 PolarHBondContact O-N 2.75Å; L7-L9 PolarHBondContact O-N 3.31Å; L7-I10 PolarHBondContact O-N 2.86Å; L7-V11 WeakPolarHBondContact O-CB 2.92Å; L7-V11 WeakPolarHBondContact O-CG2 3.16Å; L7-V11 PolarHBondContact O-N 2.66Å
8L93.5Very high91.1Very high126 Ų12670.3 Ų70.366%0.6640%0.396SS*.Hα-helixtrans-65.8-21.4175.4-74.1167.5000113.1A4 N5 P12A4-L8 WeakPolarHBondContact O-CB 3.37Å; A4-L8 VanDerWaalsContact O-CG 3.28Å; A4-L8 WeakPolarHBondContact O-CG 3.21Å; A4-L8 PolarHBondContact O-N 3.21Å; N5-L8 PolarHBondContact O-N 3.01Å; L8-P12 WeakPolarHBondContact O-CD 3.39Å; L8-P12 WeakPolarHBondContact O-CG 3.3Å
9L93.3Very high91.3Very high37 Ų3770.1 Ų70.119%0.19439%0.391CS..Hα-helixtrans-82-54.2171.3-176.869.2000110.9N5 L6 L7 P12 I13 W86 L95N5-L9 PolarHBondContact O-N 3.16Å; L6-L9 PolarHBondContact O-N 2.88Å; L7-L9 PolarHBondContact O-N 3.31Å; L9-P12 WeakPolarHBondContact O-CD 3.38Å; L9-I13 HydrophobicContact CD1-CD1 3.86Å; L9-I13 HydrophobicContact CG-CD1 3.73Å; L9-I13 WeakPolarHBondContact O-CD1 3.09Å; L9-I13 WeakPolarHBondContact O-CG1 3.47Å; L9-I13 PolarHBondContact O-N 3.14Å; L9-W86 HydrophobicContact CD2-CB 4.23Å; L9-L95 HydrophobicContact CD2-CB 4.21Å; L9-L95 HydrophobicContact CD2-CD2 3.81Å
10I94.6Very high91.5Very high44 Ų4467.2 Ų67.223%0.22637%0.374CS..Hα-helixtrans-68.8-42.9-169.8-64.9173.8000112.1L6 L7 I13 L14 L83L6-I10 HydrophobicContact CD2-CD1 3.44Å; L6-I10 VanDerWaalsContact CD2-CD1 3.44Å; L6-I10 HydrophobicContact CD2-CG1 4.43Å; L6-I10 HydrophobicContact CG-CD1 3.88Å; L6-I10 WeakPolarHBondContact O-CG1 3.19Å; L6-I10 PolarHBondContact O-N 2.99Å; L7-I10 PolarHBondContact O-N 2.86Å; I10-I13 PolarHBondContact O-N 2.94Å; I10-L14 HydrophobicContact CG2-CD1 3.94Å; I10-L14 HydrophobicContact CG2-CG 4.33Å; I10-L14 WeakPolarHBondContact O-CG 3.47Å; I10-L14 PolarHBondContact O-N 3.45Å; I10-L83 HydrophobicContact CG2-CD1 4.18Å; I10-L83 HydrophobicContact CG2-CD2 4.18Å
11V95.1Very high91.5Very high75 Ų7566 Ų6646%0.45537%0.366SS..Hα-helixtrans-63.4-49.4-174.6172.90000111.5L7 I13 L14 I15L7-V11 WeakPolarHBondContact O-CB 2.92Å; L7-V11 WeakPolarHBondContact O-CG2 3.16Å; L7-V11 PolarHBondContact O-N 2.66Å; V11-I13 VanDerWaalsContact C-N 3.32Å; V11-I13 PolarHBondContact O-N 3.35Å; V11-L14 PolarHBondContact O-N 3.46Å; V11-I15 HydrophobicContact CG1-CD1 3.8Å; V11-I15 VanDerWaalsContact O-CG1 3.32Å; V11-I15 WeakPolarHBondContact O-CG1 3.38Å; V11-I15 PolarHBondContact O-N 2.95Å; V11-I15 VanDerWaalsContact O-N 3.07Å
12P94.9Very high93Very high68 Ų6857.6 Ų57.644%0.44233%0.325SS..Hα-helixtrans-62.1-34.6175.2-27.338.9000114L8 L9 I15 A16L8-P12 WeakPolarHBondContact O-CD 3.39Å; L8-P12 WeakPolarHBondContact O-CG 3.3Å; L9-P12 WeakPolarHBondContact O-CD 3.38Å; P12-I15 PolarHBondContact O-N 3.49Å; P12-A16 VanDerWaalsContact O-CB 3.27Å; P12-A16 WeakPolarHBondContact O-CB 3.35Å; P12-A16 PolarHBondContact O-N 3.39Å
13I95.3Very high93.7Very high11 Ų1155.2 Ų55.26%0.05631%0.309CS..Hα-helixtrans-63.3-45.3177-68.2163.3000110.9L9 I10 V11 I15 A16 M17 L83 W86 T229L9-I13 HydrophobicContact CD1-CD1 3.86Å; L9-I13 HydrophobicContact CG-CD1 3.73Å; L9-I13 WeakPolarHBondContact O-CD1 3.09Å; L9-I13 WeakPolarHBondContact O-CG1 3.47Å; L9-I13 PolarHBondContact O-N 3.14Å; I10-I13 PolarHBondContact O-N 2.94Å; V11-I13 VanDerWaalsContact C-N 3.32Å; V11-I13 PolarHBondContact O-N 3.35Å; I13-I15 VanDerWaalsContact C-N 3.32Å; I13-I15 PolarHBondContact O-N 2.94Å; I13-A16 PolarHBondContact O-N 3.03Å; I13-M17 WeakPolarHBondContact O-CB 3.37Å; I13-M17 PolarHBondContact O-N 3.17Å; I13-L83 HydrophobicContact CG2-CD2 4.41Å; I13-W86 HydrophobicContact CD1-CB 3.93Å; I13-W86 HydrophobicContact CD1-CD2 3.44Å; I13-W86 VanDerWaalsContact CD1-CD2 3.44Å; I13-W86 HydrophobicContact CD1-CE3 3.62Å; I13-W86 HydrophobicContact CD1-CG 3.58Å; I13-W86 HydrophobicContact CD1-CZ3 4.25Å; I13-W86 HydrophobicContact CG1-CD2 4.07Å; I13-W86 HydrophobicContact CG1-CE3 4.03Å; I13-W86 HydrophobicContact CG1-CH2 4.3Å; I13-W86 HydrophobicContact CG1-CZ2 4.37Å; I13-W86 HydrophobicContact CG1-CZ3 4.15Å; I13-W86 HydrophobicContact CG2-CD2 4.48Å; I13-W86 HydrophobicContact CG2-CZ2 3.97Å; I13-T229 HydrophobicContact CG2-CG2 3.93Å
14L94.3Very high94Very high56 Ų5649.8 Ų49.829%0.29328%0.282SS..Hα-helixtrans-65-37.7177.5-68.4174.6000111.7I10 V11 M17 A18 L83I10-L14 HydrophobicContact CG2-CD1 3.94Å; I10-L14 HydrophobicContact CG2-CG 4.33Å; I10-L14 WeakPolarHBondContact O-CG 3.47Å; I10-L14 PolarHBondContact O-N 3.45Å; V11-L14 PolarHBondContact O-N 3.46Å; L14-M17 HydrophobicContact CD2-CE 3.97Å; L14-M17 WeakPolarHBondContact O-CE 3.37Å; L14-A18 PolarHBondContact O-N 3.36Å; L14-L83 HydrophobicContact CD2-CD2 4.49Å
15I95.3Very high94Very high81 Ų8152.4 Ų52.442%0.41528%0.282SS..Hα-helixtrans-65.6-44.5174.1-65.8167.2000110.6V11 P12 I13 M17 A18 F19V11-I15 HydrophobicContact CG1-CD1 3.8Å; V11-I15 VanDerWaalsContact O-CG1 3.32Å; V11-I15 WeakPolarHBondContact O-CG1 3.38Å; V11-I15 PolarHBondContact O-N 2.95Å; V11-I15 VanDerWaalsContact O-N 3.07Å; P12-I15 PolarHBondContact O-N 3.49Å; I13-I15 VanDerWaalsContact C-N 3.32Å; I13-I15 PolarHBondContact O-N 2.94Å; I15-M17 VanDerWaalsContact C-N 3.34Å; I15-M17 PolarHBondContact O-N 3.21Å; I15-A18 WeakPolarHBondContact O-CB 3.09Å; I15-A18 PolarHBondContact O-N 2.93Å; I15-A18 VanDerWaalsContact O-N 3.17Å; I15-F19 HydrophobicContact CG2-CD2 3.73Å; I15-F19 HydrophobicContact CG2-CE2 3.67Å; I15-F19 VanDerWaalsContact O-CD2 3.28Å; I15-F19 WeakPolarHBondContact O-CD2 3.3Å; I15-F19 PolarHBondContact O-N 2.98Å
16A94.8Very high94.1Very high46 Ų4650 Ų5038%0.3827%0.268SS..Hα-helixtrans-61.1-43.4178.200000111.4P12 I13 A18 F19 L20 I232P12-A16 VanDerWaalsContact O-CB 3.27Å; P12-A16 WeakPolarHBondContact O-CB 3.35Å; P12-A16 PolarHBondContact O-N 3.39Å; I13-A16 PolarHBondContact O-N 3.03Å; A16-A18 PolarHBondContact O-N 3.35Å; A16-F19 PolarHBondContact O-N 3.18Å; A16-L20 WeakPolarHBondContact O-CB 3.42Å; A16-L20 PolarHBondContact O-N 3.42Å; A16-I232 HydrophobicContact CB-CD1 4.3Å
17M95Very high94.2Very high5 Ų549 Ų493%0.02526%0.262CS..Hα-helixtrans-59.1-44.9173.1168.8-83.2-63.400111.7I13 L14 I15 F19 L20 M21 M225 Y228 T229 I232I13-M17 WeakPolarHBondContact O-CB 3.37Å; I13-M17 PolarHBondContact O-N 3.17Å; L14-M17 HydrophobicContact CD2-CE 3.97Å; L14-M17 WeakPolarHBondContact O-CE 3.37Å; I15-M17 VanDerWaalsContact C-N 3.34Å; I15-M17 PolarHBondContact O-N 3.21Å; M17-F19 VanDerWaalsContact C-N 3.33Å; M17-F19 PolarHBondContact O-N 3.22Å; M17-L20 PolarHBondContact O-N 3.21Å; M17-L20 VanDerWaalsContact O-N 3.12Å; M17-M21 PolarHBondContact O-N 2.87Å; M17-M21 HydrophobicContact SD-CE 3.81Å; M17-M225 HydrophobicContact CE-CB 3.73Å; M17-M225 HydrophobicContact CE-CG 3.32Å; M17-M225 HydrophobicContact CE-SD 3.7Å; M17-M225 HydrophobicContact SD-CB 4.3Å; M17-M225 HydrophobicContact SD-CG 3.88Å; M17-Y228 VanDerWaalsContact CG-CB 3.45Å; M17-Y228 HydrophobicContact CG-CG 4.46Å; M17-T229 HydrophobicContact CB-CG2 3.96Å; M17-T229 HydrophobicContact CG-CG2 4.08Å; M17-I232 HydrophobicContact CB-CD1 4.37Å
18A93.8Very high94.1Very high17 Ų1746 Ų4614%0.1425%0.246CC..Hα-helixtrans-60.3-43.3178.700000111.8L14 I15 A16 M21 P48L14-A18 PolarHBondContact O-N 3.36Å; I15-A18 WeakPolarHBondContact O-CB 3.09Å; I15-A18 PolarHBondContact O-N 2.93Å; I15-A18 VanDerWaalsContact O-N 3.17Å; A16-A18 PolarHBondContact O-N 3.35Å; A18-M21 HydrophobicContact CB-CE 4.42Å; A18-M21 PolarHBondContact O-N 3.29Å; A18-P48 HydrophobicContact CB-CB 3.88Å; A18-P48 VanDerWaalsContact O-CB 3.3Å; A18-P48 WeakPolarHBondContact O-CB 3.33Å; A18-P48 VanDerWaalsContact O-CG 3.23Å; A18-P48 WeakPolarHBondContact O-CG 3.32Å
19F95.1Very high94.1Very high67 Ų6740 Ų4029%0.29422%0.215SC..Hα-helixtrans-72.3-28.3175.7-77.2-68.9000113.4I15 A16 M17 M21 L22 T23 L45 P48 F49I15-F19 HydrophobicContact CG2-CD2 3.73Å; I15-F19 HydrophobicContact CG2-CE2 3.67Å; I15-F19 VanDerWaalsContact O-CD2 3.28Å; I15-F19 WeakPolarHBondContact O-CD2 3.3Å; I15-F19 PolarHBondContact O-N 2.98Å; A16-F19 PolarHBondContact O-N 3.18Å; M17-F19 VanDerWaalsContact C-N 3.33Å; M17-F19 PolarHBondContact O-N 3.22Å; F19-M21 VanDerWaalsContact C-N 3.28Å; F19-M21 PolarHBondContact O-N 3.06Å; F19-L22 WeakPolarHBondContact O-CB 3.43Å; F19-L22 PolarHBondContact O-N 3.23Å; F19-T23 WeakPolarHBondContact O-CG2 3.45Å; F19-T23 PolarHBondContact O-N 3.37Å; F19-L45 HydrophobicContact CE1-CD2 4.12Å; F19-P48 HydrophobicContact CD1-CG 4.43Å; F19-F49 HydrophobicContact CZ-CE2 4.2Å
20L94.6Very high94.1Very high11 Ų1144.8 Ų44.86%0.05823%0.231CC..Hα-helixtrans-63.3-34.9175.1-174.1138.8000112A16 M17 L22 T23 E24 Y228 I232 T267A16-L20 WeakPolarHBondContact O-CB 3.42Å; A16-L20 PolarHBondContact O-N 3.42Å; M17-L20 PolarHBondContact O-N 3.21Å; M17-L20 VanDerWaalsContact O-N 3.12Å; L20-L22 VanDerWaalsContact C-N 3.27Å; L20-L22 PolarHBondContact O-N 3.25Å; L20-T23 WeakPolarHBondContact CA-OG1 3.28Å; L20-T23 PolarHBondContact O-N 3.05Å; L20-T23 PolarHBondContact O-OG1 2.74Å; L20-E24 VanDerWaalsContact O-CB 3.32Å; L20-E24 WeakPolarHBondContact O-CB 3.23Å; L20-E24 PolarHBondContact O-N 3.17Å; L20-Y228 HydrophobicContact CD2-CD1 3.2Å; L20-Y228 HydrophobicContact CD2-CE1 3.68Å; L20-Y228 HydrophobicContact CD2-CG 4.17Å; L20-I232 HydrophobicContact CB-CD1 4.31Å; L20-I232 HydrophobicContact CD1-CD1 3.97Å; L20-I232 HydrophobicContact CD1-CG1 3.59Å; L20-T267 HydrophobicContact CD1-CG2 4.37Å
21M92.3Very high94.1Very high42 Ų4246.7 Ų46.721%0.20724%0.24CC..Hα-helixtrans-61.1-37.5171.8-65.7-171.4-8000112.4M17 A18 F19 R25 Y228M17-M21 PolarHBondContact O-N 2.87Å; M17-M21 HydrophobicContact SD-CE 3.81Å; A18-M21 HydrophobicContact CB-CE 4.42Å; A18-M21 PolarHBondContact O-N 3.29Å; F19-M21 VanDerWaalsContact C-N 3.28Å; F19-M21 PolarHBondContact O-N 3.06Å; M21-R25 WeakPolarHBondContact O-CG 3.43Å; M21-R25 PolarHBondContact O-N 3.33Å; M21-Y228 HydrophobicContact CG-CD2 3.75Å; M21-Y228 HydrophobicContact CG-CE1 4.4Å; M21-Y228 HydrophobicContact CG-CE2 3.63Å; M21-Y228 HydrophobicContact CG-CG 4.27Å; M21-Y228 HydrophobicContact SD-CD2 4.11Å; M21-Y228 HydrophobicContact SD-CE2 4Å
22L94.7Very high94Very high9 Ų948 Ų485%0.04724%0.241CC..Hα-helixtrans-71.5-43.9176.4173.4147.3000111.9F19 L20 E24 R25 K26 G44 Q47 P48F19-L22 WeakPolarHBondContact O-CB 3.43Å; F19-L22 PolarHBondContact O-N 3.23Å; L20-L22 VanDerWaalsContact C-N 3.27Å; L20-L22 PolarHBondContact O-N 3.25Å; L22-E24 VanDerWaalsContact C-N 3.29Å; L22-E24 PolarHBondContact O-N 3.33Å; L22-R25 PolarHBondContact O-N 3.47Å; L22-K26 HydrophobicContact CD2-CD 3.99Å; L22-K26 PolarHBondContact O-N 3.33Å; L22-G44 WeakPolarHBondContact CD1-O 3.45Å; L22-Q47 HydrophobicContact CD1-CB 4.27Å; L22-P48 HydrophobicContact CB-CG 3.88Å; L22-P48 HydrophobicContact CD1-CG 4.22Å
23T93.9Very high94Very high57 Ų5752.9 Ų52.935%0.3526%0.263SS..Hα-helixtrans-63.2-40.7179.2590000110.4F19 L20 K26 I27F19-T23 WeakPolarHBondContact O-CG2 3.45Å; F19-T23 PolarHBondContact O-N 3.37Å; L20-T23 WeakPolarHBondContact CA-OG1 3.28Å; L20-T23 PolarHBondContact O-N 3.05Å; L20-T23 PolarHBondContact O-OG1 2.74Å; T23-K26 PolarHBondContact O-N 3.32Å; T23-I27 WeakPolarHBondContact O-CB 3.28Å; T23-I27 VanDerWaalsContact O-CG1 3.31Å; T23-I27 WeakPolarHBondContact O-CG1 3.3Å; T23-I27 PolarHBondContact O-N 2.79Å
24E93.7Very high94Very high6 Ų658.8 Ų58.83%0.02829%0.285CS..Hα-helixtrans-55.9-53.8173.2174.6162-135.400112.1L20 L22 K26 I27 L28 R195 Y228 L271 R274L20-E24 VanDerWaalsContact O-CB 3.32Å; L20-E24 WeakPolarHBondContact O-CB 3.23Å; L20-E24 PolarHBondContact O-N 3.17Å; L22-E24 VanDerWaalsContact C-N 3.29Å; L22-E24 PolarHBondContact O-N 3.33Å; E24-K26 PolarHBondContact O-N 3.39Å; E24-I27 PolarHBondContact O-N 3.02Å; E24-L28 HydrophobicContact CG-CD1 3.43Å; E24-L28 VanDerWaalsContact CG-CD1 3.43Å; E24-L28 HydrophobicContact CG-CG 4.19Å; E24-L28 VanDerWaalsContact O-CB 3.26Å; E24-L28 WeakPolarHBondContact O-CB 3.46Å; E24-L28 WeakPolarHBondContact O-CD1 3.32Å; E24-L28 VanDerWaalsContact O-CG 3.28Å; E24-L28 WeakPolarHBondContact O-CG 3.3Å; E24-L28 PolarHBondContact O-N 2.97Å; E24-R195 VanDerWaalsContact CD-NH2 3.3Å; E24-R195 IonicContact OE1-CZ 3.58Å; E24-R195 IonicContact OE1-NH2 2.97Å; E24-R195 PolarHBondContact OE1-NH2 3.21Å; E24-R195 IonicContact OE2-NH2 2.65Å; E24-R195 PolarHBondContact OE2-NH2 3.02Å; E24-Y228 WeakPolarHBondContact OE2-CE1 3.28Å; E24-Y228 VanDerWaalsContact OE2-CZ 3.29Å; E24-Y228 PolarHBondContact OE2-OH 3.39Å; E24-L271 HydrophobicContact CB-CD1 4.24Å; E24-L271 HydrophobicContact CB-CD2 3.66Å; E24-L271 HydrophobicContact CG-CD2 3.65Å; E24-R274 WeakPolarHBondContact OE1-CD 3.5Å; E24-R274 IonicContact OE1-CZ 3.89Å; E24-R274 IonicContact OE1-NE 3.55Å; E24-R274 IonicContact OE1-NH1 2.82Å; E24-R274 PolarHBondContact OE1-NH1 3.46Å; E24-R274 IonicContact OE2-NH1 3.79Å
25R93.3Very high93.8Very high100 Ų10063.7 Ų63.738%0.37730%0.304SS..Hα-helixtrans-60.8-33.1179.9-70.8-177.8-177.7165.911.3112.8M21 L22 G29 P37 D51M21-R25 WeakPolarHBondContact O-CG 3.43Å; M21-R25 PolarHBondContact O-N 3.33Å; L22-R25 PolarHBondContact O-N 3.47Å; R25-G29 PolarHBondContact O-N 3.06Å; R25-G29 VanDerWaalsContact O-N 3.08Å; R25-P37 HydrophobicContact CB-CG 3.9Å; R25-P37 HydrophobicContact CG-CG 4.49Å; R25-D51 IonicContact CZ-OD2 3.17Å; R25-D51 IonicContact NH1-OD1 3.96Å; R25-D51 IonicContact NH1-OD2 2.74Å; R25-D51 PolarHBondContact NH1-OD2 3.07Å; R25-D51 IonicContact NH2-OD2 2.79Å; R25-D51 PolarHBondContact NH2-OD2 3.46Å
26K93.6Very high93.7Very high39 Ų3960.3 Ų60.317%0.1729%0.289CS..Hα-helixtrans-72.9-50.2176-76.5-171.7174.7-177.40112.1L22 T23 E24 G29 Y30 Y43L22-K26 HydrophobicContact CD2-CD 3.99Å; L22-K26 PolarHBondContact O-N 3.33Å; T23-K26 PolarHBondContact O-N 3.32Å; E24-K26 PolarHBondContact O-N 3.39Å; K26-G29 WeakPolarHBondContact O-CA 3.4Å; K26-G29 PolarHBondContact O-N 3.28Å; K26-G29 VanDerWaalsContact O-N 3.13Å; K26-Y30 HydrophobicContact CB-CD2 4.46Å; K26-Y30 HydrophobicContact CB-CE2 4.36Å; K26-Y30 WeakPolarHBondContact O-CD2 3.07Å; K26-Y30 PolarHBondContact O-N 3.17Å; K26-Y43 WeakPolarHBondContact CE-O 3.27Å; K26-Y43 PolarHBondContact NZ-O 2.91Å
27I93.7Very high93.6Very high45 Ų4559.4 Ų59.423%0.23128%0.279CS..Hα-helixtrans-60.3-48.8-179.6-71166.6000110T23 E24 G29 Y30 M31 L271T23-I27 WeakPolarHBondContact O-CB 3.28Å; T23-I27 VanDerWaalsContact O-CG1 3.31Å; T23-I27 WeakPolarHBondContact O-CG1 3.3Å; T23-I27 PolarHBondContact O-N 2.79Å; E24-I27 PolarHBondContact O-N 3.02Å; I27-G29 VanDerWaalsContact C-N 3.3Å; I27-G29 PolarHBondContact O-N 3.26Å; I27-Y30 PolarHBondContact O-N 3.41Å; I27-M31 HydrophobicContact CG2-CE 3.53Å; I27-M31 HydrophobicContact CG2-CG 4.46Å; I27-M31 HydrophobicContact CG2-SD 3.57Å; I27-M31 VanDerWaalsContact CG2-SD 3.57Å; I27-M31 WeakPolarHBondContact O-CB 3.38Å; I27-M31 VanDerWaalsContact O-CG 3.32Å; I27-M31 WeakPolarHBondContact O-CG 3.41Å; I27-M31 PolarHBondContact O-N 3.22Å; I27-L271 HydrophobicContact CD1-CD1 3.62Å; I27-L271 HydrophobicContact CG2-CB 4.2Å
28L92.1Very high93.5Very high24 Ų2461.7 Ų61.713%0.12629%0.291CS..Hα-helixtrans-55.4-45.6172.8-74.6164.6000111.5E24 Q32 R274 T275E24-L28 HydrophobicContact CG-CD1 3.43Å; E24-L28 VanDerWaalsContact CG-CD1 3.43Å; E24-L28 HydrophobicContact CG-CG 4.19Å; E24-L28 VanDerWaalsContact O-CB 3.26Å; E24-L28 WeakPolarHBondContact O-CB 3.46Å; E24-L28 WeakPolarHBondContact O-CD1 3.32Å; E24-L28 VanDerWaalsContact O-CG 3.28Å; E24-L28 WeakPolarHBondContact O-CG 3.3Å; E24-L28 PolarHBondContact O-N 2.97Å; L28-Q32 VanDerWaalsContact O-CB 3.27Å; L28-Q32 WeakPolarHBondContact O-CB 3.32Å; L28-Q32 WeakPolarHBondContact O-CG 3.42Å; L28-Q32 PolarHBondContact O-N 3.42Å; L28-R274 HydrophobicContact CD2-CG 4.02Å; L28-T275 HydrophobicContact CD2-CG2 3.31Å; L28-T275 HydrophobicContact CG-CG2 4.21Å
29G92.6Very high93.4Very high0 Ų067.5 Ų67.50%032%0.324CS..Hα-helixtrans-57.1-55.8178.100000111.7R25 K26 I27 M31 Q32 L33 R34R25-G29 PolarHBondContact O-N 3.06Å; R25-G29 VanDerWaalsContact O-N 3.08Å; K26-G29 WeakPolarHBondContact O-CA 3.4Å; K26-G29 PolarHBondContact O-N 3.28Å; K26-G29 VanDerWaalsContact O-N 3.13Å; I27-G29 VanDerWaalsContact C-N 3.3Å; I27-G29 PolarHBondContact O-N 3.26Å; G29-M31 PolarHBondContact O-N 2.96Å; G29-Q32 CarbonylContact O-C 3.57Å; G29-Q32 PolarHBondContact O-N 3.32Å; G29-Q32 VanDerWaalsContact O-N 3.1Å; G29-L33 PolarHBondContact O-N 2.9Å; G29-R34 CarbonylContact C-O 3.34Å; G29-R34 CarbonylContact O-C 3.42Å; G29-R34 WeakPolarHBondContact O-CG 3.18Å; G29-R34 PolarHBondContact O-N 3.13Å
30Y94.1Very high93.1Very high137 Ų13767 Ų6754%0.53733%0.327SS..Hα-helixtrans-63-39.8-177.3-74.5-67.1000112.6K26 I27 Q32 L33 R34K26-Y30 HydrophobicContact CB-CD2 4.46Å; K26-Y30 HydrophobicContact CB-CE2 4.36Å; K26-Y30 WeakPolarHBondContact O-CD2 3.07Å; K26-Y30 PolarHBondContact O-N 3.17Å; I27-Y30 PolarHBondContact O-N 3.41Å; Y30-Q32 VanDerWaalsContact C-N 3.26Å; Y30-Q32 PolarHBondContact O-N 3.16Å; Y30-L33 PolarHBondContact O-N 3.49Å; Y30-L33 VanDerWaalsContact O-N 3.16Å; Y30-R34 PolarHBondContact N-O 3.1Å
31M93.1Very high92.9Very high85 Ų8567.8 Ų67.842%0.41934%0.337SS..Hα-helixtrans-65.7-30.6175.7-71.3172.3173.400112.3I27 G29 L33 W272 T275I27-M31 HydrophobicContact CG2-CE 3.53Å; I27-M31 HydrophobicContact CG2-CG 4.46Å; I27-M31 HydrophobicContact CG2-SD 3.57Å; I27-M31 VanDerWaalsContact CG2-SD 3.57Å; I27-M31 WeakPolarHBondContact O-CB 3.38Å; I27-M31 VanDerWaalsContact O-CG 3.32Å; I27-M31 WeakPolarHBondContact O-CG 3.41Å; I27-M31 PolarHBondContact O-N 3.22Å; G29-M31 PolarHBondContact O-N 2.96Å; M31-L33 VanDerWaalsContact C-N 3.3Å; M31-L33 PolarHBondContact O-N 3.37Å; M31-W272 HydrophobicContact CE-CB 3.79Å; M31-W272 HydrophobicContact CE-CG 3.79Å; M31-T275 HydrophobicContact CB-CG2 3.94Å; M31-T275 HydrophobicContact CG-CG2 4.35Å; M31-T275 HydrophobicContact SD-CG2 3.49Å; M31-T275 WeakPolarHBondContact SD-CG2 3.49Å; M31-T275 PolarHBondContact SD-OG1 3.4Å
32Q93.6Very high92.8Very high102 Ų10270 Ų7048%0.47736%0.355SS..THydrogen-bonded Turntrans-89.615.5175.2-66.1172.6-7.600113.4L28 G29 Y30 R34L28-Q32 VanDerWaalsContact O-CB 3.27Å; L28-Q32 WeakPolarHBondContact O-CB 3.32Å; L28-Q32 WeakPolarHBondContact O-CG 3.42Å; L28-Q32 PolarHBondContact O-N 3.42Å; G29-Q32 CarbonylContact O-C 3.57Å; G29-Q32 PolarHBondContact O-N 3.32Å; G29-Q32 VanDerWaalsContact O-N 3.1Å; Y30-Q32 VanDerWaalsContact C-N 3.26Å; Y30-Q32 PolarHBondContact O-N 3.16Å; Q32-R34 HydrophobicContact CB-CG 4.25Å; Q32-R34 PolarHBondContact O-N 3.08Å
33L94.6Very high92.7Very high170 Ų17078 Ų7889%0.8939%0.385SS*.THydrogen-bonded Turntrans5730.2-178.9-59.5172.4000114.4G29 Y30 M31G29-L33 PolarHBondContact O-N 2.9Å; Y30-L33 PolarHBondContact O-N 3.49Å; Y30-L33 VanDerWaalsContact O-N 3.16Å; M31-L33 VanDerWaalsContact C-N 3.3Å; M31-L33 PolarHBondContact O-N 3.37Å
34R94.9Very high92.6Very high136 Ų13675.2 Ų75.251%0.51337%0.369SS..SBendtrans-128.4168.1173.665.9-177.217998.7-0.8111.4G29 Y30 Q32G29-R34 CarbonylContact C-O 3.34Å; G29-R34 CarbonylContact O-C 3.42Å; G29-R34 WeakPolarHBondContact O-CG 3.18Å; G29-R34 PolarHBondContact O-N 3.13Å; Y30-R34 PolarHBondContact N-O 3.1Å; Q32-R34 HydrophobicContact CB-CG 4.25Å; Q32-R34 PolarHBondContact O-N 3.08Å
35K91.3Very high92.6Very high159 Ų15978.9 Ų78.969%0.69139%0.388SS*.  trans-86.9140.5174.8-68-179.2-178.2177.90110.4
36G93.3Very high92.6Very high10 Ų1078.5 Ų78.510%0.10339%0.393CS..  trans-72.5-174.116500000112.4N38G36-N38 PolarHBondContact O-N 3Å; G36-N38 VanDerWaalsContact O-N 3.16Å
37P91.6Very high92.6Very high27 Ų2778.1 Ų78.118%0.17539%0.392CS..SBendtrans-58118.3177.8-20.931.4000111.2R25 G44 Q47R25-P37 HydrophobicContact CB-CG 3.9Å; R25-P37 HydrophobicContact CG-CG 4.49Å; P37-G44 WeakPolarHBondContact O-CA 3.31Å; P37-Q47 HydrophobicContact CB-CB 4.43Å; P37-Q47 HydrophobicContact CB-CG 4.1Å; P37-Q47 HydrophobicContact CG-CG 4.4Å
38N93.2Very high92.6Very high53 Ų5376.2 Ų76.228%0.28338%0.382SS..  trans-129.9-4.4-179.3-75.1-20.9000113.6G36G36-N38 PolarHBondContact O-N 3Å; G36-N38 VanDerWaalsContact O-N 3.16Å
39V91.4Very high92.6Very high138 Ų13880.5 Ų80.584%0.83640%0.4SS*.SBendtrans-94.4-42.9-172-178.20000112.5G41V39-G41 PolarHBondContact O-N 2.88Å
40V88.8Confident92.6Very high58 Ų5882.4 Ų82.435%0.35242%0.416SS..SBendtrans-77.286.1-178.6-175.40000109.5G44 L46 Q47 A50V40-G44 CarbonylContact O-C 3.55Å; V40-G44 WeakPolarHBondContact O-CA 3.4Å; V40-L46 HydrophobicContact CG1-CB 4.21Å; V40-L46 PolarHBondContact O-N 2.83Å; V40-Q47 VanDerWaalsContact CG2-OE1 3.28Å; V40-A50 HydrophobicContact CG1-CB 3.94Å
41G91.4Very high92.5Very high26 Ų2677.3 Ų77.327%0.26840%0.398SS..SBendtrans86.1172.5-175.700000114V39 Y43 G44V39-G41 PolarHBondContact O-N 2.88Å; G41-Y43 PolarHBondContact O-N 3.29Å; G41-G44 PolarHBondContact O-N 3.24Å
42P91Very high92.4Very high88 Ų8875.1 Ų75.157%0.57139%0.393SS*.G310 helixtrans-61.3120.8-179.725.6-32.9000109.9G44 L45P42-G44 PolarHBondContact O-N 2.92Å; P42-G44 VanDerWaalsContact O-N 3.07Å; P42-L45 HydrophobicContact CG-CD1 4.47Å; P42-L45 WeakPolarHBondContact O-CG 3.26Å; P42-L45 PolarHBondContact O-N 3.33Å; P42-L45 VanDerWaalsContact O-N 3.14Å
43Y91Very high92.3Very high177 Ų17776.6 Ų76.669%0.69440%0.402SS*.G310 helixtrans49.930.9-172.3-59-81.3000113.5K26 G41 L45K26-Y43 WeakPolarHBondContact CE-O 3.27Å; K26-Y43 PolarHBondContact NZ-O 2.91Å; G41-Y43 PolarHBondContact O-N 3.29Å; Y43-L45 VanDerWaalsContact C-N 3.3Å; Y43-L45 PolarHBondContact O-N 2.9Å
44G92.1Very high92.2Very high0 Ų075.2 Ų75.20%039%0.389CS..G310 helixtrans75.36.717800000116L22 P37 V40 G41 P42 L46 Q47L22-G44 WeakPolarHBondContact CD1-O 3.45Å; P37-G44 WeakPolarHBondContact O-CA 3.31Å; V40-G44 CarbonylContact O-C 3.55Å; V40-G44 WeakPolarHBondContact O-CA 3.4Å; G41-G44 PolarHBondContact O-N 3.24Å; P42-G44 PolarHBondContact O-N 2.92Å; P42-G44 VanDerWaalsContact O-N 3.07Å; G44-L46 PolarHBondContact O-N 3.4Å; G44-Q47 WeakPolarHBondContact O-CB 3.28Å; G44-Q47 PolarHBondContact O-N 3.12Å
45L93.3Very high92Very high82 Ų8270.9 Ų70.943%0.42938%0.375SS..THydrogen-bonded Turntrans-55.1-25-174.6-76170.7000114.5F19 P42 Y43 P48F19-L45 HydrophobicContact CE1-CD2 4.12Å; P42-L45 HydrophobicContact CG-CD1 4.47Å; P42-L45 WeakPolarHBondContact O-CG 3.26Å; P42-L45 PolarHBondContact O-N 3.33Å; P42-L45 VanDerWaalsContact O-N 3.14Å; Y43-L45 VanDerWaalsContact C-N 3.3Å; Y43-L45 PolarHBondContact O-N 2.9Å; L45-P48 WeakPolarHBondContact O-CD 3.42Å
46L94.4Very high91.9Very high93 Ų9369.4 Ų69.449%0.48737%0.369SS..THydrogen-bonded Turntrans-88.6-2.8179.2-63.8174.9000113.5V40 G44 F49 A50V40-L46 HydrophobicContact CG1-CB 4.21Å; V40-L46 PolarHBondContact O-N 2.83Å; G44-L46 PolarHBondContact O-N 3.4Å; L46-F49 HydrophobicContact CD2-CD2 4.29Å; L46-F49 PolarHBondContact O-N 3.23Å; L46-A50 PolarHBondContact O-N 3.47Å; L46-A50 VanDerWaalsContact O-N 3.14Å
47Q94.1Very high91.9Very high30 Ų3074 Ų7414%0.1440%0.395CS..Hα-helixtrans-56.8-45-179.5-173.471.646.100113.6L22 P37 V40 G44 F49 A50 D51L22-Q47 HydrophobicContact CD1-CB 4.27Å; P37-Q47 HydrophobicContact CB-CB 4.43Å; P37-Q47 HydrophobicContact CB-CG 4.1Å; P37-Q47 HydrophobicContact CG-CG 4.4Å; V40-Q47 VanDerWaalsContact CG2-OE1 3.28Å; G44-Q47 WeakPolarHBondContact O-CB 3.28Å; G44-Q47 PolarHBondContact O-N 3.12Å; Q47-F49 VanDerWaalsContact C-N 3.29Å; Q47-F49 PolarHBondContact O-N 2.97Å; Q47-A50 PolarHBondContact O-N 3.27Å; Q47-D51 PolarHBondContact NE2-OD1 2.85Å; Q47-D51 PolarHBondContact O-N 3.02Å
48P92.9Very high91.9Very high5 Ų578.5 Ų78.53%0.03241%0.412CS..Hα-helixtrans-62.4-37.1-178.7-23.735.9000112.8A18 F19 L22 L45 D51 A52A18-P48 HydrophobicContact CB-CB 3.88Å; A18-P48 VanDerWaalsContact O-CB 3.3Å; A18-P48 WeakPolarHBondContact O-CB 3.33Å; A18-P48 VanDerWaalsContact O-CG 3.23Å; A18-P48 WeakPolarHBondContact O-CG 3.32Å; F19-P48 HydrophobicContact CD1-CG 4.43Å; L22-P48 HydrophobicContact CB-CG 3.88Å; L22-P48 HydrophobicContact CD1-CG 4.22Å; L45-P48 WeakPolarHBondContact O-CD 3.42Å; P48-D51 PolarHBondContact O-N 2.88Å; P48-A52 WeakPolarHBondContact O-CB 3.46Å; P48-A52 PolarHBondContact O-N 3.28Å
49F91.8Very high91.7Very high115 Ų11583.1 Ų83.150%0.50443%0.432SS..Hα-helixtrans-68.7-39.4177.2-62.9-71.9000111.8F19 L46 Q47 A52 M53F19-F49 HydrophobicContact CZ-CE2 4.2Å; L46-F49 HydrophobicContact CD2-CD2 4.29Å; L46-F49 PolarHBondContact O-N 3.23Å; Q47-F49 VanDerWaalsContact C-N 3.29Å; Q47-F49 PolarHBondContact O-N 2.97Å; F49-A52 PolarHBondContact O-N 2.99Å; F49-M53 WeakPolarHBondContact O-CB 3.1Å; F49-M53 PolarHBondContact O-N 2.78Å
50A92.9Very high91.4Very high39 Ų3980 Ų8032%0.32242%0.415SS..Hα-helixtrans-64.1-42174.800000112V40 L46 Q47 M53 K54V40-A50 HydrophobicContact CG1-CB 3.94Å; L46-A50 PolarHBondContact O-N 3.47Å; L46-A50 VanDerWaalsContact O-N 3.14Å; Q47-A50 PolarHBondContact O-N 3.27Å; A50-M53 PolarHBondContact O-N 2.78Å; A50-K54 VanDerWaalsContact O-CB 3.3Å; A50-K54 WeakPolarHBondContact O-CB 3.27Å; A50-K54 PolarHBondContact O-N 3.48Å
51D91Very high91.1Very high30 Ų3082.3 Ų82.316%0.1642%0.424CS..Hα-helixtrans-65.9-42.8177.1-73.4-0.7000111.2R25 Q47 P48 K54 L55R25-D51 IonicContact CZ-OD2 3.17Å; R25-D51 IonicContact NH1-OD1 3.96Å; R25-D51 IonicContact NH1-OD2 2.74Å; R25-D51 PolarHBondContact NH1-OD2 3.07Å; R25-D51 IonicContact NH2-OD2 2.79Å; R25-D51 PolarHBondContact NH2-OD2 3.46Å; Q47-D51 PolarHBondContact NE2-OD1 2.85Å; Q47-D51 PolarHBondContact O-N 3.02Å; P48-D51 PolarHBondContact O-N 2.88Å; D51-K54 PolarHBondContact O-N 3.38Å; D51-L55 WeakPolarHBondContact O-CG 3.42Å; D51-L55 PolarHBondContact O-N 3.07Å
52A90.8Very high90.7Very high39 Ų3987.2 Ų87.232%0.32244%0.438SS..Hα-helixtrans-60.7-50.4174.900000111.5P48 F49 K54 L55 F56P48-A52 WeakPolarHBondContact O-CB 3.46Å; P48-A52 PolarHBondContact O-N 3.28Å; F49-A52 PolarHBondContact O-N 2.99Å; A52-K54 VanDerWaalsContact C-N 3.3Å; A52-K54 PolarHBondContact O-N 2.94Å; A52-L55 PolarHBondContact O-N 2.85Å; A52-L55 VanDerWaalsContact O-N 3.17Å; A52-F56 HydrophobicContact CB-CE2 4.47Å; A52-F56 WeakPolarHBondContact O-CD2 3.47Å; A52-F56 PolarHBondContact O-N 3.39Å
53M92.1Very high90.2Very high134 Ų13484.5 Ų84.566%0.6642%0.421SS*.Hα-helixtrans-59.7-41.8178.5-170.6177.1-176.300111.5F49 A50 L55 F56 T57F49-M53 WeakPolarHBondContact O-CB 3.1Å; F49-M53 PolarHBondContact O-N 2.78Å; A50-M53 PolarHBondContact O-N 2.78Å; M53-L55 PolarHBondContact O-N 3.39Å; M53-F56 PolarHBondContact O-N 3.44Å; M53-T57 HydrophobicContact CG-CG2 4.24Å; M53-T57 WeakPolarHBondContact O-CB 3.05Å; M53-T57 WeakPolarHBondContact O-CG2 3.15Å; M53-T57 PolarHBondContact O-N 3.47Å; M53-T57 PolarHBondContact O-OG1 3.07Å
54K92.6Very high89.6Confident141 Ų14181.3 Ų81.361%0.61343%0.431SS*.Hα-helixtrans-59.4-46.8174.9178.9-174.5176.1-175.40112.1A50 D51 A52 T57 K58A50-K54 VanDerWaalsContact O-CB 3.3Å; A50-K54 WeakPolarHBondContact O-CB 3.27Å; A50-K54 PolarHBondContact O-N 3.48Å; D51-K54 PolarHBondContact O-N 3.38Å; A52-K54 VanDerWaalsContact C-N 3.3Å; A52-K54 PolarHBondContact O-N 2.94Å; K54-T57 PolarHBondContact O-OG1 3.18Å; K54-K58 WeakPolarHBondContact O-CB 3.1Å; K54-K58 PolarHBondContact O-N 3.33Å
55L90.5Very high89.1Confident45 Ų4585.4 Ų85.424%0.23646%0.456CS..Hα-helixtrans-68.7-34.8-177.4-71.5171.3000112.6D51 A52 M53 A217 G218 F220 A221D51-L55 WeakPolarHBondContact O-CG 3.42Å; D51-L55 PolarHBondContact O-N 3.07Å; A52-L55 PolarHBondContact O-N 2.85Å; A52-L55 VanDerWaalsContact O-N 3.17Å; M53-L55 PolarHBondContact O-N 3.39Å; L55-A217 CarbonylContact O-C 3.21Å; L55-A217 WeakPolarHBondContact O-CA 3.42Å; L55-A217 WeakPolarHBondContact O-CB 3.23Å; L55-G218 PolarHBondContact O-N 3.17Å; L55-F220 HydrophobicContact CD2-CD1 4.18Å; L55-A221 HydrophobicContact CB-CB 4.14Å; L55-A221 HydrophobicContact CD1-CB 3.89Å
56F90.4Very high88.6Confident128 Ų12882.2 Ų82.256%0.56144%0.441SS*.Hα-helixtrans-81.3-25.7178.9-70.8-61.8000114.4A52 M53 M225A52-F56 HydrophobicContact CB-CE2 4.47Å; A52-F56 WeakPolarHBondContact O-CD2 3.47Å; A52-F56 PolarHBondContact O-N 3.39Å; M53-F56 PolarHBondContact O-N 3.44Å; F56-M225 HydrophobicContact CZ-CE 4.14Å
57T92.3Very high88.3Confident106 Ų10680.3 Ų80.365%0.6543%0.433SS*.Hα-helixtrans-83.5-19.7175.553.80000113.3M53 K54M53-T57 HydrophobicContact CG-CG2 4.24Å; M53-T57 WeakPolarHBondContact O-CB 3.05Å; M53-T57 WeakPolarHBondContact O-CG2 3.15Å; M53-T57 PolarHBondContact O-N 3.47Å; M53-T57 PolarHBondContact O-OG1 3.07Å; K54-T57 PolarHBondContact O-OG1 3.18Å
58K92.2Very high88Confident122 Ų12284.1 Ų84.153%0.5345%0.453SS..SBendtrans-70.6142.1179.8-169.5176-177.8-173.50110.6K54 A217K54-K58 WeakPolarHBondContact O-CB 3.1Å; K54-K58 PolarHBondContact O-N 3.33Å; K58-A217 HydrophobicContact CB-CB 3.8Å; K58-A217 HydrophobicContact CD-CB 4.48Å; K58-A217 HydrophobicContact CG-CB 4.17Å; K58-A217 VanDerWaalsContact O-CB 3.3Å; K58-A217 WeakPolarHBondContact O-CB 3.25Å
59E88.4Confident87.8Confident150 Ų15089 Ų8970%0.70148%0.483SS*.  trans-58.6127.7177.7-172.5178.6176.900111.1L61E59-L61 PolarHBondContact O-N 3.1Å
60P85Confident87.8Confident73 Ų7385.2 Ų85.247%0.47447%0.468SS..  trans-74.2108.317429.4-32.1000109.7K62P60-K62 PolarHBondContact O-N 2.93Å
61L83.6Confident87.6Confident106 Ų10683.6 Ų83.656%0.55545%0.453SS*.  trans-70.4124.7171.6-66168.3000109.2E59 Y71 A216E59-L61 PolarHBondContact O-N 3.1Å; L61-Y71 PolarHBondContact O-OH 3.4Å; L61-A216 HydrophobicContact CB-CB 3.79Å; L61-A216 HydrophobicContact CD1-CB 3.91Å; L61-A216 HydrophobicContact CG-CB 4.02Å
62K82.3Confident87.5Confident129 Ų12986 Ų8656%0.56147%0.465SS*.  trans-113.1116170.6-69.9-176.9-178.6178.70108.7P60P60-K62 PolarHBondContact O-N 2.93Å
63P81.3Confident87.6Confident31 Ų3186.8 Ų86.820%0.20147%0.466CS..  trans-65.2138178.7-10.120.4000111T65 S66 Y71 E214P63-T65 PolarHBondContact O-N 2.81Å; P63-S66 WeakPolarHBondContact O-CB 3.49Å; P63-S66 PolarHBondContact O-N 3.35Å; P63-S66 PolarHBondContact O-OG 3.45Å; P63-Y71 HydrophobicContact CG-CE2 4.13Å; P63-E214 WeakPolarHBondContact CB-OE2 3.41Å; P63-E214 HydrophobicContact CG-CB 3.93Å; P63-E214 HydrophobicContact CG-CG 4.43Å; P63-E214 WeakPolarHBondContact CG-OE2 3.38Å
64A78.5Confident87.7Confident110 Ų11080.4 Ų80.491%0.90944%0.435SS*.THydrogen-bonded Turntrans-66.1-25.8178.700000113.2
65T80.3Confident87.7Confident86 Ų8673.8 Ų73.853%0.52841%0.406SS..THydrogen-bonded Turntrans-87.2-4.1-179.746.80000113.6P63 N124P63-T65 PolarHBondContact O-N 2.81Å; T65-N124 WeakPolarHBondContact O-CB 3.21Å; T65-N124 PolarHBondContact O-ND2 2.94Å
66S83.3Confident87.8Confident15 Ų1574.8 Ų74.811%0.10541%0.414CS..SBendtrans-84149.3-172.268.30000113.3P63 I68 A122P63-S66 WeakPolarHBondContact O-CB 3.49Å; P63-S66 PolarHBondContact O-N 3.35Å; P63-S66 PolarHBondContact O-OG 3.45Å; S66-I68 PolarHBondContact O-N 3.29Å; S66-A122 CarbonylContact C-O 2.85Å; S66-A122 WeakPolarHBondContact CA-O 3.21Å; S66-A122 WeakPolarHBondContact CB-O 3.18Å
67T89Confident88.1Confident53 Ų5370.5 Ų70.533%0.32540%0.397SS..  trans-81.6103.5168.653.90000109.5T69 L70 Y71 W121 A122T67-T69 VanDerWaalsContact C-N 3.28Å; T67-T69 PolarHBondContact O-N 3.43Å; T67-L70 PolarHBondContact O-N 2.89Å; T67-Y71 WeakPolarHBondContact O-CB 3.37Å; T67-Y71 PolarHBondContact O-N 3.25Å; T67-W121 HydrophobicContact CG2-CZ3 4.31Å; T67-A122 PolarHBondContact N-O 2.95Å; T67-A122 WeakPolarHBondContact OG1-CA 3.38Å
68I85.8Confident88.2Confident110 Ų11065.8 Ų65.856%0.56437%0.369SS*.Hα-helixtrans-56.6-39.2-168.7-62.3164.9000112.9S66 I72S66-I68 PolarHBondContact O-N 3.29Å; I68-I72 HydrophobicContact CG2-CD1 3.78Å; I68-I72 WeakPolarHBondContact O-CG1 3.37Å; I68-I72 PolarHBondContact O-N 3.03Å; I68-I72 VanDerWaalsContact O-N 3.14Å
69T90.1Very high88.3Confident106 Ų10661.4 Ų61.465%0.6535%0.351SS*.Hα-helixtrans-62.6-53.8-177.650.80000111.2T67 I72 T73T67-T69 VanDerWaalsContact C-N 3.28Å; T67-T69 PolarHBondContact O-N 3.43Å; T69-I72 PolarHBondContact O-N 3.03Å; T69-T73 VanDerWaalsContact O-CG2 3.28Å; T69-T73 WeakPolarHBondContact O-CG2 3.29Å; T69-T73 PolarHBondContact O-N 3.49Å; T69-T73 PolarHBondContact O-OG1 2.98Å; T69-T73 VanDerWaalsContact O-OG1 3.12Å
70L90.5Very high88.7Confident37 Ų3757.8 Ų57.819%0.19434%0.339CS..Hα-helixtrans-68.9-35.7-179.9-68.5174.4000112.4T67 I72 T73 A74 W118 W121 A122T67-L70 PolarHBondContact O-N 2.89Å; L70-I72 VanDerWaalsContact C-N 3.27Å; L70-I72 PolarHBondContact O-N 3.22Å; L70-T73 WeakPolarHBondContact CA-OG1 3.19Å; L70-T73 PolarHBondContact O-N 3.36Å; L70-T73 PolarHBondContact O-OG1 3.33Å; L70-A74 VanDerWaalsContact O-CB 3.24Å; L70-A74 WeakPolarHBondContact O-CB 3.48Å; L70-A74 PolarHBondContact O-N 2.68Å; L70-W118 HydrophobicContact CD2-CB 4.43Å; L70-W118 HydrophobicContact CD2-CD2 3.93Å; L70-W118 HydrophobicContact CD2-CE3 4.04Å; L70-W118 HydrophobicContact CD2-CG 4.11Å; L70-W121 HydrophobicContact CD1-CE3 3.37Å; L70-W121 HydrophobicContact CD1-CZ3 3.36Å; L70-A122 HydrophobicContact CB-CB 3.71Å
71Y89.1Confident89.2Confident4 Ų454.5 Ų54.52%0.01632%0.318CS..Hα-helixtrans-61.6-36.5177.7-173.3-87.5000112L61 P63 T67 P75 E214 Y215L61-Y71 PolarHBondContact O-OH 3.4Å; P63-Y71 HydrophobicContact CG-CE2 4.13Å; T67-Y71 WeakPolarHBondContact O-CB 3.37Å; T67-Y71 PolarHBondContact O-N 3.25Å; Y71-P75 WeakPolarHBondContact O-CD 3.21Å; Y71-E214 HydrophobicContact CE2-CB 4.48Å; Y71-E214 PolarHBondContact OH-O 3.17Å; Y71-Y215 AromaticContact CD1-CE1 3.99Å; Y71-Y215 HydrophobicContact CD1-CE1 3.99Å; Y71-Y215 HydrophobicContact CD2-CD1 4.33Å; Y71-Y215 AromaticContact CD2-CE1 3.59Å; Y71-Y215 HydrophobicContact CD2-CE1 3.59Å; Y71-Y215 HydrophobicContact CD2-CE2 4.12Å; Y71-Y215 AromaticContact CD2-CZ 3.47Å; Y71-Y215 VanDerWaalsContact CD2-CZ 3.47Å; Y71-Y215 WeakPolarHBondContact CD2-OH 3.48Å; Y71-Y215 AromaticContact CE1-CD1 3.98Å; Y71-Y215 HydrophobicContact CE1-CD1 3.98Å; Y71-Y215 AromaticContact CE1-CE1 3.85Å; Y71-Y215 HydrophobicContact CE1-CE1 3.85Å; Y71-Y215 AromaticContact CE2-CD1 3.72Å; Y71-Y215 HydrophobicContact CE2-CD1 3.72Å; Y71-Y215 HydrophobicContact CE2-CD2 4.12Å; Y71-Y215 AromaticContact CE2-CE1 3.45Å; Y71-Y215 HydrophobicContact CE2-CE1 3.45Å; Y71-Y215 VanDerWaalsContact CE2-CE1 3.45Å; Y71-Y215 AromaticContact CE2-CE2 3.88Å; Y71-Y215 HydrophobicContact CE2-CE2 3.88Å; Y71-Y215 HydrophobicContact CE2-CG 4.06Å; Y71-Y215 AromaticContact CE2-CZ 3.54Å; Y71-Y215 AromaticContact CG-CE1 3.87Å; Y71-Y215 HydrophobicContact CG-CE1 3.87Å; Y71-Y215 AromaticContact CZ-CD1 3.52Å; Y71-Y215 AromaticContact CZ-CE1 3.58Å; Y71-Y215 WeakPolarHBondContact O-CE1 3.49Å; Y71-Y215 WeakPolarHBondContact OH-CA 3.35Å
72I90.2Very high89.7Confident81 Ų8149.4 Ų49.442%0.41529%0.291SS..Hα-helixtrans-82.4-38.9177.6-63.9170.8000111.3I68 T69 L70I68-I72 HydrophobicContact CG2-CD1 3.78Å; I68-I72 WeakPolarHBondContact O-CG1 3.37Å; I68-I72 PolarHBondContact O-N 3.03Å; I68-I72 VanDerWaalsContact O-N 3.14Å; T69-I72 PolarHBondContact O-N 3.03Å; L70-I72 VanDerWaalsContact C-N 3.27Å; L70-I72 PolarHBondContact O-N 3.22Å
73T92.4Very high90.4Very high56 Ų5645 Ų4534%0.34427%0.273SS..Hα-helixtrans-73.5-34.5-175.958.20000112.8T69 L70 T76 L77T69-T73 VanDerWaalsContact O-CG2 3.28Å; T69-T73 WeakPolarHBondContact O-CG2 3.29Å; T69-T73 PolarHBondContact O-N 3.49Å; T69-T73 PolarHBondContact O-OG1 2.98Å; T69-T73 VanDerWaalsContact O-OG1 3.12Å; L70-T73 WeakPolarHBondContact CA-OG1 3.19Å; L70-T73 PolarHBondContact O-N 3.36Å; L70-T73 PolarHBondContact O-OG1 3.33Å; T73-T76 WeakPolarHBondContact CA-OG1 3.39Å; T73-T76 PolarHBondContact O-N 3.45Å; T73-T76 PolarHBondContact O-OG1 3.09Å; T73-L77 WeakPolarHBondContact O-CB 3.37Å; T73-L77 PolarHBondContact O-N 3.44Å
74A93Very high91Very high0 Ų047.9 Ų47.90%029%0.286CS..Hα-helixtrans-59.1-50.4-175.100000114.2L70 T76 L77 A78 W118 F223L70-A74 VanDerWaalsContact O-CB 3.24Å; L70-A74 WeakPolarHBondContact O-CB 3.48Å; L70-A74 PolarHBondContact O-N 2.68Å; A74-T76 VanDerWaalsContact C-N 3.32Å; A74-T76 PolarHBondContact O-N 3.36Å; A74-L77 PolarHBondContact O-N 3.22Å; A74-A78 PolarHBondContact O-N 3.41Å; A74-W118 HydrophobicContact CB-CB 3.99Å; A74-F223 HydrophobicContact CB-CZ 4.19Å
75P92.9Very high91.8Very high2 Ų242.7 Ų42.71%0.01324%0.244CC..Hα-helixtrans-64.2-35.5176.3-11.518.6000113.2Y71 A78 L79 Y215 P219 L222 F223Y71-P75 WeakPolarHBondContact O-CD 3.21Å; P75-A78 PolarHBondContact O-N 2.71Å; P75-L79 PolarHBondContact O-N 3Å; P75-Y215 HydrophobicContact CG-CD1 4.06Å; P75-Y215 HydrophobicContact CG-CE1 3.65Å; P75-P219 HydrophobicContact CG-CB 4.08Å; P75-L222 HydrophobicContact CB-CB 3.73Å; P75-L222 HydrophobicContact CB-CD1 3.9Å; P75-L222 HydrophobicContact CB-CG 4.47Å; P75-F223 HydrophobicContact CB-CD2 4.06Å; P75-F223 HydrophobicContact CB-CE2 3.77Å; P75-F223 HydrophobicContact CB-CZ 4.02Å; P75-F223 HydrophobicContact CG-CD2 4.22Å; P75-F223 HydrophobicContact CG-CE2 3.54Å; P75-F223 HydrophobicContact CG-CZ 3.91Å
76T93.8Very high92.6Very high66 Ų6639.2 Ų39.241%0.40522%0.221SC..Hα-helixtrans-66.9-40.7176.662.90000111.2T73 A74 L79 T80 L222T73-T76 WeakPolarHBondContact CA-OG1 3.39Å; T73-T76 PolarHBondContact O-N 3.45Å; T73-T76 PolarHBondContact O-OG1 3.09Å; A74-T76 VanDerWaalsContact C-N 3.32Å; A74-T76 PolarHBondContact O-N 3.36Å; T76-L79 PolarHBondContact O-N 2.72Å; T76-T80 VanDerWaalsContact O-CG2 3.26Å; T76-T80 WeakPolarHBondContact O-CG2 3.38Å; T76-T80 PolarHBondContact O-N 3.23Å; T76-T80 PolarHBondContact O-OG1 3.04Å; T76-L222 HydrophobicContact CG2-CD1 4.31Å
77L95.4Very high93.1Very high37 Ų3739.3 Ų39.319%0.19422%0.223CC..Hα-helixtrans-63.1-45.4176.9-170.4123.9000110.6T73 A74 L79 T80 I81 W118T73-L77 WeakPolarHBondContact O-CB 3.37Å; T73-L77 PolarHBondContact O-N 3.44Å; A74-L77 PolarHBondContact O-N 3.22Å; L77-L79 PolarHBondContact O-N 3.41Å; L77-T80 WeakPolarHBondContact CA-OG1 3.36Å; L77-T80 PolarHBondContact O-N 3.37Å; L77-T80 PolarHBondContact O-OG1 3.36Å; L77-I81 HydrophobicContact CD2-CD1 3.39Å; L77-I81 HydrophobicContact CG-CD1 3.78Å; L77-I81 HydrophobicContact CG-CG1 4.44Å; L77-I81 WeakPolarHBondContact O-CG1 3.34Å; L77-I81 PolarHBondContact O-N 3.39Å; L77-W118 HydrophobicContact CD1-CH2 4.39Å; L77-W118 HydrophobicContact CD1-CZ3 3.89Å
78A94.4Very high93.3Very high7 Ų737 Ų376%0.05821%0.208CC..Hα-helixtrans-53.5-52.3176.300000112.3A74 P75 I81 A82 F223 A226A74-A78 PolarHBondContact O-N 3.41Å; P75-A78 PolarHBondContact O-N 2.71Å; A78-I81 PolarHBondContact O-N 3.14Å; A78-A82 WeakPolarHBondContact O-CB 3Å; A78-A82 PolarHBondContact O-N 3.25Å; A78-F223 HydrophobicContact CB-CD1 3.83Å; A78-F223 HydrophobicContact CB-CE1 3.8Å; A78-A226 HydrophobicContact CB-CB 3.92Å
79L95.3Very high93.7Very high30 Ų3032 Ų3216%0.15718%0.183CC..Hα-helixtrans-65.9-40.9179.6-174.669.5000112.2P75 T76 L77 I81 A82 L83 L222 M225P75-L79 PolarHBondContact O-N 3Å; T76-L79 PolarHBondContact O-N 2.72Å; L77-L79 PolarHBondContact O-N 3.41Å; L79-I81 PolarHBondContact O-N 2.71Å; L79-A82 PolarHBondContact O-N 3.06Å; L79-L83 HydrophobicContact CD1-CD1 4.45Å; L79-L83 HydrophobicContact CD1-CG 4.48Å; L79-L83 HydrophobicContact CG-CD1 4.13Å; L79-L83 WeakPolarHBondContact O-CG 3.46Å; L79-L83 PolarHBondContact O-N 3.31Å; L79-L222 HydrophobicContact CB-CD2 4.49Å; L79-L222 HydrophobicContact CD2-CD2 3.6Å; L79-M225 HydrophobicContact CD1-CB 4.01Å
80T95.6Very high93.8Very high74 Ų7427 Ų2745%0.45415%0.152SC..Hα-helixtrans-61.7-43.5179.155.20000112.1T76 L77 L83 L84T76-T80 VanDerWaalsContact O-CG2 3.26Å; T76-T80 WeakPolarHBondContact O-CG2 3.38Å; T76-T80 PolarHBondContact O-N 3.23Å; T76-T80 PolarHBondContact O-OG1 3.04Å; L77-T80 WeakPolarHBondContact CA-OG1 3.36Å; L77-T80 PolarHBondContact O-N 3.37Å; L77-T80 PolarHBondContact O-OG1 3.36Å; T80-L83 PolarHBondContact O-N 3.12Å; T80-L84 WeakPolarHBondContact O-CB 3.37Å; T80-L84 VanDerWaalsContact O-CG 3.25Å; T80-L84 WeakPolarHBondContact O-CG 3.36Å; T80-L84 PolarHBondContact O-N 3.08Å
81I95.8Very high93.8Very high4 Ų427.9 Ų27.92%0.02116%0.156CC..Hα-helixtrans-65.3-45.5177.4-65.4169000110.3L77 A78 L79 L83 L84 L85 T108 L111 A112L77-I81 HydrophobicContact CD2-CD1 3.39Å; L77-I81 HydrophobicContact CG-CD1 3.78Å; L77-I81 HydrophobicContact CG-CG1 4.44Å; L77-I81 WeakPolarHBondContact O-CG1 3.34Å; L77-I81 PolarHBondContact O-N 3.39Å; A78-I81 PolarHBondContact O-N 3.14Å; L79-I81 PolarHBondContact O-N 2.71Å; I81-L83 PolarHBondContact O-N 3.18Å; I81-L84 PolarHBondContact O-N 2.65Å; I81-L84 VanDerWaalsContact O-N 3.11Å; I81-L85 HydrophobicContact CG2-CD1 4.07Å; I81-L85 WeakPolarHBondContact O-CG 3.15Å; I81-L85 PolarHBondContact O-N 2.93Å; I81-L85 VanDerWaalsContact O-N 3.09Å; I81-T108 VanDerWaalsContact CG2-O 3.25Å; I81-T108 WeakPolarHBondContact CG2-O 3.02Å; I81-L111 HydrophobicContact CD1-CB 4.01Å; I81-L111 HydrophobicContact CD1-CD2 3.74Å; I81-L111 HydrophobicContact CD1-CG 3.71Å; I81-L111 HydrophobicContact CG1-CD2 4.08Å; I81-A112 HydrophobicContact CG2-CB 3.99Å
82A95.6Very high93.7Very high0 Ų028.2 Ų28.20%016%0.159CC..Hα-helixtrans-60.5-32.2-179.900000112.9A78 L79 W86 A226 T229 N230A78-A82 WeakPolarHBondContact O-CB 3Å; A78-A82 PolarHBondContact O-N 3.25Å; L79-A82 PolarHBondContact O-N 3.06Å; A82-W86 PolarHBondContact O-NE1 3.01Å; A82-A226 HydrophobicContact CB-CB 4.02Å; A82-T229 VanDerWaalsContact CB-OG1 3.25Å; A82-T229 WeakPolarHBondContact CB-OG1 3.07Å; A82-N230 WeakPolarHBondContact CA-OD1 3.48Å; A82-N230 VanDerWaalsContact CB-OD1 3.28Å; A82-N230 WeakPolarHBondContact CB-OD1 3.18Å
83L95.2Very high93.7Very high35 Ų3529.9 Ų29.918%0.18317%0.168CC..Hα-helixtrans-80.4-35.9173.9-68.7174.2000112.8I10 I13 L14 L79 T80 I81 L85 W86I10-L83 HydrophobicContact CG2-CD1 4.18Å; I10-L83 HydrophobicContact CG2-CD2 4.18Å; I13-L83 HydrophobicContact CG2-CD2 4.41Å; L14-L83 HydrophobicContact CD2-CD2 4.49Å; L79-L83 HydrophobicContact CD1-CD1 4.45Å; L79-L83 HydrophobicContact CD1-CG 4.48Å; L79-L83 HydrophobicContact CG-CD1 4.13Å; L79-L83 WeakPolarHBondContact O-CG 3.46Å; L79-L83 PolarHBondContact O-N 3.31Å; T80-L83 PolarHBondContact O-N 3.12Å; I81-L83 PolarHBondContact O-N 3.18Å; L83-L85 VanDerWaalsContact C-N 3.28Å; L83-L85 PolarHBondContact O-N 3.29Å; L83-W86 PolarHBondContact O-N 3.31Å
84L95.3Very high93.8Very high92 Ų9228.3 Ų28.348%0.48216%0.159SC..Hα-helixtrans-63-34.4178-79168.4000112.6T80 I81 W86 A87T80-L84 WeakPolarHBondContact O-CB 3.37Å; T80-L84 VanDerWaalsContact O-CG 3.25Å; T80-L84 WeakPolarHBondContact O-CG 3.36Å; T80-L84 PolarHBondContact O-N 3.08Å; I81-L84 PolarHBondContact O-N 2.65Å; I81-L84 VanDerWaalsContact O-N 3.11Å; L84-W86 PolarHBondContact O-N 2.95Å; L84-A87 WeakPolarHBondContact O-CB 3.34Å; L84-A87 PolarHBondContact O-N 2.65Å; L84-A87 VanDerWaalsContact O-N 3.09Å
85L95.6Very high93.8Very high2 Ų231.4 Ų31.41%0.0118%0.175CC..THydrogen-bonded Turntrans-58.3-19.7177.7-76.9159.3000113.6I81 L83 I105 T108 M233I81-L85 HydrophobicContact CG2-CD1 4.07Å; I81-L85 WeakPolarHBondContact O-CG 3.15Å; I81-L85 PolarHBondContact O-N 2.93Å; I81-L85 VanDerWaalsContact O-N 3.09Å; L83-L85 VanDerWaalsContact C-N 3.28Å; L83-L85 PolarHBondContact O-N 3.29Å; L85-I105 HydrophobicContact CD2-CB 4.31Å; L85-I105 HydrophobicContact CD2-CG2 3.81Å; L85-T108 WeakPolarHBondContact CD2-OG1 3.35Å; L85-M233 HydrophobicContact CB-CE 3.83Å; L85-M233 HydrophobicContact CB-CG 3.86Å; L85-M233 HydrophobicContact CB-SD 3.95Å; L85-M233 HydrophobicContact CD1-CE 3.51Å; L85-M233 HydrophobicContact CD2-CE 4.1Å; L85-M233 HydrophobicContact CD2-SD 4.48Å; L85-M233 HydrophobicContact CG-CE 4.01Å
86W95.8Very high93.8Very high13 Ų1334.4 Ų34.45%0.04919%0.194CC..THydrogen-bonded Turntrans-83.2-20.2178.3-69.781.3000114.8L9 I13 A82 L83 L84 L89 M91 I232 M233 T236L9-W86 HydrophobicContact CD2-CB 4.23Å; I13-W86 HydrophobicContact CD1-CB 3.93Å; I13-W86 HydrophobicContact CD1-CD2 3.44Å; I13-W86 VanDerWaalsContact CD1-CD2 3.44Å; I13-W86 HydrophobicContact CD1-CE3 3.62Å; I13-W86 HydrophobicContact CD1-CG 3.58Å; I13-W86 HydrophobicContact CD1-CZ3 4.25Å; I13-W86 HydrophobicContact CG1-CD2 4.07Å; I13-W86 HydrophobicContact CG1-CE3 4.03Å; I13-W86 HydrophobicContact CG1-CH2 4.3Å; I13-W86 HydrophobicContact CG1-CZ2 4.37Å; I13-W86 HydrophobicContact CG1-CZ3 4.15Å; I13-W86 HydrophobicContact CG2-CD2 4.48Å; I13-W86 HydrophobicContact CG2-CZ2 3.97Å; A82-W86 PolarHBondContact O-NE1 3.01Å; L83-W86 PolarHBondContact O-N 3.31Å; L84-W86 PolarHBondContact O-N 2.95Å; W86-L89 HydrophobicContact CD2-CD1 4.17Å; W86-L89 HydrophobicContact CE3-CD1 3.87Å; W86-L89 HydrophobicContact CZ3-CD1 4.44Å; W86-L89 PolarHBondContact O-N 3.4Å; W86-M91 HydrophobicContact CE3-CE 3.56Å; W86-M91 HydrophobicContact CZ3-CE 3.53Å; W86-I232 HydrophobicContact CH2-CB 4.1Å; W86-I232 HydrophobicContact CH2-CG2 3.54Å; W86-I232 HydrophobicContact CZ2-CB 3.94Å; W86-I232 HydrophobicContact CZ2-CG2 3.93Å; W86-M233 HydrophobicContact CD2-CG 4.48Å; W86-M233 HydrophobicContact CZ2-CB 3.9Å; W86-T236 HydrophobicContact CH2-CG2 3.89Å; W86-T236 HydrophobicContact CZ3-CG2 3.94Å
87A93.2Very high93.7Very high17 Ų1736.1 Ų36.114%0.1420%0.2CC..THydrogen-bonded Turntrans-57.3-42-174.400000114.7L84 L95 V96L84-A87 WeakPolarHBondContact O-CB 3.34Å; L84-A87 PolarHBondContact O-N 2.65Å; L84-A87 VanDerWaalsContact O-N 3.09Å; A87-L95 WeakPolarHBondContact O-CB 3.33Å; A87-L95 PolarHBondContact O-N 2.91Å; A87-V96 HydrophobicContact CB-CG2 4.35Å; A87-V96 PolarHBondContact O-N 2.9Å
88P94.9Very high93.7Very high4 Ų437.1 Ų37.13%0.02621%0.205CC..THydrogen-bonded Turntrans-87.6-6.4-179.137.1-40.2000114.3P90 P94 L98 F104 I105 L162P88-P90 WeakPolarHBondContact O-CD 3.17Å; P88-P94 WeakPolarHBondContact O-CB 3.1Å; P88-L98 HydrophobicContact CB-CD1 4.35Å; P88-F104 HydrophobicContact CG-CD1 3.86Å; P88-F104 HydrophobicContact CG-CE1 4.19Å; P88-I105 HydrophobicContact CG-CD1 3.91Å; P88-I105 HydrophobicContact CG-CG1 3.72Å; P88-L162 HydrophobicContact CB-CD1 4.14Å; P88-L162 HydrophobicContact CG-CD1 4.39Å; P88-L162 WeakPolarHBondContact O-CD1 3.32Å
89L94.4Very high93.6Very high5 Ų542.6 Ų42.63%0.02623%0.234CC..  trans-69.4126-174.9-73176.1000111.2W86 M91 P94 I105 L162 M233 T236 L237W86-L89 HydrophobicContact CD2-CD1 4.17Å; W86-L89 HydrophobicContact CE3-CD1 3.87Å; W86-L89 HydrophobicContact CZ3-CD1 4.44Å; W86-L89 PolarHBondContact O-N 3.4Å; L89-M91 PolarHBondContact O-N 3.27Å; L89-P94 WeakPolarHBondContact O-CA 3.44Å; L89-I105 HydrophobicContact CD2-CD1 4.06Å; L89-L162 HydrophobicContact CD2-CD1 4.4Å; L89-M233 HydrophobicContact CD1-CG 4.1Å; L89-T236 WeakPolarHBondContact CD1-OG1 3.1Å; L89-L237 HydrophobicContact CD2-CB 4.31Å; L89-L237 HydrophobicContact CD2-CD1 4.27Å
90P92Very high93.5Very high1 Ų145.6 Ų45.61%0.00625%0.249CC..  trans-81.6118.6-177.232.9-36.3000111.5P88 P92 L162 I166 T240P88-P90 WeakPolarHBondContact O-CD 3.17Å; P90-P92 WeakPolarHBondContact CB-O 3.5Å; P90-L162 HydrophobicContact CG-CB 3.9Å; P90-I166 HydrophobicContact CB-CD1 3.83Å; P90-I166 HydrophobicContact CG-CD1 4.11Å; P90-T240 HydrophobicContact CG-CG2 4.07Å
91M88.8Confident93.5Very high56 Ų5642.1 Ų42.128%0.27623%0.228SC..SBendtrans-134.283.3173.8-67.2-172-123.500112.8W86 L89 N93 F259W86-M91 HydrophobicContact CE3-CE 3.56Å; W86-M91 HydrophobicContact CZ3-CE 3.53Å; L89-M91 PolarHBondContact O-N 3.27Å; M91-N93 PolarHBondContact N-O 2.81Å; M91-N93 PolarHBondContact O-N 3.41Å; M91-F259 HydrophobicContact CG-CD1 4.08Å; M91-F259 HydrophobicContact CG-CE1 3.78Å; M91-F259 HydrophobicContact SD-CE1 4.22Å
92P87.4Confident93.3Very high11 Ų1142.1 Ų42.17%0.07123%0.228CC..SBendcis-54.4-21.7-48.526.5-35000113.6P90 Y247 P252 Y255 T256P90-P92 WeakPolarHBondContact CB-O 3.5Å; P92-Y247 HydrophobicContact CB-CD2 3.56Å; P92-Y247 HydrophobicContact CB-CE2 3.64Å; P92-Y247 HydrophobicContact CG-CD2 4Å; P92-Y247 HydrophobicContact CG-CE2 3.66Å; P92-P252 HydrophobicContact CG-CB 3.93Å; P92-Y255 HydrophobicContact CB-CD1 3.51Å; P92-Y255 HydrophobicContact CB-CD2 4.38Å; P92-Y255 HydrophobicContact CB-CE1 3.89Å; P92-Y255 HydrophobicContact CB-CG 3.81Å; P92-Y255 HydrophobicContact CG-CD1 4.12Å; P92-Y255 HydrophobicContact CG-CG 4.41Å; P92-T256 VanDerWaalsContact CD-CG2 3.41Å
93N91.1Very high93.3Very high115 Ų11545.7 Ų45.762%0.61525%0.247SC*.SBendtrans-97.4130.1175.4-65.5-38000109.5M91M91-N93 PolarHBondContact N-O 2.81Å; M91-N93 PolarHBondContact O-N 3.41Å
94P93.8Very high93.3Very high23 Ų2347.2 Ų47.215%0.14925%0.252CS..  trans-73.5157.6175.331.4-35.4000111.3P88 L89 V96 N97P88-P94 WeakPolarHBondContact O-CB 3.1Å; L89-P94 WeakPolarHBondContact O-CA 3.44Å; P94-V96 VanDerWaalsContact C-N 3.31Å; P94-N97 HydrophobicContact CG-CB 3.86Å
95L93.1Very high93.3Very high65 Ų6543.3 Ų43.334%0.3423%0.232SC..SBendtrans-63.1-43.1172.3-178.975.3000110.4N5 L9 A87N5-L95 HydrophobicContact CB-CD1 3.72Å; L9-L95 HydrophobicContact CD2-CB 4.21Å; L9-L95 HydrophobicContact CD2-CD2 3.81Å; A87-L95 WeakPolarHBondContact O-CB 3.33Å; A87-L95 PolarHBondContact O-N 2.91Å
96V93.1Very high93.2Very high66 Ų6645.4 Ų45.440%0.424%0.243SC..SBendtrans-126.2108175.8-173.50000108.4A87 P94 L98A87-V96 HydrophobicContact CB-CG2 4.35Å; A87-V96 PolarHBondContact O-N 2.9Å; P94-V96 VanDerWaalsContact C-N 3.31Å; V96-L98 HydrophobicContact CG1-CD2 3.64Å; V96-L98 HydrophobicContact CG1-CG 3.88Å; V96-L98 PolarHBondContact O-N 3.35Å; V96-L98 VanDerWaalsContact O-N 3.16Å
97N92.8Very high93.1Very high102 Ų10247.5 Ų47.555%0.54526%0.263SS..  trans-76.4102.6175.4-169.31.8000109.8P94 N161P94-N97 HydrophobicContact CG-CB 3.86Å; N97-N161 PolarHBondContact OD1-ND2 3.41Å; N97-N161 VanDerWaalsContact OD1-ND2 3.09Å; N97-N161 PolarHBondContact OD1-OD1 3.19Å
98L93.8Very high93.1Very high57 Ų5747.5 Ų47.530%0.29826%0.261SS..  trans-103.4131.7178.7-63.4177.8000110P88 V96 L100 G101 F104P88-L98 HydrophobicContact CB-CD1 4.35Å; V96-L98 HydrophobicContact CG1-CD2 3.64Å; V96-L98 HydrophobicContact CG1-CG 3.88Å; V96-L98 PolarHBondContact O-N 3.35Å; V96-L98 VanDerWaalsContact O-N 3.16Å; L98-L100 PolarHBondContact O-N 3.5Å; L98-G101 PolarHBondContact O-N 3.42Å; L98-F104 HydrophobicContact CD1-CB 4Å; L98-F104 HydrophobicContact CD1-CD1 4.22Å; L98-F104 HydrophobicContact CD1-CD2 4.11Å; L98-F104 HydrophobicContact CD1-CG 3.83Å
99N92.9Very high93Very high122 Ų12247.6 Ų47.665%0.65226%0.262SS*.THydrogen-bonded Turntrans-60.8-35.1174-166.217.1000112F160 N161N99-F160 CarbonylContact O-C 3.59Å; N99-F160 VanDerWaalsContact O-C 3.31Å; N99-N161 PolarHBondContact O-N 3.48Å
100L94.1Very high92.8Very high93 Ų9349.3 Ų49.349%0.48727%0.274SS..THydrogen-bonded Turntrans-106.142.6176.7-57.5179.6000111.5L98 L102 L103 F104 F160L98-L100 PolarHBondContact O-N 3.5Å; L100-L102 VanDerWaalsContact C-N 3.32Å; L100-L102 PolarHBondContact O-N 3.12Å; L100-L103 HydrophobicContact CB-CB 4.36Å; L100-L103 HydrophobicContact CB-CD1 4.29Å; L100-L103 HydrophobicContact CD1-CD1 4.32Å; L100-L103 HydrophobicContact CD2-CD1 4.12Å; L100-L103 HydrophobicContact CG-CD1 4.47Å; L100-L103 PolarHBondContact O-N 3.07Å; L100-F104 PolarHBondContact O-N 2.92Å; L100-F160 HydrophobicContact CD2-CB 3.9Å; L100-F160 HydrophobicContact CD2-CD2 3.95Å; L100-F160 HydrophobicContact CD2-CG 4.14Å
101G94.2Very high92.9Very high1 Ų153.1 Ų53.11%0.0129%0.294CS..Hα-helixtrans-57.5-40.7-174.400000113.8L98 F104 I105 F160L98-G101 PolarHBondContact O-N 3.42Å; G101-F104 WeakPolarHBondContact O-CB 3.38Å; G101-F104 PolarHBondContact O-N 3.44Å; G101-I105 WeakPolarHBondContact O-CG1 3.49Å; G101-I105 PolarHBondContact O-N 3.39Å; G101-I105 VanDerWaalsContact O-N 3.17Å; G101-F160 PolarHBondContact N-O 2.87Å
102L93.3Very high93Very high5 Ų551.3 Ų51.33%0.02629%0.288CS..Hα-helixtrans-71.3-39.6-179.9-168.9150.8000112.8L100 F104 I105 L106 L150 L154 F160 L162L100-L102 VanDerWaalsContact C-N 3.32Å; L100-L102 PolarHBondContact O-N 3.12Å; L102-F104 VanDerWaalsContact C-N 3.27Å; L102-F104 PolarHBondContact O-N 2.86Å; L102-I105 PolarHBondContact O-N 3.42Å; L102-I105 VanDerWaalsContact O-N 3.17Å; L102-L106 PolarHBondContact O-N 2.94Å; L102-L150 HydrophobicContact CD1-CD2 3.62Å; L102-L150 HydrophobicContact CD2-CB 3.92Å; L102-L150 HydrophobicContact CD2-CD1 3.95Å; L102-L150 HydrophobicContact CD2-CD2 3.97Å; L102-L150 HydrophobicContact CD2-CG 4.13Å; L102-L150 HydrophobicContact CG-CD2 4.07Å; L102-L154 HydrophobicContact CB-CD1 4.5Å; L102-L154 HydrophobicContact CD1-CD1 3.8Å; L102-L154 HydrophobicContact CD1-CD2 3.83Å; L102-L154 HydrophobicContact CD1-CG 3.98Å; L102-L154 HydrophobicContact CD2-CD1 3.84Å; L102-L154 HydrophobicContact CG-CD1 4.25Å; L102-F160 PolarHBondContact N-O 3.36Å; L102-F160 VanDerWaalsContact N-O 3.16Å; L102-L162 HydrophobicContact CB-CD2 4.34Å; L102-L162 HydrophobicContact CD1-CD2 4.35Å
103L94Very high93.2Very high75 Ų7551.6 Ų51.639%0.39329%0.29SS..Hα-helixtrans-63.6-36.1173.9-70.4174000111.5L100 I105 L106 A107 F160L100-L103 HydrophobicContact CB-CB 4.36Å; L100-L103 HydrophobicContact CB-CD1 4.29Å; L100-L103 HydrophobicContact CD1-CD1 4.32Å; L100-L103 HydrophobicContact CD2-CD1 4.12Å; L100-L103 HydrophobicContact CG-CD1 4.47Å; L100-L103 PolarHBondContact O-N 3.07Å; L103-I105 VanDerWaalsContact C-N 3.33Å; L103-I105 PolarHBondContact O-N 3.45Å; L103-L106 PolarHBondContact O-N 3.38Å; L103-A107 WeakPolarHBondContact O-CB 3.28Å; L103-A107 PolarHBondContact O-N 3.01Å; L103-F160 HydrophobicContact CD1-CD1 4.13Å; L103-F160 HydrophobicContact CD1-CE1 4.28Å; L103-F160 HydrophobicContact CD1-CG 4.32Å; L103-F160 HydrophobicContact CD2-CD1 4.35Å; L103-F160 HydrophobicContact CD2-CE1 4.18Å; L103-F160 HydrophobicContact CG-CD1 3.82Å; L103-F160 HydrophobicContact CG-CE1 4.1Å; L103-F160 HydrophobicContact CG-CG 4.38Å
104F95.6Very high93.3Very high67 Ų6751.7 Ų51.729%0.29428%0.282SS..Hα-helixtrans-60.3-43.3173.2173.1-89.7000111.6P88 L98 L100 G101 L102 A107 T108P88-F104 HydrophobicContact CG-CD1 3.86Å; P88-F104 HydrophobicContact CG-CE1 4.19Å; L98-F104 HydrophobicContact CD1-CB 4Å; L98-F104 HydrophobicContact CD1-CD1 4.22Å; L98-F104 HydrophobicContact CD1-CD2 4.11Å; L98-F104 HydrophobicContact CD1-CG 3.83Å; L100-F104 PolarHBondContact O-N 2.92Å; G101-F104 WeakPolarHBondContact O-CB 3.38Å; G101-F104 PolarHBondContact O-N 3.44Å; L102-F104 VanDerWaalsContact C-N 3.27Å; L102-F104 PolarHBondContact O-N 2.86Å; F104-A107 PolarHBondContact O-N 3.41Å; F104-T108 HydrophobicContact CD1-CG2 4.37Å; F104-T108 HydrophobicContact CD2-CG2 4.25Å; F104-T108 HydrophobicContact CE1-CG2 3.96Å; F104-T108 HydrophobicContact CE2-CG2 3.82Å; F104-T108 HydrophobicContact CZ-CG2 3.68Å; F104-T108 WeakPolarHBondContact O-CB 3.49Å; F104-T108 WeakPolarHBondContact O-CG2 3.37Å; F104-T108 PolarHBondContact O-N 3.08Å; F104-T108 PolarHBondContact O-OG1 2.97Å
105I95Very high93.2Very high10 Ų1050.9 Ų50.95%0.05128%0.277CS..Hα-helixtrans-61.9-46.1176.5-67.5-179.5000110.7L85 P88 L89 G101 L102 L103 A107 T108 S109 L162 L237L85-I105 HydrophobicContact CD2-CB 4.31Å; L85-I105 HydrophobicContact CD2-CG2 3.81Å; P88-I105 HydrophobicContact CG-CD1 3.91Å; P88-I105 HydrophobicContact CG-CG1 3.72Å; L89-I105 HydrophobicContact CD2-CD1 4.06Å; G101-I105 WeakPolarHBondContact O-CG1 3.49Å; G101-I105 PolarHBondContact O-N 3.39Å; G101-I105 VanDerWaalsContact O-N 3.17Å; L102-I105 PolarHBondContact O-N 3.42Å; L102-I105 VanDerWaalsContact O-N 3.17Å; L103-I105 VanDerWaalsContact C-N 3.33Å; L103-I105 PolarHBondContact O-N 3.45Å; I105-A107 PolarHBondContact O-N 2.88Å; I105-T108 WeakPolarHBondContact CA-OG1 3.27Å; I105-T108 PolarHBondContact O-N 3.41Å; I105-T108 PolarHBondContact O-OG1 3.38Å; I105-T108 VanDerWaalsContact O-OG1 3.13Å; I105-S109 WeakPolarHBondContact O-CB 3.49Å; I105-S109 PolarHBondContact O-N 2.92Å; I105-S109 PolarHBondContact O-OG 3.39Å; I105-L162 HydrophobicContact CD1-CD1 3.68Å; I105-L237 HydrophobicContact CB-CD1 4.39Å; I105-L237 HydrophobicContact CD1-CD1 3.28Å; I105-L237 HydrophobicContact CG1-CD1 4.39Å; I105-L237 HydrophobicContact CG2-CD1 3.7Å
106L93.5Very high93.2Very high45 Ų4548.7 Ų48.724%0.23627%0.266CS..Hα-helixtrans-65.4-39-180-166.5138.8000112.5L102 L103 S109 S110 A147 L150L102-L106 PolarHBondContact O-N 2.94Å; L103-L106 PolarHBondContact O-N 3.38Å; L106-S109 PolarHBondContact O-OG 2.87Å; L106-S109 VanDerWaalsContact O-OG 3.13Å; L106-S110 PolarHBondContact O-N 3.15Å; L106-S110 PolarHBondContact O-OG 3.46Å; L106-A147 HydrophobicContact CD1-CB 3.76Å; L106-L150 HydrophobicContact CD1-CD1 3.82Å
107A93.9Very high93.1Very high57 Ų5748 Ų4847%0.47126%0.26SS..Hα-helixtrans-67.5-39.1175.800000112.1L103 F104 I105 S110 L111L103-A107 WeakPolarHBondContact O-CB 3.28Å; L103-A107 PolarHBondContact O-N 3.01Å; F104-A107 PolarHBondContact O-N 3.41Å; I105-A107 PolarHBondContact O-N 2.88Å; A107-S110 PolarHBondContact O-OG 2.65Å; A107-L111 PolarHBondContact O-N 2.82Å
108T94.1Very high93.2Very high18 Ų1847.4 Ų47.411%0.1125%0.25CC..Hα-helixtrans-77.1-31.4179.348.80000112.6I81 L85 F104 I105 L111 A112I81-T108 VanDerWaalsContact CG2-O 3.25Å; I81-T108 WeakPolarHBondContact CG2-O 3.02Å; L85-T108 WeakPolarHBondContact CD2-OG1 3.35Å; F104-T108 HydrophobicContact CD1-CG2 4.37Å; F104-T108 HydrophobicContact CD2-CG2 4.25Å; F104-T108 HydrophobicContact CE1-CG2 3.96Å; F104-T108 HydrophobicContact CE2-CG2 3.82Å; F104-T108 HydrophobicContact CZ-CG2 3.68Å; F104-T108 WeakPolarHBondContact O-CB 3.49Å; F104-T108 WeakPolarHBondContact O-CG2 3.37Å; F104-T108 PolarHBondContact O-N 3.08Å; F104-T108 PolarHBondContact O-OG1 2.97Å; I105-T108 WeakPolarHBondContact CA-OG1 3.27Å; I105-T108 PolarHBondContact O-N 3.41Å; I105-T108 PolarHBondContact O-OG1 3.38Å; I105-T108 VanDerWaalsContact O-OG1 3.13Å; T108-L111 WeakPolarHBondContact O-CB 3.49Å; T108-L111 PolarHBondContact O-N 3.08Å; T108-A112 PolarHBondContact O-N 3.32Å
109S91.8Very high93Very high6 Ų644.7 Ų44.74%0.04224%0.236CC..Hα-helixtrans-66.8-40.7173.571.60000111.8I105 L106 L111 A112 E192I105-S109 WeakPolarHBondContact O-CB 3.49Å; I105-S109 PolarHBondContact O-N 2.92Å; I105-S109 PolarHBondContact O-OG 3.39Å; L106-S109 PolarHBondContact O-OG 2.87Å; L106-S109 VanDerWaalsContact O-OG 3.13Å; S109-L111 PolarHBondContact O-N 2.78Å; S109-A112 WeakPolarHBondContact O-CB 3.32Å; S109-A112 PolarHBondContact O-N 3.16Å; S109-E192 VanDerWaalsContact CB-OE1 3.31Å; S109-E192 WeakPolarHBondContact CB-OE1 3.45Å; S109-E192 PolarHBondContact OG-OE1 3.18Å
110S91.4Very high92.9Very high41 Ų4138.9 Ų38.929%0.28721%0.205SC..Hα-helixtrans-62.1-27.1173.264.90000113.5L106 A107 A112 E143L106-S110 PolarHBondContact O-N 3.15Å; L106-S110 PolarHBondContact O-OG 3.46Å; A107-S110 PolarHBondContact O-OG 2.65Å; S110-A112 VanDerWaalsContact C-N 3.31Å; S110-A112 PolarHBondContact O-N 3.26Å; S110-E143 WeakPolarHBondContact CA-OE1 3.09Å
111L92.6Very high92.8Very high80 Ų8041.9 Ų41.942%0.41921%0.209SC..Hα-helixtrans-70.2-27.6173.3-165.873.5000112.4I81 A107 T108 S109 V113 Y114I81-L111 HydrophobicContact CD1-CB 4.01Å; I81-L111 HydrophobicContact CD1-CD2 3.74Å; I81-L111 HydrophobicContact CD1-CG 3.71Å; I81-L111 HydrophobicContact CG1-CD2 4.08Å; A107-L111 PolarHBondContact O-N 2.82Å; T108-L111 WeakPolarHBondContact O-CB 3.49Å; T108-L111 PolarHBondContact O-N 3.08Å; S109-L111 PolarHBondContact O-N 2.78Å; L111-V113 PolarHBondContact O-N 3.37Å; L111-Y114 HydrophobicContact CD1-CD2 3.83Å; L111-Y114 HydrophobicContact CD1-CE2 4.17Å; L111-Y114 HydrophobicContact CG-CD2 4.47Å; L111-Y114 PolarHBondContact O-N 3.04Å; L111-Y114 VanDerWaalsContact O-N 3.15Å
112A91.1Very high92.6Very high19 Ų1941.9 Ų41.916%0.15721%0.209CC..Hα-helixtrans-61-29.8-178.800000112.1I81 T108 S109 S110 Y114 S115I81-A112 HydrophobicContact CG2-CB 3.99Å; T108-A112 PolarHBondContact O-N 3.32Å; S109-A112 WeakPolarHBondContact O-CB 3.32Å; S109-A112 PolarHBondContact O-N 3.16Å; S110-A112 VanDerWaalsContact C-N 3.31Å; S110-A112 PolarHBondContact O-N 3.26Å; A112-Y114 PolarHBondContact O-N 3.29Å; A112-S115 WeakPolarHBondContact O-CB 3.18Å; A112-S115 PolarHBondContact O-N 3.22Å; A112-S115 PolarHBondContact O-OG 3.49Å
113V92.4Very high92.2Very high17 Ų1741.6 Ų41.610%0.10321%0.208CC..Hα-helixtrans-57.7-34.7177.9-175.40000112.2L111 S115 I116 L117 V136 T139 E143L111-V113 PolarHBondContact O-N 3.37Å; V113-S115 VanDerWaalsContact C-N 3.3Å; V113-S115 PolarHBondContact O-N 3.32Å; V113-I116 PolarHBondContact O-N 2.72Å; V113-L117 PolarHBondContact O-N 3.49Å; V113-V136 HydrophobicContact CG1-CB 4.14Å; V113-V136 HydrophobicContact CG1-CG1 4Å; V113-V136 HydrophobicContact CG1-CG2 3.73Å; V113-T139 WeakPolarHBondContact CG1-OG1 3.49Å; V113-T139 HydrophobicContact CG2-CG2 4.06Å; V113-T139 VanDerWaalsContact CG2-OG1 3.22Å; V113-T139 WeakPolarHBondContact CG2-OG1 3.49Å; V113-E143 WeakPolarHBondContact CG2-OE1 3.48Å
114Y92.7Very high91.9Very high116 Ų11643.2 Ų43.246%0.45522%0.217SC..Hα-helixtrans-66.4-31.4178.4-68.4-75.6000112.8L111 A112 I116 L117 W118L111-Y114 HydrophobicContact CD1-CD2 3.83Å; L111-Y114 HydrophobicContact CD1-CE2 4.17Å; L111-Y114 HydrophobicContact CG-CD2 4.47Å; L111-Y114 PolarHBondContact O-N 3.04Å; L111-Y114 VanDerWaalsContact O-N 3.15Å; A112-Y114 PolarHBondContact O-N 3.29Å; Y114-I116 VanDerWaalsContact C-N 3.3Å; Y114-I116 PolarHBondContact O-N 3.01Å; Y114-L117 PolarHBondContact O-N 2.95Å; Y114-W118 VanDerWaalsContact O-CB 3.28Å; Y114-W118 WeakPolarHBondContact O-CB 3.32Å; Y114-W118 PolarHBondContact O-N 2.94Å
115S92.9Very high91.6Very high6 Ų641.3 Ų41.34%0.04221%0.211CC..Hα-helixtrans-61.3-42.6175.5700000111.4A112 V113 S119A112-S115 WeakPolarHBondContact O-CB 3.18Å; A112-S115 PolarHBondContact O-N 3.22Å; A112-S115 PolarHBondContact O-OG 3.49Å; V113-S115 VanDerWaalsContact C-N 3.3Å; V113-S115 PolarHBondContact O-N 3.32Å; S115-S119 VanDerWaalsContact O-CB 3.26Å; S115-S119 WeakPolarHBondContact O-CB 3.35Å; S115-S119 PolarHBondContact O-N 3.23Å; S115-S119 PolarHBondContact O-OG 3.13Å
116I91.2Very high91.2Very high19 Ų1946.9 Ų46.910%0.09724%0.241CC..Hα-helixtrans-69.7-46.3179.3-57.4171.9000109.9V113 Y114 W118 S119 G120 A135 F211V113-I116 PolarHBondContact O-N 2.72Å; Y114-I116 VanDerWaalsContact C-N 3.3Å; Y114-I116 PolarHBondContact O-N 3.01Å; I116-W118 PolarHBondContact O-N 3.46Å; I116-S119 PolarHBondContact O-N 3.42Å; I116-S119 PolarHBondContact O-OG 2.82Å; I116-G120 PolarHBondContact O-N 3.33Å; I116-G120 VanDerWaalsContact O-N 3.12Å; I116-A135 HydrophobicContact CG2-CB 3.74Å; I116-F211 HydrophobicContact CG1-CZ 4.47Å; I116-F211 HydrophobicContact CG2-CB 4.17Å; I116-F211 HydrophobicContact CG2-CD1 3.79Å; I116-F211 HydrophobicContact CG2-CD2 4.18Å; I116-F211 HydrophobicContact CG2-CE1 4.19Å; I116-F211 HydrophobicContact CG2-CG 3.78Å
117L92.8Very high91Very high53 Ų5351.8 Ų51.828%0.27726%0.258SS..Hα-helixtrans-61.3-48.1179-179.565.2000112.3V113 Y114 S119 G120 W121 V136V113-L117 PolarHBondContact O-N 3.49Å; Y114-L117 PolarHBondContact O-N 2.95Å; L117-S119 VanDerWaalsContact C-N 3.28Å; L117-S119 PolarHBondContact O-N 3.32Å; L117-G120 PolarHBondContact O-N 3.26Å; L117-W121 PolarHBondContact O-N 2.94Å; L117-V136 HydrophobicContact CB-CG2 3.93Å; L117-V136 HydrophobicContact CD1-CG2 4.14Å
118W93.4Very high90.7Very high89 Ų8949 Ų4934%0.33724%0.235SC..Hα-helixtrans-63.5-37.8178.7-69-3.4000111.2L70 A74 L77 Y114 I116 A122L70-W118 HydrophobicContact CD2-CB 4.43Å; L70-W118 HydrophobicContact CD2-CD2 3.93Å; L70-W118 HydrophobicContact CD2-CE3 4.04Å; L70-W118 HydrophobicContact CD2-CG 4.11Å; A74-W118 HydrophobicContact CB-CB 3.99Å; L77-W118 HydrophobicContact CD1-CH2 4.39Å; L77-W118 HydrophobicContact CD1-CZ3 3.89Å; Y114-W118 VanDerWaalsContact O-CB 3.28Å; Y114-W118 WeakPolarHBondContact O-CB 3.32Å; Y114-W118 PolarHBondContact O-N 2.94Å; I116-W118 PolarHBondContact O-N 3.46Å; W118-A122 WeakPolarHBondContact O-CB 3.31Å; W118-A122 PolarHBondContact O-N 2.88Å
119S91Very high90.5Very high0 Ų051.1 Ų51.10%025%0.246CC..Hα-helixtrans-62.5-44.1178.5750000112.9S115 I116 L117 S123 F211 Y215S115-S119 VanDerWaalsContact O-CB 3.26Å; S115-S119 WeakPolarHBondContact O-CB 3.35Å; S115-S119 PolarHBondContact O-N 3.23Å; S115-S119 PolarHBondContact O-OG 3.13Å; I116-S119 PolarHBondContact O-N 3.42Å; I116-S119 PolarHBondContact O-OG 2.82Å; L117-S119 VanDerWaalsContact C-N 3.28Å; L117-S119 PolarHBondContact O-N 3.32Å; S119-S123 PolarHBondContact O-N 2.99Å; S119-F211 WeakPolarHBondContact OG-CD2 3.39Å; S119-Y215 WeakPolarHBondContact CA-OH 3.24Å
120G90.3Very high90.4Very high0 Ų054.9 Ų54.90%026%0.264CS..Hα-helixtrans-69.1-42.9179.100000112.4I116 L117 S123I116-G120 PolarHBondContact O-N 3.33Å; I116-G120 VanDerWaalsContact O-N 3.12Å; L117-G120 PolarHBondContact O-N 3.26Å; G120-S123 PolarHBondContact O-OG 3.4Å
121W91.5Very high90.3Very high156 Ų15653 Ų5359%0.59125%0.251SS*.Hα-helixtrans-67.4-38.4176.7-168.274000112.5T67 L70 L117 S123 N124T67-W121 HydrophobicContact CG2-CZ3 4.31Å; L70-W121 HydrophobicContact CD1-CE3 3.37Å; L70-W121 HydrophobicContact CD1-CZ3 3.36Å; L117-W121 PolarHBondContact O-N 2.94Å; W121-S123 VanDerWaalsContact C-N 3.31Å; W121-S123 PolarHBondContact O-N 3.25Å; W121-N124 PolarHBondContact O-N 3.11Å
122A90.3Very high90.2Very high0 Ų049.1 Ų49.10%023%0.231CC..Hα-helixtrans-67.7-30.6-177.300000113.6S66 T67 L70 W118 N124S66-A122 CarbonylContact C-O 2.85Å; S66-A122 WeakPolarHBondContact CA-O 3.21Å; S66-A122 WeakPolarHBondContact CB-O 3.18Å; T67-A122 PolarHBondContact N-O 2.95Å; T67-A122 WeakPolarHBondContact OG1-CA 3.38Å; L70-A122 HydrophobicContact CB-CB 3.71Å; W118-A122 WeakPolarHBondContact O-CB 3.31Å; W118-A122 PolarHBondContact O-N 2.88Å; A122-N124 VanDerWaalsContact C-N 3.32Å
123S85.3Confident90.2Very high0 Ų052.8 Ų52.80%025%0.247CC..Hα-helixtrans-68.6-27.8179.270.40000113.2S119 G120 W121 S125 A128 E214S119-S123 PolarHBondContact O-N 2.99Å; G120-S123 PolarHBondContact O-OG 3.4Å; W121-S123 VanDerWaalsContact C-N 3.31Å; W121-S123 PolarHBondContact O-N 3.25Å; S123-S125 PolarHBondContact O-N 3.02Å; S123-A128 WeakPolarHBondContact OG-CB 3.35Å; S123-E214 WeakPolarHBondContact CA-OE2 3.39Å; S123-E214 VanDerWaalsContact CB-CD 3.48Å; S123-E214 WeakPolarHBondContact CB-OE2 3.44Å; S123-E214 VanDerWaalsContact O-CD 3.25Å; S123-E214 VanDerWaalsContact O-OE1 3.12Å
124N88.1Confident90.1Very high109 Ų10954 Ų5458%0.58325%0.25SC*.THydrogen-bonded Turntrans58.730.6-179.8-160.519.8000113.7T65 W121 A122T65-N124 WeakPolarHBondContact O-CB 3.21Å; T65-N124 PolarHBondContact O-ND2 2.94Å; W121-N124 PolarHBondContact O-N 3.11Å; A122-N124 VanDerWaalsContact C-N 3.32Å
125S87.5Confident89.9Confident26 Ų2648.4 Ų48.418%0.18223%0.228CC..  trans-108.7141.5163.750.50000111.9S123 Y127 A128 L129 E214S123-S125 PolarHBondContact O-N 3.02Å; S125-Y127 VanDerWaalsContact C-N 3.28Å; S125-Y127 PolarHBondContact O-N 3.34Å; S125-A128 PolarHBondContact O-N 3.03Å; S125-A128 VanDerWaalsContact OG-CB 3.25Å; S125-A128 WeakPolarHBondContact OG-CB 3.35Å; S125-L129 PolarHBondContact O-N 3.23Å; S125-E214 WeakPolarHBondContact CB-OE1 3.01Å; S125-E214 PolarHBondContact OG-OE1 3.5Å
126N87.7Confident89.8Confident127 Ų12749.2 Ų49.268%0.67923%0.233SC*.Hα-helixtrans-60.6-38.4-177.8-66.3-19.9000112.1L129 I130N126-L129 PolarHBondContact O-N 3.39Å; N126-I130 WeakPolarHBondContact O-CD1 3.48Å; N126-I130 VanDerWaalsContact O-CG1 3.24Å; N126-I130 WeakPolarHBondContact O-CG1 3.36Å; N126-I130 PolarHBondContact O-N 2.97Å
127Y89.1Confident89.8Confident148 Ų14849.6 Ų49.658%0.5824%0.239SC*.Hα-helixtrans-67.4-41.9178.9-70.5-75.2000112.5S125 L129 I130 G131 L207S125-Y127 VanDerWaalsContact C-N 3.28Å; S125-Y127 PolarHBondContact O-N 3.34Å; Y127-L129 VanDerWaalsContact C-N 3.34Å; Y127-I130 PolarHBondContact O-N 3.48Å; Y127-G131 PolarHBondContact O-N 2.96Å; Y127-L207 HydrophobicContact CD1-CD2 4.1Å
128A87.9Confident89.7Confident0 Ų047.1 Ų47.10%023%0.225CC..Hα-helixtrans-66.8-37.6177.800000112.2S123 S125 G131 A132 G210S123-A128 WeakPolarHBondContact OG-CB 3.35Å; S125-A128 PolarHBondContact O-N 3.03Å; S125-A128 VanDerWaalsContact OG-CB 3.25Å; S125-A128 WeakPolarHBondContact OG-CB 3.35Å; A128-G131 PolarHBondContact O-N 3.4Å; A128-A132 WeakPolarHBondContact O-CB 3.5Å; A128-A132 PolarHBondContact O-N 2.66Å; A128-G210 VanDerWaalsContact CA-O 3.26Å; A128-G210 WeakPolarHBondContact CA-O 3.19Å
129L89.9Confident89.6Confident62 Ų6243.3 Ų43.333%0.32521%0.212SC..Hα-helixtrans-65.1-43.5174.2-173.165000112S125 N126 Y127 A132 L133S125-L129 PolarHBondContact O-N 3.23Å; N126-L129 PolarHBondContact O-N 3.39Å; Y127-L129 VanDerWaalsContact C-N 3.34Å; L129-A132 PolarHBondContact O-N 3.38Å; L129-L133 HydrophobicContact CG-CD1 4.29Å; L129-L133 WeakPolarHBondContact O-CG 3.42Å; L129-L133 PolarHBondContact O-N 3.46Å
130I89.4Confident89.6Confident85 Ų8547.5 Ų47.544%0.43623%0.234SC..Hα-helixtrans-62.7-43176.4-68.6164.6000110.8N126 Y127 L133 R134 L207N126-I130 WeakPolarHBondContact O-CD1 3.48Å; N126-I130 VanDerWaalsContact O-CG1 3.24Å; N126-I130 WeakPolarHBondContact O-CG1 3.36Å; N126-I130 PolarHBondContact O-N 2.97Å; Y127-I130 PolarHBondContact O-N 3.48Å; I130-L133 PolarHBondContact O-N 3.24Å; I130-R134 WeakPolarHBondContact O-CG 3.49Å; I130-R134 PolarHBondContact O-N 3.12Å; I130-L207 HydrophobicContact CB-CD2 4.47Å; I130-L207 HydrophobicContact CG2-CD2 4.09Å
131G88.8Confident89.6Confident0 Ų047.7 Ų47.70%024%0.235CC..Hα-helixtrans-60.6-46.1175.700000112.5Y127 A128 R134 A135Y127-G131 PolarHBondContact O-N 2.96Å; A128-G131 PolarHBondContact O-N 3.4Å; G131-R134 PolarHBondContact O-N 3.43Å; G131-A135 WeakPolarHBondContact O-CB 3.42Å; G131-A135 PolarHBondContact O-N 2.99Å
132A90.9Very high89.5Confident0 Ų040.4 Ų40.40%021%0.207CC..Hα-helixtrans-63.2-43.6177.400000112.4A128 L129 R134 A135 V136 F211A128-A132 WeakPolarHBondContact O-CB 3.5Å; A128-A132 PolarHBondContact O-N 2.66Å; L129-A132 PolarHBondContact O-N 3.38Å; A132-R134 VanDerWaalsContact C-N 3.33Å; A132-R134 PolarHBondContact O-N 3.39Å; A132-A135 PolarHBondContact O-N 3.3Å; A132-V136 WeakPolarHBondContact O-CB 3.37Å; A132-V136 WeakPolarHBondContact O-CG2 3.19Å; A132-V136 PolarHBondContact O-N 3.27Å; A132-F211 HydrophobicContact CB-CB 4.22Å
133L90.9Very high89.7Confident96 Ų9642.3 Ų42.350%0.50322%0.216SC..Hα-helixtrans-63.9-37.5177.7-71.8173000112.5L129 I130 A137L129-L133 HydrophobicContact CG-CD1 4.29Å; L129-L133 WeakPolarHBondContact O-CG 3.42Å; L129-L133 PolarHBondContact O-N 3.46Å; I130-L133 PolarHBondContact O-N 3.24Å; L133-A137 WeakPolarHBondContact O-CB 3.48Å; L133-A137 PolarHBondContact O-N 2.77Å
134R90.4Very high90.1Very high41 Ų4144.9 Ų44.916%0.15523%0.232CC..Hα-helixtrans-65.9-43.8174.1-74.4175.666.21750.3112I130 G131 A132 A137 Q138 E206 Y282I130-R134 WeakPolarHBondContact O-CG 3.49Å; I130-R134 PolarHBondContact O-N 3.12Å; G131-R134 PolarHBondContact O-N 3.43Å; A132-R134 VanDerWaalsContact C-N 3.33Å; A132-R134 PolarHBondContact O-N 3.39Å; R134-A137 PolarHBondContact O-N 3.31Å; R134-Q138 VanDerWaalsContact O-CB 3.32Å; R134-Q138 WeakPolarHBondContact O-CB 3.21Å; R134-Q138 PolarHBondContact O-N 3.05Å; R134-E206 IonicContact CZ-OE2 3.22Å; R134-E206 IonicContact NH1-OE2 2.67Å; R134-E206 PolarHBondContact NH1-OE2 2.94Å; R134-E206 IonicContact NH2-OE2 2.83Å; R134-E206 PolarHBondContact NH2-OE2 3.4Å; R134-Y282 HydrophobicContact CB-CD2 4.46Å; R134-Y282 HydrophobicContact CB-CE2 4.47Å; R134-Y282 HydrophobicContact CG-CD2 4.34Å; R134-Y282 HydrophobicContact CG-CE2 4.45Å
135A88.9Confident90.4Very high0 Ų039.8 Ų39.80%021%0.205CC..Hα-helixtrans-61.2-44.5176.800000111.4I116 G131 A132 Q138 T139 A201I116-A135 HydrophobicContact CG2-CB 3.74Å; G131-A135 WeakPolarHBondContact O-CB 3.42Å; G131-A135 PolarHBondContact O-N 2.99Å; A132-A135 PolarHBondContact O-N 3.3Å; A135-Q138 WeakPolarHBondContact O-CB 3.35Å; A135-Q138 PolarHBondContact O-N 2.79Å; A135-T139 WeakPolarHBondContact O-CG2 3.37Å; A135-T139 PolarHBondContact O-N 3.18Å; A135-T139 PolarHBondContact O-OG1 2.86Å; A135-A201 HydrophobicContact CB-CB 3.62Å
136V91.4Very high90.6Very high23 Ų2338.8 Ų38.814%0.13920%0.197CC..Hα-helixtrans-63.9-44.4177.8172.30000111.5V113 L117 A132 Q138 T139 I140V113-V136 HydrophobicContact CG1-CB 4.14Å; V113-V136 HydrophobicContact CG1-CG1 4Å; V113-V136 HydrophobicContact CG1-CG2 3.73Å; L117-V136 HydrophobicContact CB-CG2 3.93Å; L117-V136 HydrophobicContact CD1-CG2 4.14Å; A132-V136 WeakPolarHBondContact O-CB 3.37Å; A132-V136 WeakPolarHBondContact O-CG2 3.19Å; A132-V136 PolarHBondContact O-N 3.27Å; V136-Q138 VanDerWaalsContact C-N 3.28Å; V136-Q138 PolarHBondContact O-N 2.84Å; V136-T139 PolarHBondContact O-N 3.43Å; V136-T139 PolarHBondContact O-OG1 2.97Å; V136-I140 HydrophobicContact CG1-CD1 3.68Å; V136-I140 HydrophobicContact CG1-CG1 4.43Å; V136-I140 WeakPolarHBondContact O-CD1 3.25Å; V136-I140 VanDerWaalsContact O-CG1 3.25Å; V136-I140 WeakPolarHBondContact O-CG1 3.47Å; V136-I140 PolarHBondContact O-N 3.37Å; V136-I140 VanDerWaalsContact O-N 3.09Å
137A90.7Very high91Very high27 Ų2734.5 Ų34.522%0.22318%0.179CC..Hα-helixtrans-63.3-38.1176.900000111.8L133 R134 S141 Y282L133-A137 WeakPolarHBondContact O-CB 3.48Å; L133-A137 PolarHBondContact O-N 2.77Å; R134-A137 PolarHBondContact O-N 3.31Å; A137-S141 WeakPolarHBondContact O-CB 3.37Å; A137-S141 PolarHBondContact O-N 3.02Å; A137-S141 PolarHBondContact O-OG 2.93Å; A137-Y282 HydrophobicContact CB-CE2 4.17Å; A137-Y282 WeakPolarHBondContact CB-OH 3.25Å
138Q91.1Very high91.3Very high0 Ų028.8 Ų28.80%016%0.158CC..Hα-helixtrans-61-56.4172.7164.1164.5-2.900111.1R134 A135 V136 I140 S141 Y142 A191 N194 F198 L285R134-Q138 VanDerWaalsContact O-CB 3.32Å; R134-Q138 WeakPolarHBondContact O-CB 3.21Å; R134-Q138 PolarHBondContact O-N 3.05Å; A135-Q138 WeakPolarHBondContact O-CB 3.35Å; A135-Q138 PolarHBondContact O-N 2.79Å; V136-Q138 VanDerWaalsContact C-N 3.28Å; V136-Q138 PolarHBondContact O-N 2.84Å; Q138-I140 PolarHBondContact O-N 3.39Å; Q138-S141 PolarHBondContact O-N 3.37Å; Q138-S141 VanDerWaalsContact O-N 3.1Å; Q138-S141 PolarHBondContact O-OG 3.12Å; Q138-Y142 HydrophobicContact CG-CD2 3.83Å; Q138-Y142 HydrophobicContact CG-CE2 3.79Å; Q138-Y142 WeakPolarHBondContact O-CD2 3.18Å; Q138-Y142 PolarHBondContact O-N 3.18Å; Q138-Y142 VanDerWaalsContact O-N 3.12Å; Q138-A191 PolarHBondContact NE2-O 3.27Å; Q138-N194 PolarHBondContact NE2-OD1 3.32Å; Q138-F198 PolarHBondContact NE2-O 2.93Å; Q138-F198 PolarHBondContact OE1-O 3.26Å; Q138-L285 HydrophobicContact CG-CD1 4.4Å
139T90.8Very high91.7Very high9 Ų928.8 Ų28.86%0.05516%0.159CC..Hα-helixtrans-59-46-17654.90000112.2V113 A135 V136 S141 Y142 E143V113-T139 WeakPolarHBondContact CG1-OG1 3.49Å; V113-T139 HydrophobicContact CG2-CG2 4.06Å; V113-T139 VanDerWaalsContact CG2-OG1 3.22Å; V113-T139 WeakPolarHBondContact CG2-OG1 3.49Å; A135-T139 WeakPolarHBondContact O-CG2 3.37Å; A135-T139 PolarHBondContact O-N 3.18Å; A135-T139 PolarHBondContact O-OG1 2.86Å; V136-T139 PolarHBondContact O-N 3.43Å; V136-T139 PolarHBondContact O-OG1 2.97Å; T139-S141 VanDerWaalsContact C-N 3.28Å; T139-S141 PolarHBondContact O-N 3.3Å; T139-Y142 PolarHBondContact O-N 3.15Å; T139-E143 WeakPolarHBondContact O-CB 2.98Å; T139-E143 WeakPolarHBondContact O-CG 3.24Å; T139-E143 PolarHBondContact O-N 3.01Å
140I90.1Very high91.9Very high89 Ų8926.3 Ų26.346%0.45615%0.145SC..Hα-helixtrans-58.9-41.8177.8-64.9166.6000111V136 Q138V136-I140 HydrophobicContact CG1-CD1 3.68Å; V136-I140 HydrophobicContact CG1-CG1 4.43Å; V136-I140 WeakPolarHBondContact O-CD1 3.25Å; V136-I140 VanDerWaalsContact O-CG1 3.25Å; V136-I140 WeakPolarHBondContact O-CG1 3.47Å; V136-I140 PolarHBondContact O-N 3.37Å; V136-I140 VanDerWaalsContact O-N 3.09Å; Q138-I140 PolarHBondContact O-N 3.39Å
141S91.3Very high92.2Very high4 Ų425.9 Ų25.93%0.02814%0.144CC..Hα-helixtrans-67.5-36.3-178.167.10000113.3A137 Q138 T139 L289A137-S141 WeakPolarHBondContact O-CB 3.37Å; A137-S141 PolarHBondContact O-N 3.02Å; A137-S141 PolarHBondContact O-OG 2.93Å; Q138-S141 PolarHBondContact O-N 3.37Å; Q138-S141 VanDerWaalsContact O-N 3.1Å; Q138-S141 PolarHBondContact O-OG 3.12Å; T139-S141 VanDerWaalsContact C-N 3.28Å; T139-S141 PolarHBondContact O-N 3.3Å; S141-L289 WeakPolarHBondContact OG-CD1 3.39Å
142Y89.8Confident92.4Very high2 Ų225.9 Ų25.91%0.00814%0.144CC..Hα-helixtrans-76.9-37.3176-74.1-77000112.6Q138 T139 V144 T145 L146 A191 F198 L285 L289Q138-Y142 HydrophobicContact CG-CD2 3.83Å; Q138-Y142 HydrophobicContact CG-CE2 3.79Å; Q138-Y142 WeakPolarHBondContact O-CD2 3.18Å; Q138-Y142 PolarHBondContact O-N 3.18Å; Q138-Y142 VanDerWaalsContact O-N 3.12Å; T139-Y142 PolarHBondContact O-N 3.15Å; Y142-V144 PolarHBondContact O-N 3.2Å; Y142-T145 PolarHBondContact O-N 3.03Å; Y142-T145 PolarHBondContact O-OG1 3.23Å; Y142-L146 WeakPolarHBondContact O-CB 3.36Å; Y142-L146 PolarHBondContact O-N 3.48Å; Y142-A191 HydrophobicContact CD1-CB 3.63Å; Y142-A191 HydrophobicContact CD2-CB 3.55Å; Y142-A191 HydrophobicContact CE1-CB 3.23Å; Y142-A191 HydrophobicContact CE2-CB 3.19Å; Y142-A191 HydrophobicContact CG-CB 3.78Å; Y142-A191 WeakPolarHBondContact OH-CB 3.45Å; Y142-F198 WeakPolarHBondContact OH-CD1 3.36Å; Y142-L285 HydrophobicContact CE2-CD1 3.8Å; Y142-L285 HydrophobicContact CE2-CD2 3.64Å; Y142-L285 HydrophobicContact CE2-CG 3.87Å; Y142-L285 VanDerWaalsContact OH-CD1 3.31Å; Y142-L285 WeakPolarHBondContact OH-CD1 3.26Å; Y142-L285 WeakPolarHBondContact OH-CG 3.08Å; Y142-L289 HydrophobicContact CD1-CD1 3.52Å; Y142-L289 HydrophobicContact CD1-CD2 3.1Å; Y142-L289 HydrophobicContact CD1-CG 3.7Å; Y142-L289 HydrophobicContact CD2-CD1 3.47Å; Y142-L289 VanDerWaalsContact CD2-CD1 3.47Å; Y142-L289 HydrophobicContact CE1-CD1 3.33Å; Y142-L289 HydrophobicContact CE1-CD2 3.13Å; Y142-L289 HydrophobicContact CE1-CG 3.35Å; Y142-L289 HydrophobicContact CE2-CD1 3.22Å; Y142-L289 HydrophobicContact CE2-CG 4.18Å; Y142-L289 HydrophobicContact CG-CD1 3.58Å; Y142-L289 HydrophobicContact CG-CD2 3.91Å; Y142-L289 HydrophobicContact CG-CG 4.27Å
143E92.9Very high92.5Very high40 Ų4026 Ų2619%0.18714%0.144CC..Hα-helixtrans-54.7-39.2179.1-83.4175.8-157.400112.7S110 V113 T139 T145 L146 A147S110-E143 WeakPolarHBondContact CA-OE1 3.09Å; V113-E143 WeakPolarHBondContact CG2-OE1 3.48Å; T139-E143 WeakPolarHBondContact O-CB 2.98Å; T139-E143 WeakPolarHBondContact O-CG 3.24Å; T139-E143 PolarHBondContact O-N 3.01Å; E143-T145 PolarHBondContact O-N 2.94Å; E143-L146 WeakPolarHBondContact O-CB 3.26Å; E143-L146 PolarHBondContact O-N 3.44Å; E143-A147 WeakPolarHBondContact O-CB 3.33Å; E143-A147 PolarHBondContact O-N 3.06Å
144V94.5Very high92.6Very high55 Ų5521.8 Ų21.833%0.33312%0.122SC..Hα-helixtrans-60.1-48.6176.8177.80000110.7Y142 I148 L294Y142-V144 PolarHBondContact O-N 3.2Å; V144-I148 HydrophobicContact CG1-CD1 4.15Å; V144-I148 WeakPolarHBondContact O-CD1 3.42Å; V144-I148 WeakPolarHBondContact O-CG1 3.48Å; V144-I148 PolarHBondContact O-N 3.4Å; V144-L294 HydrophobicContact CG1-CD1 3.64Å
145T93.6Very high92.7Very high1 Ų122.8 Ų22.81%0.00613%0.13CC..Hα-helixtrans-69.6-37.6178.860.40000112Y142 E143 A147 I148 I149 L289 F293Y142-T145 PolarHBondContact O-N 3.03Å; Y142-T145 PolarHBondContact O-OG1 3.23Å; E143-T145 PolarHBondContact O-N 2.94Å; T145-A147 PolarHBondContact O-N 3.27Å; T145-I148 PolarHBondContact O-N 2.93Å; T145-I149 WeakPolarHBondContact O-CB 3.26Å; T145-I149 WeakPolarHBondContact O-CD1 3.44Å; T145-I149 WeakPolarHBondContact O-CG1 3.25Å; T145-I149 PolarHBondContact O-N 3.39Å; T145-L289 HydrophobicContact CG2-CD2 4.01Å; T145-F293 HydrophobicContact CG2-CB 4.1Å
146L93.3Very high92.8Very high6 Ų625 Ų253%0.03114%0.142CC..Hα-helixtrans-58-48.1176.9-163.983.1000110.7Y142 E143 I148 I149 L150 W185 T189 E192Y142-L146 WeakPolarHBondContact O-CB 3.36Å; Y142-L146 PolarHBondContact O-N 3.48Å; E143-L146 WeakPolarHBondContact O-CB 3.26Å; E143-L146 PolarHBondContact O-N 3.44Å; L146-I148 PolarHBondContact O-N 3.16Å; L146-I149 PolarHBondContact O-N 3.47Å; L146-L150 HydrophobicContact CD2-CD1 4.46Å; L146-L150 HydrophobicContact CG-CD1 4.11Å; L146-L150 WeakPolarHBondContact O-CB 3.34Å; L146-L150 WeakPolarHBondContact O-CD1 3.35Å; L146-L150 VanDerWaalsContact O-CG 3.3Å; L146-L150 WeakPolarHBondContact O-CG 3.32Å; L146-L150 PolarHBondContact O-N 3.47Å; L146-W185 HydrophobicContact CB-CZ3 4.5Å; L146-W185 HydrophobicContact CD1-CE3 3.77Å; L146-W185 HydrophobicContact CD1-CH2 3.34Å; L146-W185 HydrophobicContact CD1-CZ2 4.13Å; L146-W185 HydrophobicContact CD1-CZ3 3.13Å; L146-W185 HydrophobicContact CD2-CH2 4.38Å; L146-W185 HydrophobicContact CD2-CZ3 4.5Å; L146-W185 HydrophobicContact CG-CE3 4.41Å; L146-W185 HydrophobicContact CG-CH2 3.78Å; L146-W185 HydrophobicContact CG-CZ3 3.46Å; L146-W185 VanDerWaalsContact CG-CZ3 3.46Å; L146-T189 HydrophobicContact CD1-CG2 4.28Å; L146-E192 WeakPolarHBondContact CD2-OE2 3.18Å
147A95.2Very high92.9Very high36 Ų3624.2 Ų24.230%0.29814%0.137SC..Hα-helixtrans-61.5-44.1179.300000112.4L106 E143 T145 L150 L151L106-A147 HydrophobicContact CD1-CB 3.76Å; E143-A147 WeakPolarHBondContact O-CB 3.33Å; E143-A147 PolarHBondContact O-N 3.06Å; T145-A147 PolarHBondContact O-N 3.27Å; A147-L150 PolarHBondContact O-N 2.87Å; A147-L151 WeakPolarHBondContact O-CB 3.07Å; A147-L151 PolarHBondContact O-N 2.95Å
148I95.4Very high92.9Very high28 Ų2824.3 Ų24.314%0.14414%0.14CC..Hα-helixtrans-69.6-40.5-179.7-61.9164.9000110.8V144 T145 L146 L151 S152 L294 L298 L301V144-I148 HydrophobicContact CG1-CD1 4.15Å; V144-I148 WeakPolarHBondContact O-CD1 3.42Å; V144-I148 WeakPolarHBondContact O-CG1 3.48Å; V144-I148 PolarHBondContact O-N 3.4Å; T145-I148 PolarHBondContact O-N 2.93Å; L146-I148 PolarHBondContact O-N 3.16Å; I148-L151 PolarHBondContact O-N 3.25Å; I148-S152 PolarHBondContact O-N 2.86Å; I148-S152 PolarHBondContact O-OG 2.84Å; I148-S152 VanDerWaalsContact O-OG 3.04Å; I148-L294 HydrophobicContact CD1-CD1 4.42Å; I148-L298 HydrophobicContact CD1-CD2 4.17Å; I148-L301 HydrophobicContact CG2-CB 4.12Å; I148-L301 HydrophobicContact CG2-CD1 4.4Å; I148-L301 HydrophobicContact CG2-CD2 4.33Å
149I95.9Very high93Very high1 Ų125 Ų251%0.00515%0.146CC..Hα-helixtrans-63.2-46.8175.7-66.2162.6000110.1T145 L146 L151 S152 T153 L181 M184 W185 T297T145-I149 WeakPolarHBondContact O-CB 3.26Å; T145-I149 WeakPolarHBondContact O-CD1 3.44Å; T145-I149 WeakPolarHBondContact O-CG1 3.25Å; T145-I149 PolarHBondContact O-N 3.39Å; L146-I149 PolarHBondContact O-N 3.47Å; I149-L151 PolarHBondContact O-N 3.09Å; I149-S152 WeakPolarHBondContact CA-OG 3.25Å; I149-S152 PolarHBondContact O-N 3.27Å; I149-S152 PolarHBondContact O-OG 3.31Å; I149-T153 WeakPolarHBondContact O-CG2 3.37Å; I149-T153 PolarHBondContact O-N 2.77Å; I149-T153 PolarHBondContact O-OG1 2.66Å; I149-L181 HydrophobicContact CG1-CD2 4.19Å; I149-L181 HydrophobicContact CG2-CB 4.1Å; I149-L181 HydrophobicContact CG2-CD2 4.21Å; I149-M184 HydrophobicContact CD1-CB 3.84Å; I149-W185 HydrophobicContact CB-CE3 4.28Å; I149-W185 HydrophobicContact CG2-CB 3.98Å; I149-W185 HydrophobicContact CG2-CE3 3.86Å; I149-T297 HydrophobicContact CD1-CG2 3.85Å; I149-T297 HydrophobicContact CG1-CG2 3.51Å
150L94.7Very high93.1Very high9 Ų928 Ų285%0.04716%0.158CC..Hα-helixtrans-58.8-48.7176.1-75.4160000111.3L102 L106 L146 A147 S152 T153 L154 W185 I241L102-L150 HydrophobicContact CD1-CD2 3.62Å; L102-L150 HydrophobicContact CD2-CB 3.92Å; L102-L150 HydrophobicContact CD2-CD1 3.95Å; L102-L150 HydrophobicContact CD2-CD2 3.97Å; L102-L150 HydrophobicContact CD2-CG 4.13Å; L102-L150 HydrophobicContact CG-CD2 4.07Å; L106-L150 HydrophobicContact CD1-CD1 3.82Å; L146-L150 HydrophobicContact CD2-CD1 4.46Å; L146-L150 HydrophobicContact CG-CD1 4.11Å; L146-L150 WeakPolarHBondContact O-CB 3.34Å; L146-L150 WeakPolarHBondContact O-CD1 3.35Å; L146-L150 VanDerWaalsContact O-CG 3.3Å; L146-L150 WeakPolarHBondContact O-CG 3.32Å; L146-L150 PolarHBondContact O-N 3.47Å; A147-L150 PolarHBondContact O-N 2.87Å; L150-S152 VanDerWaalsContact C-N 3.31Å; L150-S152 PolarHBondContact O-N 3.12Å; L150-T153 PolarHBondContact O-N 3.4Å; L150-T153 PolarHBondContact O-OG1 3.37Å; L150-L154 WeakPolarHBondContact O-CB 3.41Å; L150-L154 VanDerWaalsContact O-CG 3.27Å; L150-L154 WeakPolarHBondContact O-CG 3.47Å; L150-L154 PolarHBondContact O-N 2.61Å; L150-W185 HydrophobicContact CD1-CH2 3.81Å; L150-W185 HydrophobicContact CD1-CZ3 3.59Å; L150-W185 HydrophobicContact CD2-CE3 4.34Å; L150-W185 HydrophobicContact CD2-CH2 3.71Å; L150-W185 HydrophobicContact CD2-CZ3 3.56Å; L150-W185 HydrophobicContact CG-CE3 4.2Å; L150-W185 HydrophobicContact CG-CH2 3.87Å; L150-W185 HydrophobicContact CG-CZ3 3.34Å; L150-I241 HydrophobicContact CD2-CD1 3.39Å
151L94.9Very high93.3Very high77 Ų7724.8 Ų24.840%0.40314%0.142SC..Hα-helixtrans-56.2-46.4178.5-176.564.5000111.6A147 I148 I149 T153 L154 L155 L301A147-L151 WeakPolarHBondContact O-CB 3.07Å; A147-L151 PolarHBondContact O-N 2.95Å; I148-L151 PolarHBondContact O-N 3.25Å; I149-L151 PolarHBondContact O-N 3.09Å; L151-T153 PolarHBondContact O-N 2.92Å; L151-L154 PolarHBondContact O-N 3.43Å; L151-L155 WeakPolarHBondContact O-CG 3.49Å; L151-L155 PolarHBondContact O-N 3.08Å; L151-L155 VanDerWaalsContact O-N 3.16Å; L151-L301 HydrophobicContact CB-CD1 4.36Å; L151-L301 HydrophobicContact CD2-CD1 3.88Å; L151-L301 HydrophobicContact CG-CD1 4.03Å
152S94.4Very high93.3Very high0 Ų024.7 Ų24.70%014%0.141CC..Hα-helixtrans-65-38179.355.60000113.4I148 I149 L150 L181I148-S152 PolarHBondContact O-N 2.86Å; I148-S152 PolarHBondContact O-OG 2.84Å; I148-S152 VanDerWaalsContact O-OG 3.04Å; I149-S152 WeakPolarHBondContact CA-OG 3.25Å; I149-S152 PolarHBondContact O-N 3.27Å; I149-S152 PolarHBondContact O-OG 3.31Å; L150-S152 VanDerWaalsContact C-N 3.31Å; L150-S152 PolarHBondContact O-N 3.12Å; S152-L181 WeakPolarHBondContact OG-CD1 3.44Å; S152-L181 WeakPolarHBondContact OG-CD2 3.08Å
153T92.8Very high93.5Very high1 Ų126.1 Ų26.11%0.00615%0.151CC..Hα-helixtrans-67.4-36.8172.859.20000112.5I149 L150 L151 L155 M156 L174 L181 I241 F242I149-T153 WeakPolarHBondContact O-CG2 3.37Å; I149-T153 PolarHBondContact O-N 2.77Å; I149-T153 PolarHBondContact O-OG1 2.66Å; L150-T153 PolarHBondContact O-N 3.4Å; L150-T153 PolarHBondContact O-OG1 3.37Å; L151-T153 PolarHBondContact O-N 2.92Å; T153-L155 VanDerWaalsContact C-N 3.32Å; T153-L155 PolarHBondContact O-N 3.23Å; T153-M156 WeakPolarHBondContact O-CB 3.24Å; T153-M156 PolarHBondContact O-N 3.28Å; T153-M156 VanDerWaalsContact O-N 3.16Å; T153-L174 HydrophobicContact CG2-CD2 4.38Å; T153-L181 HydrophobicContact CG2-CB 4.45Å; T153-L181 HydrophobicContact CG2-CD1 4.02Å; T153-I241 HydrophobicContact CG2-CG2 4.28Å; T153-F242 HydrophobicContact CG2-CE1 3.66Å; T153-F242 HydrophobicContact CG2-CZ 3.65Å
154L92.5Very high93.4Very high9 Ų925.5 Ų25.55%0.04715%0.15CC..Hα-helixtrans-69.4-27.9-178.4-76.3-179.3000113.6L102 L150 L151 M156 S157 G158 S159 F160 L165L102-L154 HydrophobicContact CB-CD1 4.5Å; L102-L154 HydrophobicContact CD1-CD1 3.8Å; L102-L154 HydrophobicContact CD1-CD2 3.83Å; L102-L154 HydrophobicContact CD1-CG 3.98Å; L102-L154 HydrophobicContact CD2-CD1 3.84Å; L102-L154 HydrophobicContact CG-CD1 4.25Å; L150-L154 WeakPolarHBondContact O-CB 3.41Å; L150-L154 VanDerWaalsContact O-CG 3.27Å; L150-L154 WeakPolarHBondContact O-CG 3.47Å; L150-L154 PolarHBondContact O-N 2.61Å; L151-L154 PolarHBondContact O-N 3.43Å; L154-M156 PolarHBondContact O-N 2.79Å; L154-M156 VanDerWaalsContact O-N 3.14Å; L154-S157 WeakPolarHBondContact CA-OG 3.44Å; L154-S157 WeakPolarHBondContact CD2-OG 3.2Å; L154-S157 WeakPolarHBondContact O-CA 3.25Å; L154-S157 PolarHBondContact O-N 3.16Å; L154-S157 PolarHBondContact O-OG 3.35Å; L154-G158 PolarHBondContact O-N 3.19Å; L154-S159 WeakPolarHBondContact CD2-O 3.39Å; L154-F160 HydrophobicContact CD1-CD1 3.31Å; L154-F160 HydrophobicContact CD1-CE1 3.47Å; L154-F160 VanDerWaalsContact CD1-CE1 3.47Å; L154-F160 HydrophobicContact CD1-CG 4.28Å; L154-L165 HydrophobicContact CD2-CD1 4.37Å
155L93.3Very high93.4Very high61 Ų6123 Ų2332%0.31913%0.134SC..THydrogen-bonded Turntrans-58.8-23.4172.8-70.1171000112.9L151 T153 L301 V305 P315L151-L155 WeakPolarHBondContact O-CG 3.49Å; L151-L155 PolarHBondContact O-N 3.08Å; L151-L155 VanDerWaalsContact O-N 3.16Å; T153-L155 VanDerWaalsContact C-N 3.32Å; T153-L155 PolarHBondContact O-N 3.23Å; L155-L301 HydrophobicContact CD1-CD1 4.44Å; L155-V305 HydrophobicContact CD1-CB 4.38Å; L155-V305 HydrophobicContact CD1-CG2 3.47Å; L155-V305 VanDerWaalsContact CD1-CG2 3.47Å; L155-P315 WeakPolarHBondContact O-CD 3.45Å; L155-P315 VanDerWaalsContact O-CG 3.25Å; L155-P315 WeakPolarHBondContact O-CG 3.48Å
156M90.9Very high93.4Very high48 Ų4823.4 Ų23.424%0.23614%0.137CC..THydrogen-bonded Turntrans-82.5-21.7173.2-60.2-170.161.500113.3T153 L154 L174 P177 Y304 P315T153-M156 WeakPolarHBondContact O-CB 3.24Å; T153-M156 PolarHBondContact O-N 3.28Å; T153-M156 VanDerWaalsContact O-N 3.16Å; L154-M156 PolarHBondContact O-N 2.79Å; L154-M156 VanDerWaalsContact O-N 3.14Å; M156-L174 HydrophobicContact CB-CD1 3.92Å; M156-L174 HydrophobicContact CE-CD1 3.77Å; M156-L174 HydrophobicContact CG-CD1 4.41Å; M156-L174 HydrophobicContact SD-CD1 3.71Å; M156-P177 HydrophobicContact CE-CB 3.8Å; M156-P177 HydrophobicContact CE-CG 3.62Å; M156-P177 HydrophobicContact SD-CB 4.4Å; M156-P177 HydrophobicContact SD-CG 4.29Å; M156-Y304 HydrophobicContact CG-CD1 4.17Å; M156-Y304 HydrophobicContact SD-CD1 3.95Å; M156-Y304 HydrophobicContact SD-CE1 3.76Å; M156-P315 WeakPolarHBondContact O-CB 3.31Å
157S92.1Very high93.3Very high5 Ų527 Ų274%0.03516%0.159CC..THydrogen-bonded Turntrans-94.7-29.5-179.468.40000114.3L154 S159L154-S157 WeakPolarHBondContact CA-OG 3.44Å; L154-S157 WeakPolarHBondContact CD2-OG 3.2Å; L154-S157 WeakPolarHBondContact O-CA 3.25Å; L154-S157 PolarHBondContact O-N 3.16Å; L154-S157 PolarHBondContact O-OG 3.35Å; S157-S159 VanDerWaalsContact C-N 3.3Å; S157-S159 PolarHBondContact O-N 2.86Å; S157-S159 PolarHBondContact OG-O 3.21Å
158G90.8Very high93.2Very high29 Ų2927.7 Ų27.730%0.29916%0.159SC..SBendtrans84.3-13.6179.200000115.8L154 P315L154-G158 PolarHBondContact O-N 3.19Å; G158-P315 VanDerWaalsContact N-CG 3.35Å
159S93.1Very high93.1Very high16 Ų1626.4 Ų26.411%0.11215%0.153CC..SBendtrans-139.3160.3-178.5105.90000112.7L154 S157 N161 T164L154-S159 WeakPolarHBondContact CD2-O 3.39Å; S157-S159 VanDerWaalsContact C-N 3.3Å; S157-S159 PolarHBondContact O-N 2.86Å; S157-S159 PolarHBondContact OG-O 3.21Å; S159-N161 VanDerWaalsContact C-N 3.34Å; S159-N161 PolarHBondContact OG-N 2.83Å; S159-N161 VanDerWaalsContact OG-N 3.13Å; S159-T164 WeakPolarHBondContact OG-CG2 3.33Å; S159-T164 PolarHBondContact OG-OG1 2.82Å
160F93.1Very high92.9Very high71 Ų7130.7 Ų30.731%0.31117%0.173SC..SBendtrans-89.51.8175.4-69-84.8000113.5N99 L100 G101 L102 L103 L154N99-F160 CarbonylContact O-C 3.59Å; N99-F160 VanDerWaalsContact O-C 3.31Å; L100-F160 HydrophobicContact CD2-CB 3.9Å; L100-F160 HydrophobicContact CD2-CD2 3.95Å; L100-F160 HydrophobicContact CD2-CG 4.14Å; G101-F160 PolarHBondContact N-O 2.87Å; L102-F160 PolarHBondContact N-O 3.36Å; L102-F160 VanDerWaalsContact N-O 3.16Å; L103-F160 HydrophobicContact CD1-CD1 4.13Å; L103-F160 HydrophobicContact CD1-CE1 4.28Å; L103-F160 HydrophobicContact CD1-CG 4.32Å; L103-F160 HydrophobicContact CD2-CD1 4.35Å; L103-F160 HydrophobicContact CD2-CE1 4.18Å; L103-F160 HydrophobicContact CG-CD1 3.82Å; L103-F160 HydrophobicContact CG-CE1 4.1Å; L103-F160 HydrophobicContact CG-CG 4.38Å; L154-F160 HydrophobicContact CD1-CD1 3.31Å; L154-F160 HydrophobicContact CD1-CE1 3.47Å; L154-F160 VanDerWaalsContact CD1-CE1 3.47Å; L154-F160 HydrophobicContact CD1-CG 4.28Å
161N94.4Very high92.6Very high22 Ų2238.7 Ų38.712%0.11821%0.21CC..  trans-83.1123.1-178.2-173.1-16.1000110.1N97 N99 S159 S163 T164N97-N161 PolarHBondContact OD1-ND2 3.41Å; N97-N161 VanDerWaalsContact OD1-ND2 3.09Å; N97-N161 PolarHBondContact OD1-OD1 3.19Å; N99-N161 PolarHBondContact O-N 3.48Å; S159-N161 VanDerWaalsContact C-N 3.34Å; S159-N161 PolarHBondContact OG-N 2.83Å; S159-N161 VanDerWaalsContact OG-N 3.13Å; N161-S163 PolarHBondContact ND2-OG 3.29Å; N161-S163 VanDerWaalsContact ND2-OG 3.16Å; N161-S163 PolarHBondContact O-N 3.12Å; N161-S163 PolarHBondContact OD1-N 3.28Å; N161-S163 PolarHBondContact OD1-OG 3.32Å; N161-T164 HydrophobicContact CB-CG2 4.05Å; N161-T164 PolarHBondContact O-N 3.02Å; N161-T164 PolarHBondContact O-OG1 3.48Å
162L92.6Very high92.6Very high1 Ų140.7 Ų40.71%0.00522%0.22CC..THydrogen-bonded Turntrans-62.2-27.1-179.1-67.9166.9000113.2P88 L89 P90 L102 I105 T164 L165P88-L162 HydrophobicContact CB-CD1 4.14Å; P88-L162 HydrophobicContact CG-CD1 4.39Å; P88-L162 WeakPolarHBondContact O-CD1 3.32Å; L89-L162 HydrophobicContact CD2-CD1 4.4Å; P90-L162 HydrophobicContact CG-CB 3.9Å; L102-L162 HydrophobicContact CB-CD2 4.34Å; L102-L162 HydrophobicContact CD1-CD2 4.35Å; I105-L162 HydrophobicContact CD1-CD1 3.68Å; L162-T164 VanDerWaalsContact C-N 3.32Å; L162-T164 PolarHBondContact O-N 3.16Å; L162-L165 HydrophobicContact CD2-CD1 3.98Å; L162-L165 WeakPolarHBondContact O-CB 3.05Å; L162-L165 PolarHBondContact O-N 2.91Å
163S92.6Very high92.6Very high32 Ų3246.5 Ų46.522%0.22424%0.242CC..THydrogen-bonded Turntrans-67.4-32.3175.558.60000112.8N161 L165 I166N161-S163 PolarHBondContact ND2-OG 3.29Å; N161-S163 VanDerWaalsContact ND2-OG 3.16Å; N161-S163 PolarHBondContact O-N 3.12Å; N161-S163 PolarHBondContact OD1-N 3.28Å; N161-S163 PolarHBondContact OD1-OG 3.32Å; S163-L165 PolarHBondContact O-N 3.15Å; S163-I166 WeakPolarHBondContact O-CB 2.89Å; S163-I166 PolarHBondContact O-N 3.37Å; S163-I166 VanDerWaalsContact O-N 3.14Å
164T92.6Very high92.7Very high28 Ų2846.9 Ų46.917%0.17224%0.244CC..Hα-helixtrans-70.3-22.1175.6680000112.6S159 N161 L162 I166 T167 T168S159-T164 WeakPolarHBondContact OG-CG2 3.33Å; S159-T164 PolarHBondContact OG-OG1 2.82Å; N161-T164 HydrophobicContact CB-CG2 4.05Å; N161-T164 PolarHBondContact O-N 3.02Å; N161-T164 PolarHBondContact O-OG1 3.48Å; L162-T164 VanDerWaalsContact C-N 3.32Å; L162-T164 PolarHBondContact O-N 3.16Å; T164-I166 PolarHBondContact O-N 2.92Å; T164-T167 PolarHBondContact O-N 3.34Å; T164-T167 PolarHBondContact O-OG1 2.96Å; T164-T168 WeakPolarHBondContact O-CG2 3.06Å; T164-T168 PolarHBondContact O-N 3.43Å; T164-T168 PolarHBondContact O-OG1 3.35Å
165L93.4Very high92.8Very high1 Ų149.3 Ų49.31%0.00526%0.257CS..Hα-helixtrans-67.4-20.7172.8-80.5164.3000112.7L154 L162 S163 T168 Q169 I241L154-L165 HydrophobicContact CD2-CD1 4.37Å; L162-L165 HydrophobicContact CD2-CD1 3.98Å; L162-L165 WeakPolarHBondContact O-CB 3.05Å; L162-L165 PolarHBondContact O-N 2.91Å; S163-L165 PolarHBondContact O-N 3.15Å; L165-T168 WeakPolarHBondContact CA-OG1 3.17Å; L165-T168 PolarHBondContact O-OG1 3.44Å; L165-T168 VanDerWaalsContact O-OG1 3.09Å; L165-Q169 WeakPolarHBondContact O-CG 3.08Å; L165-Q169 PolarHBondContact O-NE2 3.49Å; L165-I241 HydrophobicContact CD1-CG1 4.21Å
166I93.3Very high92.8Very high11 Ų1151.4 Ų51.46%0.05627%0.268CS..Hα-helixtrans-72.6-47.6173.6-61173.4000109.5P90 S163 T164 T168 Q169 Y255P90-I166 HydrophobicContact CB-CD1 3.83Å; P90-I166 HydrophobicContact CG-CD1 4.11Å; S163-I166 WeakPolarHBondContact O-CB 2.89Å; S163-I166 PolarHBondContact O-N 3.37Å; S163-I166 VanDerWaalsContact O-N 3.14Å; T164-I166 PolarHBondContact O-N 2.92Å; I166-T168 VanDerWaalsContact C-N 3.34Å; I166-T168 PolarHBondContact O-N 2.93Å; I166-Q169 PolarHBondContact O-N 3.02Å; I166-Y255 HydrophobicContact CD1-CE1 4.45Å; I166-Y255 HydrophobicContact CD1-CE2 3.92Å; I166-Y255 VanDerWaalsContact CD1-OH 3.24Å; I166-Y255 WeakPolarHBondContact CD1-OH 3.35Å; I166-Y255 HydrophobicContact CG1-CE2 4.14Å; I166-Y255 WeakPolarHBondContact CG1-OH 3.47Å; I166-Y255 HydrophobicContact CG2-CE2 3.76Å
167T91.8Very high92.9Very high80 Ų8051.8 Ų51.849%0.49127%0.274SS..Hα-helixtrans-67.5-35.7-178.958.10000111.7T164 Q169 E170T164-T167 PolarHBondContact O-N 3.34Å; T164-T167 PolarHBondContact O-OG1 2.96Å; T167-Q169 PolarHBondContact O-N 3.31Å; T167-E170 WeakPolarHBondContact O-CG 3.44Å; T167-E170 PolarHBondContact O-N 3.25Å
168T92.9Very high93Very high51 Ų5151.6 Ų51.631%0.31327%0.272SS..Hα-helixtrans-66.5-23.9177.762.40000113.2T164 L165 I166T164-T168 WeakPolarHBondContact O-CG2 3.06Å; T164-T168 PolarHBondContact O-N 3.43Å; T164-T168 PolarHBondContact O-OG1 3.35Å; L165-T168 WeakPolarHBondContact CA-OG1 3.17Å; L165-T168 PolarHBondContact O-OG1 3.44Å; L165-T168 VanDerWaalsContact O-OG1 3.09Å; I166-T168 VanDerWaalsContact C-N 3.34Å; I166-T168 PolarHBondContact O-N 2.93Å
169Q93.3Very high93.2Very high2 Ų258.4 Ų58.41%0.00929%0.289CS..THydrogen-bonded Turntrans-101.212.3-177.2-68.1177.16600113.6L165 I166 T167 H171 L172 L174 T240 I241 F242L165-Q169 WeakPolarHBondContact O-CG 3.08Å; L165-Q169 PolarHBondContact O-NE2 3.49Å; I166-Q169 PolarHBondContact O-N 3.02Å; T167-Q169 PolarHBondContact O-N 3.31Å; Q169-H171 PolarHBondContact O-N 3.09Å; Q169-L172 WeakPolarHBondContact CA-O 3.34Å; Q169-L174 HydrophobicContact CG-CB 4.04Å; Q169-T240 PolarHBondContact NE2-O 3.16Å; Q169-I241 PolarHBondContact NE2-O 3.03Å; Q169-F242 VanDerWaalsContact OE1-C 3.3Å; Q169-F242 PolarHBondContact OE1-O 3.24Å
170E90.9Very high93.4Very high90 Ų9059 Ų5942%0.42129%0.292SS..SBendtrans-61.1-42.2179.9-78.6178.7-169.600112.8T167T167-E170 WeakPolarHBondContact O-CG 3.44Å; T167-E170 PolarHBondContact O-N 3.25Å
171H90Very high93.5Very high178 Ų17855.6 Ų55.682%0.82428%0.278SS*.SBendtrans-89.8-43.3-177-62.9-46.2000113.3Q169Q169-H171 PolarHBondContact O-N 3.09Å
172L93.2Very high93.5Very high118 Ų11855 Ų5562%0.61828%0.276SS*.SBendtrans-141.2138.4-176.6-71.5172.5000109.4Q169 L176Q169-L172 WeakPolarHBondContact CA-O 3.34Å; L172-L176 HydrophobicContact CD2-CD1 4.31Å
173W95Very high93.6Very high122 Ų12260.1 Ų60.146%0.46230%0.301SS..  trans-64.8137.3172.1-61.8-25.2000110.7L175 L176 P177 L243 G244W173-L175 PolarHBondContact O-N 3.25Å; W173-L175 VanDerWaalsContact O-N 3.12Å; W173-L176 PolarHBondContact O-N 2.64Å; W173-L176 VanDerWaalsContact O-N 3.11Å; W173-P177 VanDerWaalsContact O-CD 3.25Å; W173-P177 WeakPolarHBondContact O-CD 3.5Å; W173-L243 HydrophobicContact CD2-CD2 4.35Å; W173-L243 HydrophobicContact CE3-CD2 4.1Å; W173-G244 PolarHBondContact NE1-O 3.06Å
174L94.8Very high93.8Very high10 Ų1059 Ų595%0.05229%0.292CS..THydrogen-bonded Turntrans-63.9-21.3179.7-159.271.7000111.8T153 M156 Q169 L176 P177 S178 I241 F242T153-L174 HydrophobicContact CG2-CD2 4.38Å; M156-L174 HydrophobicContact CB-CD1 3.92Å; M156-L174 HydrophobicContact CE-CD1 3.77Å; M156-L174 HydrophobicContact CG-CD1 4.41Å; M156-L174 HydrophobicContact SD-CD1 3.71Å; Q169-L174 HydrophobicContact CG-CB 4.04Å; L174-L176 PolarHBondContact O-N 3.39Å; L174-P177 HydrophobicContact CD1-CG 4.4Å; L174-P177 VanDerWaalsContact O-CD 3.25Å; L174-P177 WeakPolarHBondContact O-CD 3.32Å; L174-P177 WeakPolarHBondContact O-CG 3.49Å; L174-S178 WeakPolarHBondContact O-CB 3.46Å; L174-S178 PolarHBondContact O-N 3.07Å; L174-S178 VanDerWaalsContact O-N 3.11Å; L174-S178 PolarHBondContact O-OG 3.42Å; L174-I241 WeakPolarHBondContact CB-O 3.28Å; L174-I241 HydrophobicContact CD2-CG2 4.31Å; L174-I241 VanDerWaalsContact CD2-O 3.26Å; L174-I241 WeakPolarHBondContact CD2-O 3.26Å; L174-F242 PolarHBondContact N-O 3.09Å
175L94.8Very high94Very high60 Ų6057.9 Ų57.931%0.31429%0.285SS..THydrogen-bonded Turntrans-54.5-35.8172.8-172.1137.3000113.3W173 S178 W179 A182 F242 L243W173-L175 PolarHBondContact O-N 3.25Å; W173-L175 VanDerWaalsContact O-N 3.12Å; L175-S178 CarbonylContact O-C 3.39Å; L175-W179 WeakPolarHBondContact O-CA 3.36Å; L175-W179 VanDerWaalsContact O-CB 3.26Å; L175-W179 WeakPolarHBondContact O-CB 3.34Å; L175-W179 PolarHBondContact O-N 3.44Å; L175-A182 HydrophobicContact CD1-CB 4.35Å; L175-A182 HydrophobicContact CG-CB 4.27Å; L175-F242 HydrophobicContact CB-CB 4.13Å; L175-F242 WeakPolarHBondContact CB-O 3.36Å; L175-F242 HydrophobicContact CD1-CB 4.49Å; L175-F242 PolarHBondContact N-O 2.88Å; L175-L243 HydrophobicContact CB-CD2 4.17Å; L175-L243 HydrophobicContact CD1-CD2 3.92Å; L175-L243 HydrophobicContact CD1-CG 4.26Å
176L93.6Very high94.1Very high105 Ų10559.1 Ų59.155%0.5529%0.291SS..THydrogen-bonded Turntrans-69.3-55.7-176.6-68.8171.6000113L172 W173 L174 S178L172-L176 HydrophobicContact CD2-CD1 4.31Å; W173-L176 PolarHBondContact O-N 2.64Å; W173-L176 VanDerWaalsContact O-N 3.11Å; L174-L176 PolarHBondContact O-N 3.39Å; L176-S178 PolarHBondContact O-N 3.01Å
177P92.7Very high94.1Very high56 Ų5660.4 Ų60.436%0.36430%0.297SS..THydrogen-bonded Turntrans-71.3-19.8177.729.2-36.5000113.1M156 W173 L174 Y304M156-P177 HydrophobicContact CE-CB 3.8Å; M156-P177 HydrophobicContact CE-CG 3.62Å; M156-P177 HydrophobicContact SD-CB 4.4Å; M156-P177 HydrophobicContact SD-CG 4.29Å; W173-P177 VanDerWaalsContact O-CD 3.25Å; W173-P177 WeakPolarHBondContact O-CD 3.5Å; L174-P177 HydrophobicContact CD1-CG 4.4Å; L174-P177 VanDerWaalsContact O-CD 3.25Å; L174-P177 WeakPolarHBondContact O-CD 3.32Å; L174-P177 WeakPolarHBondContact O-CG 3.49Å; P177-Y304 PolarHBondContact O-OH 3.25Å
178S94.8Very high94.2Very high0 Ų056.6 Ų56.60%027%0.273CS..THydrogen-bonded Turntrans-12029-176.774.10000115L174 L175 L176 P180 L181 A182 F242 Y304L174-S178 WeakPolarHBondContact O-CB 3.46Å; L174-S178 PolarHBondContact O-N 3.07Å; L174-S178 VanDerWaalsContact O-N 3.11Å; L174-S178 PolarHBondContact O-OG 3.42Å; L175-S178 CarbonylContact O-C 3.39Å; L176-S178 PolarHBondContact O-N 3.01Å; S178-P180 VanDerWaalsContact C-N 3.33Å; S178-P180 VanDerWaalsContact O-N 3.17Å; S178-L181 CarbonylContact O-C 3.42Å; S178-L181 WeakPolarHBondContact O-CA 3.33Å; S178-L181 WeakPolarHBondContact O-CB 3.26Å; S178-L181 PolarHBondContact O-N 3.02Å; S178-A182 PolarHBondContact O-N 2.95Å; S178-F242 VanDerWaalsContact OG-CE1 3.31Å; S178-F242 WeakPolarHBondContact OG-CE1 3.09Å; S178-Y304 VanDerWaalsContact CA-OH 3.26Å; S178-Y304 WeakPolarHBondContact CA-OH 2.99Å
179W95.1Very high94.2Very high172 Ų17254.1 Ų54.165%0.65226%0.259SS*.Hα-helixtrans-54.4-36.7-17778-95.5000114.9L175 A182 M183L175-W179 WeakPolarHBondContact O-CA 3.36Å; L175-W179 VanDerWaalsContact O-CB 3.26Å; L175-W179 WeakPolarHBondContact O-CB 3.34Å; L175-W179 PolarHBondContact O-N 3.44Å; W179-A182 PolarHBondContact O-N 3.5Å; W179-M183 PolarHBondContact O-N 3.28Å
180P95.5Very high94.2Very high28 Ų2854.3 Ų54.318%0.18226%0.26CS..Hα-helixtrans-68.6-38.6177.3-16.632000111.4S178 M183 M184 L300S178-P180 VanDerWaalsContact C-N 3.33Å; S178-P180 VanDerWaalsContact O-N 3.17Å; P180-M183 PolarHBondContact O-N 2.87Å; P180-M184 WeakPolarHBondContact O-CG 3.19Å; P180-M184 PolarHBondContact O-N 2.97Å; P180-M184 VanDerWaalsContact O-N 3.11Å; P180-L300 HydrophobicContact CB-CD1 3.97Å
181L95.6Very high94.2Very high0 Ų050 Ų500%024%0.24CC..Hα-helixtrans-65.2-44.2174-69.2178.2000110.7I149 S152 T153 S178 M183 M184 W185 L300 Y304I149-L181 HydrophobicContact CG1-CD2 4.19Å; I149-L181 HydrophobicContact CG2-CB 4.1Å; I149-L181 HydrophobicContact CG2-CD2 4.21Å; S152-L181 WeakPolarHBondContact OG-CD1 3.44Å; S152-L181 WeakPolarHBondContact OG-CD2 3.08Å; T153-L181 HydrophobicContact CG2-CB 4.45Å; T153-L181 HydrophobicContact CG2-CD1 4.02Å; S178-L181 CarbonylContact O-C 3.42Å; S178-L181 WeakPolarHBondContact O-CA 3.33Å; S178-L181 WeakPolarHBondContact O-CB 3.26Å; S178-L181 PolarHBondContact O-N 3.02Å; L181-M183 VanDerWaalsContact C-N 3.31Å; L181-M183 PolarHBondContact O-N 3.06Å; L181-M184 HydrophobicContact CD2-CE 3.91Å; L181-M184 PolarHBondContact O-N 2.81Å; L181-W185 WeakPolarHBondContact O-CB 3.43Å; L181-W185 PolarHBondContact O-N 2.96Å; L181-L300 HydrophobicContact CD2-CB 3.94Å; L181-L300 HydrophobicContact CD2-CD1 3.77Å; L181-L300 HydrophobicContact CD2-CG 4.49Å; L181-L300 HydrophobicContact CG-CD1 4.18Å; L181-Y304 HydrophobicContact CD1-CD2 3.55Å; L181-Y304 HydrophobicContact CD1-CE2 3.17Å; L181-Y304 HydrophobicContact CD1-CG 4.43Å; L181-Y304 HydrophobicContact CG-CD2 4.43Å; L181-Y304 HydrophobicContact CG-CE2 3.77Å
182A95.8Very high94.2Very high9 Ų942.9 Ų42.97%0.07421%0.207CC..Hα-helixtrans-59.7-40.6178.100000112.1L175 S178 W179 W185 F186 F242L175-A182 HydrophobicContact CD1-CB 4.35Å; L175-A182 HydrophobicContact CG-CB 4.27Å; S178-A182 PolarHBondContact O-N 2.95Å; W179-A182 PolarHBondContact O-N 3.5Å; A182-W185 WeakPolarHBondContact O-CB 3.28Å; A182-F186 WeakPolarHBondContact O-CB 3.45Å; A182-F186 PolarHBondContact O-N 3.02Å; A182-F242 HydrophobicContact CB-CD1 3.54Å; A182-F242 HydrophobicContact CB-CD2 4.36Å; A182-F242 HydrophobicContact CB-CE1 3.6Å; A182-F242 HydrophobicContact CB-CE2 4.44Å; A182-F242 HydrophobicContact CB-CG 3.93Å; A182-F242 HydrophobicContact CB-CZ 4.06Å
183M95Very high94Very high110 Ų11037.7 Ų37.754%0.54218%0.18SC..Hα-helixtrans-67.9-46.4177.2-171.365.2-171.700111.9W179 P180 L181 W185 F186 I187W179-M183 PolarHBondContact O-N 3.28Å; P180-M183 PolarHBondContact O-N 2.87Å; L181-M183 VanDerWaalsContact C-N 3.31Å; L181-M183 PolarHBondContact O-N 3.06Å; M183-W185 VanDerWaalsContact C-N 3.32Å; M183-W185 PolarHBondContact O-N 3.44Å; M183-F186 PolarHBondContact O-N 3.46Å; M183-I187 HydrophobicContact CE-CD1 4.11Å; M183-I187 HydrophobicContact CE-CG1 4.48Å; M183-I187 HydrophobicContact CG-CD1 4.49Å; M183-I187 WeakPolarHBondContact O-CG1 3.32Å; M183-I187 PolarHBondContact O-N 3.29Å; M183-I187 VanDerWaalsContact O-N 3.13Å
184M96Very high93.6Very high8 Ų832.6 Ų32.64%0.03916%0.161CC..Hα-helixtrans-64.2-39.7176.8-69.6-172.1-65.800111.8I149 P180 L181 F186 I187 S188 F293 L296 T297 L300I149-M184 HydrophobicContact CD1-CB 3.84Å; P180-M184 WeakPolarHBondContact O-CG 3.19Å; P180-M184 PolarHBondContact O-N 2.97Å; P180-M184 VanDerWaalsContact O-N 3.11Å; L181-M184 HydrophobicContact CD2-CE 3.91Å; L181-M184 PolarHBondContact O-N 2.81Å; M184-F186 VanDerWaalsContact C-N 3.35Å; M184-F186 PolarHBondContact O-N 3.16Å; M184-I187 PolarHBondContact O-N 2.97Å; M184-S188 PolarHBondContact O-N 2.7Å; M184-S188 PolarHBondContact O-OG 3.14Å; M184-F293 HydrophobicContact CG-CD1 4.21Å; M184-F293 HydrophobicContact CG-CE1 4.2Å; M184-F293 HydrophobicContact SD-CD1 4.21Å; M184-F293 HydrophobicContact SD-CG 4.45Å; M184-L296 HydrophobicContact CE-CD2 4.24Å; M184-L296 HydrophobicContact CE-CG 4.2Å; M184-L296 HydrophobicContact SD-CB 4.2Å; M184-L296 HydrophobicContact SD-CD2 3.64Å; M184-L296 HydrophobicContact SD-CG 3.98Å; M184-T297 HydrophobicContact CE-CG2 3.55Å; M184-T297 HydrophobicContact SD-CG2 3.74Å; M184-L300 HydrophobicContact CE-CD1 3.38Å
185W96.1Very high93Very high4 Ų433 Ų332%0.01516%0.162CC..Hα-helixtrans-58-46174.5173.1-95.1000112.1L146 I149 L150 L181 A182 M183 I187 S188 T189 L237 I241 F242L146-W185 HydrophobicContact CB-CZ3 4.5Å; L146-W185 HydrophobicContact CD1-CE3 3.77Å; L146-W185 HydrophobicContact CD1-CH2 3.34Å; L146-W185 HydrophobicContact CD1-CZ2 4.13Å; L146-W185 HydrophobicContact CD1-CZ3 3.13Å; L146-W185 HydrophobicContact CD2-CH2 4.38Å; L146-W185 HydrophobicContact CD2-CZ3 4.5Å; L146-W185 HydrophobicContact CG-CE3 4.41Å; L146-W185 HydrophobicContact CG-CH2 3.78Å; L146-W185 HydrophobicContact CG-CZ3 3.46Å; L146-W185 VanDerWaalsContact CG-CZ3 3.46Å; I149-W185 HydrophobicContact CB-CE3 4.28Å; I149-W185 HydrophobicContact CG2-CB 3.98Å; I149-W185 HydrophobicContact CG2-CE3 3.86Å; L150-W185 HydrophobicContact CD1-CH2 3.81Å; L150-W185 HydrophobicContact CD1-CZ3 3.59Å; L150-W185 HydrophobicContact CD2-CE3 4.34Å; L150-W185 HydrophobicContact CD2-CH2 3.71Å; L150-W185 HydrophobicContact CD2-CZ3 3.56Å; L150-W185 HydrophobicContact CG-CE3 4.2Å; L150-W185 HydrophobicContact CG-CH2 3.87Å; L150-W185 HydrophobicContact CG-CZ3 3.34Å; L181-W185 WeakPolarHBondContact O-CB 3.43Å; L181-W185 PolarHBondContact O-N 2.96Å; A182-W185 WeakPolarHBondContact O-CB 3.28Å; M183-W185 VanDerWaalsContact C-N 3.32Å; M183-W185 PolarHBondContact O-N 3.44Å; W185-I187 VanDerWaalsContact C-N 3.31Å; W185-I187 PolarHBondContact O-N 2.9Å; W185-S188 WeakPolarHBondContact CA-OG 3.42Å; W185-S188 PolarHBondContact O-N 2.96Å; W185-S188 PolarHBondContact O-OG 2.8Å; W185-T189 HydrophobicContact CD2-CG2 4.21Å; W185-T189 VanDerWaalsContact CE2-CG2 3.49Å; W185-T189 HydrophobicContact CH2-CG2 4.18Å; W185-T189 HydrophobicContact CZ2-CG2 3.4Å; W185-T189 WeakPolarHBondContact O-CG2 3.47Å; W185-T189 PolarHBondContact O-N 3.09Å; W185-T189 PolarHBondContact O-OG1 3.24Å; W185-L237 HydrophobicContact CH2-CD2 3.52Å; W185-L237 HydrophobicContact CZ2-CD2 3.07Å; W185-I241 HydrophobicContact CH2-CD1 4.41Å; W185-I241 HydrophobicContact CZ2-CD1 4.19Å; W185-F242 HydrophobicContact CB-CE2 3.78Å; W185-F242 HydrophobicContact CB-CZ 4Å; W185-F242 AromaticContact CD1-CD2 3.89Å; W185-F242 AromaticContact CD1-CE2 3.37Å; W185-F242 AromaticContact CD2-CE2 3.99Å; W185-F242 HydrophobicContact CD2-CE2 3.99Å; W185-F242 HydrophobicContact CG-CD2 4.33Å; W185-F242 AromaticContact CG-CE2 3.39Å; W185-F242 HydrophobicContact CG-CE2 3.39Å; W185-F242 HydrophobicContact CG-CZ 4.05Å; W185-F242 AromaticContact NE1-CE2 3.93Å
186F95.1Very high92.3Very high28 Ų2830.8 Ų30.812%0.12315%0.151CC..Hα-helixtrans-65.5-37.1179.6-174.1-97.3000111.5A182 M183 M184 T189 L190 L266 L269 F270 I273A182-F186 WeakPolarHBondContact O-CB 3.45Å; A182-F186 PolarHBondContact O-N 3.02Å; M183-F186 PolarHBondContact O-N 3.46Å; M184-F186 VanDerWaalsContact C-N 3.35Å; M184-F186 PolarHBondContact O-N 3.16Å; F186-T189 WeakPolarHBondContact CA-OG1 3.42Å; F186-T189 PolarHBondContact O-OG1 3.43Å; F186-L190 HydrophobicContact CD1-CD1 4Å; F186-L190 HydrophobicContact CE1-CD1 3.76Å; F186-L190 HydrophobicContact CE1-CG 4.48Å; F186-L190 WeakPolarHBondContact O-CG 3.38Å; F186-L190 PolarHBondContact O-N 3.5Å; F186-L190 VanDerWaalsContact O-N 3.16Å; F186-L266 HydrophobicContact CE2-CD2 4.21Å; F186-L269 HydrophobicContact CE1-CD2 4.4Å; F186-L269 HydrophobicContact CZ-CB 4.33Å; F186-L269 HydrophobicContact CZ-CD2 4.17Å; F186-F270 AromaticContact CD2-CE1 3.95Å; F186-F270 HydrophobicContact CD2-CE1 3.95Å; F186-F270 HydrophobicContact CE1-CD1 4.42Å; F186-F270 HydrophobicContact CE1-CE1 4.31Å; F186-F270 AromaticContact CE2-CD1 3.64Å; F186-F270 HydrophobicContact CE2-CD1 3.64Å; F186-F270 AromaticContact CE2-CE1 3.34Å; F186-F270 HydrophobicContact CE2-CE1 3.34Å; F186-F270 AromaticContact CZ-CD1 3.5Å; F186-F270 HydrophobicContact CZ-CD1 3.5Å; F186-F270 AromaticContact CZ-CE1 3.55Å; F186-F270 HydrophobicContact CZ-CE1 3.55Å; F186-I273 HydrophobicContact CE1-CD1 3.43Å; F186-I273 VanDerWaalsContact CE1-CD1 3.43Å; F186-I273 HydrophobicContact CZ-CD1 3.98Å
187I94.2Very high91.7Very high37 Ų3726.1 Ų26.119%0.1913%0.127CC..Hα-helixtrans-70.1-39.5173.9-61.4169.2000111.4M183 M184 W185 L190 A191 F198 L288 F293M183-I187 HydrophobicContact CE-CD1 4.11Å; M183-I187 HydrophobicContact CE-CG1 4.48Å; M183-I187 HydrophobicContact CG-CD1 4.49Å; M183-I187 WeakPolarHBondContact O-CG1 3.32Å; M183-I187 PolarHBondContact O-N 3.29Å; M183-I187 VanDerWaalsContact O-N 3.13Å; M184-I187 PolarHBondContact O-N 2.97Å; W185-I187 VanDerWaalsContact C-N 3.31Å; W185-I187 PolarHBondContact O-N 2.9Å; I187-L190 WeakPolarHBondContact O-CB 3.24Å; I187-L190 PolarHBondContact O-N 3.33Å; I187-A191 PolarHBondContact O-N 3.42Å; I187-F198 HydrophobicContact CG2-CE2 3.7Å; I187-F198 HydrophobicContact CG2-CZ 3.67Å; I187-L288 HydrophobicContact CG2-CD2 4.37Å; I187-F293 HydrophobicContact CB-CE2 3.94Å; I187-F293 HydrophobicContact CB-CZ 3.89Å; I187-F293 HydrophobicContact CD1-CZ 3.77Å; I187-F293 HydrophobicContact CG1-CZ 4.44Å; I187-F293 HydrophobicContact CG2-CE2 3.66Å; I187-F293 HydrophobicContact CG2-CZ 3.67Å
188S93.6Very high91.4Very high0 Ų023.7 Ų23.70%011%0.111CC..Hα-helixtrans-66.8-38.5178.262.10000112.2M184 W185 A191 E192M184-S188 PolarHBondContact O-N 2.7Å; M184-S188 PolarHBondContact O-OG 3.14Å; W185-S188 WeakPolarHBondContact CA-OG 3.42Å; W185-S188 PolarHBondContact O-N 2.96Å; W185-S188 PolarHBondContact O-OG 2.8Å; S188-A191 PolarHBondContact O-N 2.84Å; S188-E192 PolarHBondContact O-N 2.94Å
189T94.1Very high90.8Very high0 Ų024 Ų240%011%0.113CC..Hα-helixtrans-69-34.6175.850.30000113.2L146 W185 F186 A191 T193 M234 T238L146-T189 HydrophobicContact CD1-CG2 4.28Å; W185-T189 HydrophobicContact CD2-CG2 4.21Å; W185-T189 VanDerWaalsContact CE2-CG2 3.49Å; W185-T189 HydrophobicContact CH2-CG2 4.18Å; W185-T189 HydrophobicContact CZ2-CG2 3.4Å; W185-T189 WeakPolarHBondContact O-CG2 3.47Å; W185-T189 PolarHBondContact O-N 3.09Å; W185-T189 PolarHBondContact O-OG1 3.24Å; F186-T189 WeakPolarHBondContact CA-OG1 3.42Å; F186-T189 PolarHBondContact O-OG1 3.43Å; T189-A191 PolarHBondContact O-N 3Å; T189-T193 PolarHBondContact O-N 3.46Å; T189-T193 PolarHBondContact O-OG1 3.39Å; T189-M234 HydrophobicContact CG2-CB 4.43Å; T189-M234 HydrophobicContact CG2-SD 4.44Å; T189-T238 HydrophobicContact CG2-CG2 4.12Å
190L92.2Very high89.8Confident6 Ų616 Ų163%0.0318%0.083CC..Hα-helixtrans-58.8-38.6169.2-83.6165.1000111.8F186 I187 T193 R195 F198 F270 I273F186-L190 HydrophobicContact CD1-CD1 4Å; F186-L190 HydrophobicContact CE1-CD1 3.76Å; F186-L190 HydrophobicContact CE1-CG 4.48Å; F186-L190 WeakPolarHBondContact O-CG 3.38Å; F186-L190 PolarHBondContact O-N 3.5Å; F186-L190 VanDerWaalsContact O-N 3.16Å; I187-L190 WeakPolarHBondContact O-CB 3.24Å; I187-L190 PolarHBondContact O-N 3.33Å; L190-T193 PolarHBondContact O-OG1 3.17Å; L190-R195 PolarHBondContact O-N 2.87Å; L190-F198 HydrophobicContact CB-CD2 4.18Å; L190-F198 HydrophobicContact CB-CE2 4.33Å; L190-F270 HydrophobicContact CD2-CB 4.42Å; L190-F270 HydrophobicContact CD2-CD1 3.71Å; L190-F270 HydrophobicContact CD2-CD2 3.72Å; L190-F270 HydrophobicContact CD2-CE1 3.75Å; L190-F270 HydrophobicContact CD2-CE2 3.8Å; L190-F270 HydrophobicContact CD2-CG 3.68Å; L190-F270 HydrophobicContact CD2-CZ 3.8Å; L190-F270 HydrophobicContact CG-CD1 4.16Å; L190-F270 HydrophobicContact CG-CE1 3.74Å; L190-F270 HydrophobicContact CG-CE2 4.25Å; L190-F270 HydrophobicContact CG-CZ 3.79Å; L190-I273 HydrophobicContact CD1-CD1 3.89Å; L190-I273 HydrophobicContact CD1-CG2 4.22Å
191A91Very high88.4Confident0 Ų014.8 Ų14.80%08%0.075CC..Hα-helixtrans-81.7-32.5-178.300000114Q138 Y142 I187 S188 T189 T193 N194 F198Q138-A191 PolarHBondContact NE2-O 3.27Å; Y142-A191 HydrophobicContact CD1-CB 3.63Å; Y142-A191 HydrophobicContact CD2-CB 3.55Å; Y142-A191 HydrophobicContact CE1-CB 3.23Å; Y142-A191 HydrophobicContact CE2-CB 3.19Å; Y142-A191 HydrophobicContact CG-CB 3.78Å; Y142-A191 WeakPolarHBondContact OH-CB 3.45Å; I187-A191 PolarHBondContact O-N 3.42Å; S188-A191 PolarHBondContact O-N 2.84Å; T189-A191 PolarHBondContact O-N 3Å; A191-T193 VanDerWaalsContact C-N 3.27Å; A191-T193 PolarHBondContact O-N 2.87Å; A191-N194 PolarHBondContact O-N 2.9Å; A191-N194 VanDerWaalsContact O-N 3.15Å; A191-N194 PolarHBondContact O-OD1 2.85Å; A191-F198 HydrophobicContact CB-CB 3.89Å; A191-F198 HydrophobicContact CB-CD2 3.67Å; A191-F198 HydrophobicContact CB-CE2 4.33Å; A191-F198 HydrophobicContact CB-CG 3.78Å
192E90.8Very high87.3Confident28 Ų2816.1 Ų16.113%0.1318%0.081CC..Hα-helixtrans-63.4-35.7172.6-173.4174.7-177.100111.7S109 L146 S188 N194 M234S109-E192 VanDerWaalsContact CB-OE1 3.31Å; S109-E192 WeakPolarHBondContact CB-OE1 3.45Å; S109-E192 PolarHBondContact OG-OE1 3.18Å; L146-E192 WeakPolarHBondContact CD2-OE2 3.18Å; S188-E192 PolarHBondContact O-N 2.94Å; E192-N194 PolarHBondContact O-N 3.48Å; E192-M234 HydrophobicContact CG-CE 3.98Å; E192-M234 WeakPolarHBondContact OE1-CE 3.31Å; E192-M234 VanDerWaalsContact OE2-CE 3.25Å; E192-M234 WeakPolarHBondContact OE2-CE 3.35Å
193T89.2Confident86Confident8 Ų815.8 Ų15.85%0.0498%0.079CC..THydrogen-bonded Turntrans-80.87.2176.1540000113.8T189 L190 A191 R195 I231 M234T189-T193 PolarHBondContact O-N 3.46Å; T189-T193 PolarHBondContact O-OG1 3.39Å; L190-T193 PolarHBondContact O-OG1 3.17Å; A191-T193 VanDerWaalsContact C-N 3.27Å; A191-T193 PolarHBondContact O-N 2.87Å; T193-R195 WeakPolarHBondContact O-CG 3.43Å; T193-R195 PolarHBondContact O-N 3.4Å; T193-R195 VanDerWaalsContact O-N 3.12Å; T193-I231 HydrophobicContact CG2-CG1 4.18Å; T193-M234 HydrophobicContact CG2-CB 4.25Å; T193-M234 HydrophobicContact CG2-CG 3.79Å
194N85.6Confident84.3Confident15 Ų1516.4 Ų16.48%0.088%0.08CC..THydrogen-bonded Turntrans50.832.6-179.4-61.9-41.3000113.8Q138 A191 E192 D199 A201Q138-N194 PolarHBondContact NE2-OD1 3.32Å; A191-N194 PolarHBondContact O-N 2.9Å; A191-N194 VanDerWaalsContact O-N 3.15Å; A191-N194 PolarHBondContact O-OD1 2.85Å; E192-N194 PolarHBondContact O-N 3.48Å; N194-D199 WeakPolarHBondContact O-CA 3.28Å; N194-D199 WeakPolarHBondContact O-CB 3.13Å; N194-A201 HydrophobicContact CB-CB 4.4Å
195R82.5Confident82.3Confident18 Ų1820.8 Ų20.87%0.06811%0.111CC..  trans-94.3150.7-179.8-60.3-58.2-96.8-168.5-10.5111.7E24 L190 T193 F198 D199 Y228 I231E24-R195 VanDerWaalsContact CD-NH2 3.3Å; E24-R195 IonicContact OE1-CZ 3.58Å; E24-R195 IonicContact OE1-NH2 2.97Å; E24-R195 PolarHBondContact OE1-NH2 3.21Å; E24-R195 IonicContact OE2-NH2 2.65Å; E24-R195 PolarHBondContact OE2-NH2 3.02Å; L190-R195 PolarHBondContact O-N 2.87Å; T193-R195 WeakPolarHBondContact O-CG 3.43Å; T193-R195 PolarHBondContact O-N 3.4Å; T193-R195 VanDerWaalsContact O-N 3.12Å; R195-F198 CarbonylContact O-C 3.47Å; R195-F198 WeakPolarHBondContact O-CA 3.25Å; R195-F198 PolarHBondContact O-N 2.83Å; R195-D199 PolarHBondContact O-N 2.67Å; R195-Y228 PolarHBondContact NH2-OH 3.02Å; R195-Y228 VanDerWaalsContact NH2-OH 3.15Å; R195-I231 HydrophobicContact CG-CD1 3.85Å; R195-I231 HydrophobicContact CG-CG1 4.17Å; R195-I231 VanDerWaalsContact NE-CD1 3.31Å
196T79.4Confident80.3Confident14 Ų1425.4 Ų25.49%0.08613%0.133CC..THydrogen-bonded Turntrans-52.7128.6173.748.50000109.8D199 R274 R279T196-D199 HydrophobicContact CG2-CB 3.71Å; T196-R274 WeakPolarHBondContact OG1-CA 3.39Å; T196-R274 WeakPolarHBondContact OG1-CB 3.41Å; T196-R274 WeakPolarHBondContact OG1-CG 3.43Å; T196-R279 HydrophobicContact CG2-CG 4.19Å
197P80.6Confident78.9Confident7 Ų724.4 Ų24.45%0.04513%0.129CC..THydrogen-bonded Turncis-88.9-0.219.936.7-39.7000116.1P278 R279 F280P197-P278 WeakPolarHBondContact CB-O 3.38Å; P197-R279 WeakPolarHBondContact O-CA 3.49Å; P197-F280 HydrophobicContact CB-CD2 3.64Å; P197-F280 HydrophobicContact CB-CE2 3.89Å; P197-F280 HydrophobicContact CG-CD2 3.82Å; P197-F280 HydrophobicContact CG-CE2 3.75Å; P197-F280 PolarHBondContact O-N 2.85Å
198F86.6Confident77.8Confident6 Ų628 Ų283%0.02615%0.153CC..SBendtrans-101.125.4-177.7-51.5-65.2000113.8Q138 Y142 I187 L190 A191 R195 L200 F280 L285 L288Q138-F198 PolarHBondContact NE2-O 2.93Å; Q138-F198 PolarHBondContact OE1-O 3.26Å; Y142-F198 WeakPolarHBondContact OH-CD1 3.36Å; I187-F198 HydrophobicContact CG2-CE2 3.7Å; I187-F198 HydrophobicContact CG2-CZ 3.67Å; L190-F198 HydrophobicContact CB-CD2 4.18Å; L190-F198 HydrophobicContact CB-CE2 4.33Å; A191-F198 HydrophobicContact CB-CB 3.89Å; A191-F198 HydrophobicContact CB-CD2 3.67Å; A191-F198 HydrophobicContact CB-CE2 4.33Å; A191-F198 HydrophobicContact CB-CG 3.78Å; R195-F198 CarbonylContact O-C 3.47Å; R195-F198 WeakPolarHBondContact O-CA 3.25Å; R195-F198 PolarHBondContact O-N 2.83Å; F198-L200 VanDerWaalsContact C-N 3.3Å; F198-L200 PolarHBondContact O-N 3.49Å; F198-F280 HydrophobicContact CD1-CB 4.45Å; F198-F280 AromaticContact CD1-CD2 3.77Å; F198-F280 HydrophobicContact CD1-CD2 3.77Å; F198-F280 HydrophobicContact CD1-CE2 4.49Å; F198-F280 HydrophobicContact CD1-CG 4.39Å; F198-F280 AromaticContact CE1-CD2 3.38Å; F198-F280 HydrophobicContact CE1-CD2 3.38Å; F198-F280 AromaticContact CE1-CE2 3.71Å; F198-F280 HydrophobicContact CE1-CE2 3.71Å; F198-F280 HydrophobicContact CE1-CG 4.12Å; F198-F280 HydrophobicContact CZ-CD2 4.09Å; F198-F280 AromaticContact CZ-CE2 4Å; F198-F280 HydrophobicContact CZ-CE2 4Å; F198-L285 HydrophobicContact CB-CD1 3.94Å; F198-L285 HydrophobicContact CD1-CD1 3.59Å; F198-L285 HydrophobicContact CD1-CG 4.21Å; F198-L285 HydrophobicContact CG-CD1 4.14Å; F198-L288 HydrophobicContact CE1-CD2 4.02Å; F198-L288 HydrophobicContact CZ-CD2 4.04Å
199D82.4Confident76.6Confident7 Ų729.3 Ų29.34%0.03716%0.161CC..  trans-80.775.8176.2174.322.8000110.5N194 R195 T196 E202 R279N194-D199 WeakPolarHBondContact O-CA 3.28Å; N194-D199 WeakPolarHBondContact O-CB 3.13Å; R195-D199 PolarHBondContact O-N 2.67Å; T196-D199 HydrophobicContact CG2-CB 3.71Å; D199-E202 VanDerWaalsContact OD1-CB 3.25Å; D199-E202 WeakPolarHBondContact OD1-CB 3.35Å; D199-E202 PolarHBondContact OD1-N 3.43Å; D199-R279 IonicContact OD2-CZ 2.87Å; D199-R279 IonicContact OD2-NE 3.55Å; D199-R279 IonicContact OD2-NH2 3.84Å; D199-R279 PolarHBondContact OD2-NH2 2.98Å
200L74Confident76.1Confident4 Ų429.3 Ų29.32%0.02116%0.161CC..  trans-95.9-22.5177.9-56.6-179.4000112.6F198 F280 Y282 L285F198-L200 VanDerWaalsContact C-N 3.3Å; F198-L200 PolarHBondContact O-N 3.49Å; L200-F280 WeakPolarHBondContact CD2-O 3.46Å; L200-Y282 HydrophobicContact CD1-CD2 3.81Å; L200-Y282 HydrophobicContact CD1-CG 4.37Å; L200-L285 HydrophobicContact CD1-CB 4.22Å; L200-L285 HydrophobicContact CD1-CD1 3.51Å; L200-L285 HydrophobicContact CD1-CG 4.28Å; L200-L285 HydrophobicContact CG-CD1 4.25Å
201A67.8Low75.5Confident1 Ų129.1 Ų29.11%0.00816%0.16CC..SBendtrans-74-37.9-177.900000111.7A135 N194 G210 F211A135-A201 HydrophobicContact CB-CB 3.62Å; N194-A201 HydrophobicContact CB-CB 4.4Å; A201-G210 VanDerWaalsContact O-CA 3.24Å; A201-G210 WeakPolarHBondContact O-CA 3.19Å; A201-F211 HydrophobicContact CB-CD1 4.11Å; A201-F211 HydrophobicContact CB-CE1 4.08Å
202E71.3Confident75.2Confident29 Ų2929.2 Ų29.214%0.13616%0.161CC..SBendtrans-102.7-2-178.7-157177.5-167.700112.6D199 E204 N212 F224D199-E202 VanDerWaalsContact OD1-CB 3.25Å; D199-E202 WeakPolarHBondContact OD1-CB 3.35Å; D199-E202 PolarHBondContact OD1-N 3.43Å; E202-E204 PolarHBondContact O-N 2.9Å; E202-N212 PolarHBondContact OE1-ND2 3.03Å; E202-F224 WeakPolarHBondContact OE1-CZ 3.4Å
203G68.1Low74.8Confident2 Ų230.8 Ų30.82%0.02117%0.17CC..  trans-36.693.6-16700000115.1S205 E206 L207G203-S205 PolarHBondContact O-N 2.86Å; G203-S205 VanDerWaalsContact O-N 3.08Å; G203-E206 PolarHBondContact O-N 3.27Å; G203-L207 PolarHBondContact O-N 3.31Å
204E60.3Low74.6Confident123 Ų12332.3 Ų32.358%0.57518%0.176SC*.Hα-helixtrans-56.4-34-171.1-62.4176.1168.100113E202 V208E202-E204 PolarHBondContact O-N 2.9Å; E204-V208 WeakPolarHBondContact CA-O 3.06Å; E204-V208 WeakPolarHBondContact O-CA 3.36Å; E204-V208 PolarHBondContact O-N 3.27Å
205S54.4Low74.6Confident99 Ų9932 Ų3269%0.69217%0.174SC*.Hα-helixtrans-74.9-23.7-179.852.30000113.8G203G203-S205 PolarHBondContact O-N 2.86Å; G203-S205 VanDerWaalsContact O-N 3.08Å
206E54.2Low74.8Confident101 Ų10131.8 Ų31.847%0.47218%0.176SC..Hα-helixtrans-109.9-35.1-173.5-63.7-179.4178.700112.1R134 G203R134-E206 IonicContact CZ-OE2 3.22Å; R134-E206 IonicContact NH1-OE2 2.67Å; R134-E206 PolarHBondContact NH1-OE2 2.94Å; R134-E206 IonicContact NH2-OE2 2.83Å; R134-E206 PolarHBondContact NH2-OE2 3.4Å; G203-E206 PolarHBondContact O-N 3.27Å
207L64Low75.2Confident7 Ų731.3 Ų31.34%0.03717%0.173CC..Hα-helixtrans-130.711-169.2-61175.1000113.5Y127 I130 G203 S209 G210 I213Y127-L207 HydrophobicContact CD1-CD2 4.1Å; I130-L207 HydrophobicContact CB-CD2 4.47Å; I130-L207 HydrophobicContact CG2-CD2 4.09Å; G203-L207 PolarHBondContact O-N 3.31Å; L207-S209 PolarHBondContact O-N 3.43Å; L207-G210 PolarHBondContact O-N 3.05Å; L207-I213 WeakPolarHBondContact O-CD1 3.45Å
208V71.6Confident75.6Confident114 Ų11431.8 Ų31.869%0.69118%0.179SC*.THydrogen-bonded Turntrans63.9-56.1-175.8-174.10000113.2E204E204-V208 WeakPolarHBondContact CA-O 3.06Å; E204-V208 WeakPolarHBondContact O-CA 3.36Å; E204-V208 PolarHBondContact O-N 3.27Å
209S69.7Low75.8Confident26 Ų2633.1 Ų33.118%0.18219%0.188CC..THydrogen-bonded Turntrans-154.49.7165.576.70000114L207 N212 I213L207-S209 PolarHBondContact O-N 3.43Å; S209-N212 VanDerWaalsContact CB-OD1 3.23Å; S209-N212 WeakPolarHBondContact CB-OD1 3.49Å; S209-N212 PolarHBondContact O-OD1 3.32Å; S209-N212 PolarHBondContact OG-OD1 2.99Å; S209-I213 WeakPolarHBondContact OG-CA 3.4Å; S209-I213 WeakPolarHBondContact OG-CG1 3.45Å; S209-I213 PolarHBondContact OG-N 3.44Å
210G83.5Confident76.1Confident0 Ų035.4 Ų35.40%020%0.198CC..G310 helixtrans73.1-128.1171.200000116A128 A201 L207 N212 I213A128-G210 VanDerWaalsContact CA-O 3.26Å; A128-G210 WeakPolarHBondContact CA-O 3.19Å; A201-G210 VanDerWaalsContact O-CA 3.24Å; A201-G210 WeakPolarHBondContact O-CA 3.19Å; L207-G210 PolarHBondContact O-N 3.05Å; G210-N212 VanDerWaalsContact C-N 3.26Å; G210-N212 PolarHBondContact O-N 2.8Å; G210-I213 WeakPolarHBondContact O-CD1 3.36Å; G210-I213 WeakPolarHBondContact O-CG1 3.42Å
211F78.8Confident77Confident2 Ų235.4 Ų35.41%0.00920%0.199CC..G310 helixtrans-70.3-21.4-173.468.3-92.7000113.8I116 S119 A132 A201 F223I116-F211 HydrophobicContact CG1-CZ 4.47Å; I116-F211 HydrophobicContact CG2-CB 4.17Å; I116-F211 HydrophobicContact CG2-CD1 3.79Å; I116-F211 HydrophobicContact CG2-CD2 4.18Å; I116-F211 HydrophobicContact CG2-CE1 4.19Å; I116-F211 HydrophobicContact CG2-CG 3.78Å; S119-F211 WeakPolarHBondContact OG-CD2 3.39Å; A132-F211 HydrophobicContact CB-CB 4.22Å; A201-F211 HydrophobicContact CB-CD1 4.11Å; A201-F211 HydrophobicContact CB-CE1 4.08Å; F211-F223 HydrophobicContact CE2-CD1 4.05Å; F211-F223 HydrophobicContact CE2-CE1 4.26Å; F211-F223 HydrophobicContact CE2-CG 4.28Å
212N83.9Confident78.1Confident2 Ų237.2 Ų37.21%0.01121%0.208CC..G310 helixtrans-97.26.3-174.670.914.7000113.8E202 S209 G210 E214 Y215E202-N212 PolarHBondContact OE1-ND2 3.03Å; S209-N212 VanDerWaalsContact CB-OD1 3.23Å; S209-N212 WeakPolarHBondContact CB-OD1 3.49Å; S209-N212 PolarHBondContact O-OD1 3.32Å; S209-N212 PolarHBondContact OG-OD1 2.99Å; G210-N212 VanDerWaalsContact C-N 3.26Å; G210-N212 PolarHBondContact O-N 2.8Å; N212-E214 PolarHBondContact O-N 3.09Å; N212-E214 VanDerWaalsContact O-N 3.1Å; N212-Y215 WeakPolarHBondContact O-CB 3.24Å; N212-Y215 PolarHBondContact O-N 3.16Å
213I82.4Confident79.1Confident62 Ų6236 Ų3632%0.31820%0.203SC..THydrogen-bonded Turntrans-50.7-40.6-173-66.5159.8000113.1L207 S209 G210L207-I213 WeakPolarHBondContact O-CD1 3.45Å; S209-I213 WeakPolarHBondContact OG-CA 3.4Å; S209-I213 WeakPolarHBondContact OG-CG1 3.45Å; S209-I213 PolarHBondContact OG-N 3.44Å; G210-I213 WeakPolarHBondContact O-CD1 3.36Å; G210-I213 WeakPolarHBondContact O-CG1 3.42Å
214E85.6Confident80.2Confident40 Ų4037.6 Ų37.619%0.18721%0.209CC..THydrogen-bonded Turntrans-91.7-2.6-175.7-67.7-172.9-157.600113.9P63 Y71 S123 S125 N212P63-E214 WeakPolarHBondContact CB-OE2 3.41Å; P63-E214 HydrophobicContact CG-CB 3.93Å; P63-E214 HydrophobicContact CG-CG 4.43Å; P63-E214 WeakPolarHBondContact CG-OE2 3.38Å; Y71-E214 HydrophobicContact CE2-CB 4.48Å; Y71-E214 PolarHBondContact OH-O 3.17Å; S123-E214 WeakPolarHBondContact CA-OE2 3.39Å; S123-E214 VanDerWaalsContact CB-CD 3.48Å; S123-E214 WeakPolarHBondContact CB-OE2 3.44Å; S123-E214 VanDerWaalsContact O-CD 3.25Å; S123-E214 VanDerWaalsContact O-OE1 3.12Å; S125-E214 WeakPolarHBondContact CB-OE1 3.01Å; S125-E214 PolarHBondContact OG-OE1 3.5Å; N212-E214 PolarHBondContact O-N 3.09Å; N212-E214 VanDerWaalsContact O-N 3.1Å
215Y86.7Confident81.7Confident9 Ų933.3 Ų33.34%0.03519%0.189CC..  trans-85.8123.1177.7-70.1-90.5000110.4Y71 P75 S119 N212 P219 F223Y71-Y215 AromaticContact CD1-CE1 3.99Å; Y71-Y215 HydrophobicContact CD1-CE1 3.99Å; Y71-Y215 HydrophobicContact CD2-CD1 4.33Å; Y71-Y215 AromaticContact CD2-CE1 3.59Å; Y71-Y215 HydrophobicContact CD2-CE1 3.59Å; Y71-Y215 HydrophobicContact CD2-CE2 4.12Å; Y71-Y215 AromaticContact CD2-CZ 3.47Å; Y71-Y215 VanDerWaalsContact CD2-CZ 3.47Å; Y71-Y215 WeakPolarHBondContact CD2-OH 3.48Å; Y71-Y215 AromaticContact CE1-CD1 3.98Å; Y71-Y215 HydrophobicContact CE1-CD1 3.98Å; Y71-Y215 AromaticContact CE1-CE1 3.85Å; Y71-Y215 HydrophobicContact CE1-CE1 3.85Å; Y71-Y215 AromaticContact CE2-CD1 3.72Å; Y71-Y215 HydrophobicContact CE2-CD1 3.72Å; Y71-Y215 HydrophobicContact CE2-CD2 4.12Å; Y71-Y215 AromaticContact CE2-CE1 3.45Å; Y71-Y215 HydrophobicContact CE2-CE1 3.45Å; Y71-Y215 VanDerWaalsContact CE2-CE1 3.45Å; Y71-Y215 AromaticContact CE2-CE2 3.88Å; Y71-Y215 HydrophobicContact CE2-CE2 3.88Å; Y71-Y215 HydrophobicContact CE2-CG 4.06Å; Y71-Y215 AromaticContact CE2-CZ 3.54Å; Y71-Y215 AromaticContact CG-CE1 3.87Å; Y71-Y215 HydrophobicContact CG-CE1 3.87Å; Y71-Y215 AromaticContact CZ-CD1 3.52Å; Y71-Y215 AromaticContact CZ-CE1 3.58Å; Y71-Y215 WeakPolarHBondContact O-CE1 3.49Å; Y71-Y215 WeakPolarHBondContact OH-CA 3.35Å; P75-Y215 HydrophobicContact CG-CD1 4.06Å; P75-Y215 HydrophobicContact CG-CE1 3.65Å; S119-Y215 WeakPolarHBondContact CA-OH 3.24Å; N212-Y215 WeakPolarHBondContact O-CB 3.24Å; N212-Y215 PolarHBondContact O-N 3.16Å; Y215-P219 HydrophobicContact CD1-CB 3.71Å; Y215-P219 HydrophobicContact CE1-CB 4.43Å; Y215-F223 HydrophobicContact CD1-CD2 4.5Å; Y215-F223 AromaticContact CD1-CE2 3.98Å; Y215-F223 HydrophobicContact CD1-CE2 3.98Å; Y215-F223 HydrophobicContact CD2-CE2 4.19Å; Y215-F223 AromaticContact CE1-CE2 3.92Å; Y215-F223 HydrophobicContact CE1-CE2 3.92Å; Y215-F223 HydrophobicContact CE2-CE2 4.14Å; Y215-F223 HydrophobicContact CG-CD2 4.42Å; Y215-F223 HydrophobicContact CG-CE2 4.1Å
216A85.8Confident83.6Confident13 Ų1328.8 Ų28.811%0.10716%0.158CC..  trans-115.8158.5176.100000111.5L61 G218 P219L61-A216 HydrophobicContact CB-CB 3.79Å; L61-A216 HydrophobicContact CD1-CB 3.91Å; L61-A216 HydrophobicContact CG-CB 4.02Å; A216-G218 PolarHBondContact O-N 3.17Å; A216-P219 VanDerWaalsContact O-CD 3.3Å; A216-P219 WeakPolarHBondContact O-CD 3.07Å
217A88.4Confident85.4Confident4 Ų425.2 Ų25.23%0.03314%0.141CC..Hα-helixtrans55.1-119.9165.900000113.8L55 K58 A221L55-A217 CarbonylContact O-C 3.21Å; L55-A217 WeakPolarHBondContact O-CA 3.42Å; L55-A217 WeakPolarHBondContact O-CB 3.23Å; K58-A217 HydrophobicContact CB-CB 3.8Å; K58-A217 HydrophobicContact CD-CB 4.48Å; K58-A217 HydrophobicContact CG-CB 4.17Å; K58-A217 VanDerWaalsContact O-CB 3.3Å; K58-A217 WeakPolarHBondContact O-CB 3.25Å; A217-A221 PolarHBondContact O-N 3.36Å
218G89.1Confident86.8Confident16 Ų1625.8 Ų25.817%0.16514%0.143CC..Hα-helixtrans-62.5-55.1-176.300000114.6L55 A216 F220 A221 L222L55-G218 PolarHBondContact O-N 3.17Å; A216-G218 PolarHBondContact O-N 3.17Å; G218-F220 VanDerWaalsContact C-N 3.26Å; G218-F220 PolarHBondContact O-N 3.43Å; G218-A221 WeakPolarHBondContact O-CA 3.39Å; G218-A221 VanDerWaalsContact O-CB 3.28Å; G218-A221 WeakPolarHBondContact O-CB 3.31Å; G218-A221 PolarHBondContact O-N 3.13Å; G218-L222 PolarHBondContact O-N 2.73Å
219P90Very high87.9Confident34 Ų3420.4 Ų20.422%0.22111%0.11CC..Hα-helixtrans-53.6-39.4175.9-31.936.7000114.3P75 Y215 A216 L222P75-P219 HydrophobicContact CG-CB 4.08Å; Y215-P219 HydrophobicContact CD1-CB 3.71Å; Y215-P219 HydrophobicContact CE1-CB 4.43Å; A216-P219 VanDerWaalsContact O-CD 3.3Å; A216-P219 WeakPolarHBondContact O-CD 3.07Å; P219-L222 PolarHBondContact O-N 3.3Å
220F89.3Confident89.1Confident55 Ų5520.7 Ų20.724%0.24111%0.11CC..Hα-helixtrans-61.5-48.1171.8174.7-93.4000111.2L55 G218 L222 F223 F224L55-F220 HydrophobicContact CD2-CD1 4.18Å; G218-F220 VanDerWaalsContact C-N 3.26Å; G218-F220 PolarHBondContact O-N 3.43Å; F220-L222 PolarHBondContact O-N 2.91Å; F220-F223 PolarHBondContact O-N 3.38Å; F220-F223 VanDerWaalsContact O-N 3.07Å; F220-F224 AromaticContact CD1-CD2 3.63Å; F220-F224 HydrophobicContact CD1-CD2 3.63Å; F220-F224 AromaticContact CD1-CE2 3.86Å; F220-F224 HydrophobicContact CD1-CE2 3.86Å; F220-F224 HydrophobicContact CD2-CD2 4.05Å; F220-F224 AromaticContact CD2-CE2 3.6Å; F220-F224 HydrophobicContact CD2-CE2 3.6Å; F220-F224 AromaticContact CE1-CD2 3.37Å; F220-F224 HydrophobicContact CE1-CD2 3.37Å; F220-F224 AromaticContact CE1-CE2 3.3Å; F220-F224 HydrophobicContact CE1-CE2 3.3Å; F220-F224 HydrophobicContact CE1-CG 4.21Å; F220-F224 AromaticContact CE1-CZ 3.97Å; F220-F224 HydrophobicContact CE1-CZ 3.97Å; F220-F224 AromaticContact CE2-CD2 3.85Å; F220-F224 HydrophobicContact CE2-CD2 3.85Å; F220-F224 AromaticContact CE2-CE2 3.03Å; F220-F224 HydrophobicContact CE2-CE2 3.03Å; F220-F224 AromaticContact CE2-CZ 3.73Å; F220-F224 HydrophobicContact CE2-CZ 3.73Å; F220-F224 AromaticContact CG-CD2 3.98Å; F220-F224 HydrophobicContact CG-CD2 3.98Å; F220-F224 AromaticContact CG-CE2 4Å; F220-F224 HydrophobicContact CG-CE2 4Å; F220-F224 AromaticContact CZ-CD2 3.51Å; F220-F224 HydrophobicContact CZ-CD2 3.51Å; F220-F224 HydrophobicContact CZ-CE1 4.33Å; F220-F224 AromaticContact CZ-CE2 2.86Å; F220-F224 HydrophobicContact CZ-CE2 2.86Å; F220-F224 HydrophobicContact CZ-CG 4.49Å; F220-F224 AromaticContact CZ-CZ 3.32Å; F220-F224 HydrophobicContact CZ-CZ 3.32Å; F220-F224 WeakPolarHBondContact O-CD2 3.34Å; F220-F224 PolarHBondContact O-N 3.46Å; F220-F224 VanDerWaalsContact O-N 3.17Å
221A91.4Very high89.6Confident5 Ų521 Ų214%0.04111%0.111CC..Hα-helixtrans-55.3-37.517800000112.4L55 A217 G218 F223 F224 M225L55-A221 HydrophobicContact CB-CB 4.14Å; L55-A221 HydrophobicContact CD1-CB 3.89Å; A217-A221 PolarHBondContact O-N 3.36Å; G218-A221 WeakPolarHBondContact O-CA 3.39Å; G218-A221 VanDerWaalsContact O-CB 3.28Å; G218-A221 WeakPolarHBondContact O-CB 3.31Å; G218-A221 PolarHBondContact O-N 3.13Å; A221-F223 PolarHBondContact O-N 2.84Å; A221-F224 PolarHBondContact O-N 3.13Å; A221-M225 HydrophobicContact CB-CE 4.26Å; A221-M225 WeakPolarHBondContact O-CB 3.39Å; A221-M225 WeakPolarHBondContact O-CE 3.22Å; A221-M225 WeakPolarHBondContact O-CG 3.39Å; A221-M225 PolarHBondContact O-N 3.41Å
222L92.7Very high90.4Very high38 Ų3821.7 Ų21.720%0.19912%0.115CC..Hα-helixtrans-61.5-40.9177.5-67.5170.3000112.9P75 T76 L79 G218 P219 F220 M225 A226P75-L222 HydrophobicContact CB-CB 3.73Å; P75-L222 HydrophobicContact CB-CD1 3.9Å; P75-L222 HydrophobicContact CB-CG 4.47Å; T76-L222 HydrophobicContact CG2-CD1 4.31Å; L79-L222 HydrophobicContact CB-CD2 4.49Å; L79-L222 HydrophobicContact CD2-CD2 3.6Å; G218-L222 PolarHBondContact O-N 2.73Å; P219-L222 PolarHBondContact O-N 3.3Å; F220-L222 PolarHBondContact O-N 2.91Å; L222-M225 HydrophobicContact CD2-CE 3.75Å; L222-M225 HydrophobicContact CG-CE 4.33Å; L222-A226 WeakPolarHBondContact O-CB 3.41Å; L222-A226 PolarHBondContact O-N 3.18Å
223F91.6Very high91Very high5 Ų521.6 Ų21.62%0.02212%0.115CC..Hα-helixtrans-65.2-46.6174.1-77.6-63.1000112A74 P75 A78 F211 Y215 F220 A221 M225 A226 E227A74-F223 HydrophobicContact CB-CZ 4.19Å; P75-F223 HydrophobicContact CB-CD2 4.06Å; P75-F223 HydrophobicContact CB-CE2 3.77Å; P75-F223 HydrophobicContact CB-CZ 4.02Å; P75-F223 HydrophobicContact CG-CD2 4.22Å; P75-F223 HydrophobicContact CG-CE2 3.54Å; P75-F223 HydrophobicContact CG-CZ 3.91Å; A78-F223 HydrophobicContact CB-CD1 3.83Å; A78-F223 HydrophobicContact CB-CE1 3.8Å; F211-F223 HydrophobicContact CE2-CD1 4.05Å; F211-F223 HydrophobicContact CE2-CE1 4.26Å; F211-F223 HydrophobicContact CE2-CG 4.28Å; Y215-F223 HydrophobicContact CD1-CD2 4.5Å; Y215-F223 AromaticContact CD1-CE2 3.98Å; Y215-F223 HydrophobicContact CD1-CE2 3.98Å; Y215-F223 HydrophobicContact CD2-CE2 4.19Å; Y215-F223 AromaticContact CE1-CE2 3.92Å; Y215-F223 HydrophobicContact CE1-CE2 3.92Å; Y215-F223 HydrophobicContact CE2-CE2 4.14Å; Y215-F223 HydrophobicContact CG-CD2 4.42Å; Y215-F223 HydrophobicContact CG-CE2 4.1Å; F220-F223 PolarHBondContact O-N 3.38Å; F220-F223 VanDerWaalsContact O-N 3.07Å; A221-F223 PolarHBondContact O-N 2.84Å; F223-M225 VanDerWaalsContact C-N 3.32Å; F223-M225 PolarHBondContact O-N 3.22Å; F223-A226 WeakPolarHBondContact O-CB 3.49Å; F223-A226 PolarHBondContact O-N 3.15Å; F223-A226 VanDerWaalsContact O-N 3.13Å; F223-E227 WeakPolarHBondContact O-CG 3.43Å; F223-E227 PolarHBondContact O-N 3.45Å
224F90Very high91.6Very high35 Ų3519 Ų1915%0.15410%0.101CC..Hα-helixtrans-60-44.3177.4-84-88.2000111.8E202 F220 A221 A226 E227 Y228E202-F224 WeakPolarHBondContact OE1-CZ 3.4Å; F220-F224 AromaticContact CD1-CD2 3.63Å; F220-F224 HydrophobicContact CD1-CD2 3.63Å; F220-F224 AromaticContact CD1-CE2 3.86Å; F220-F224 HydrophobicContact CD1-CE2 3.86Å; F220-F224 HydrophobicContact CD2-CD2 4.05Å; F220-F224 AromaticContact CD2-CE2 3.6Å; F220-F224 HydrophobicContact CD2-CE2 3.6Å; F220-F224 AromaticContact CE1-CD2 3.37Å; F220-F224 HydrophobicContact CE1-CD2 3.37Å; F220-F224 AromaticContact CE1-CE2 3.3Å; F220-F224 HydrophobicContact CE1-CE2 3.3Å; F220-F224 HydrophobicContact CE1-CG 4.21Å; F220-F224 AromaticContact CE1-CZ 3.97Å; F220-F224 HydrophobicContact CE1-CZ 3.97Å; F220-F224 AromaticContact CE2-CD2 3.85Å; F220-F224 HydrophobicContact CE2-CD2 3.85Å; F220-F224 AromaticContact CE2-CE2 3.03Å; F220-F224 HydrophobicContact CE2-CE2 3.03Å; F220-F224 AromaticContact CE2-CZ 3.73Å; F220-F224 HydrophobicContact CE2-CZ 3.73Å; F220-F224 AromaticContact CG-CD2 3.98Å; F220-F224 HydrophobicContact CG-CD2 3.98Å; F220-F224 AromaticContact CG-CE2 4Å; F220-F224 HydrophobicContact CG-CE2 4Å; F220-F224 AromaticContact CZ-CD2 3.51Å; F220-F224 HydrophobicContact CZ-CD2 3.51Å; F220-F224 HydrophobicContact CZ-CE1 4.33Å; F220-F224 AromaticContact CZ-CE2 2.86Å; F220-F224 HydrophobicContact CZ-CE2 2.86Å; F220-F224 HydrophobicContact CZ-CG 4.49Å; F220-F224 AromaticContact CZ-CZ 3.32Å; F220-F224 HydrophobicContact CZ-CZ 3.32Å; F220-F224 WeakPolarHBondContact O-CD2 3.34Å; F220-F224 PolarHBondContact O-N 3.46Å; F220-F224 VanDerWaalsContact O-N 3.17Å; A221-F224 PolarHBondContact O-N 3.13Å; F224-A226 VanDerWaalsContact C-N 3.32Å; F224-A226 PolarHBondContact O-N 3.48Å; F224-E227 PolarHBondContact O-N 2.95Å; F224-Y228 AromaticContact CD1-CE2 3.99Å; F224-Y228 HydrophobicContact CD1-CE2 3.99Å; F224-Y228 WeakPolarHBondContact O-CD2 3.43Å; F224-Y228 PolarHBondContact O-N 3.44Å
225M92.6Very high92.1Very high33 Ų3317.1 Ų17.116%0.1639%0.092CC..Hα-helixtrans-59.6-44.7176.1-70.8-170-73.700110.9M17 F56 L79 A221 L222 F223 Y228 T229M17-M225 HydrophobicContact CE-CB 3.73Å; M17-M225 HydrophobicContact CE-CG 3.32Å; M17-M225 HydrophobicContact CE-SD 3.7Å; M17-M225 HydrophobicContact SD-CB 4.3Å; M17-M225 HydrophobicContact SD-CG 3.88Å; F56-M225 HydrophobicContact CZ-CE 4.14Å; L79-M225 HydrophobicContact CD1-CB 4.01Å; A221-M225 HydrophobicContact CB-CE 4.26Å; A221-M225 WeakPolarHBondContact O-CB 3.39Å; A221-M225 WeakPolarHBondContact O-CE 3.22Å; A221-M225 WeakPolarHBondContact O-CG 3.39Å; A221-M225 PolarHBondContact O-N 3.41Å; L222-M225 HydrophobicContact CD2-CE 3.75Å; L222-M225 HydrophobicContact CG-CE 4.33Å; F223-M225 VanDerWaalsContact C-N 3.32Å; F223-M225 PolarHBondContact O-N 3.22Å; M225-Y228 PolarHBondContact O-N 3.06Å; M225-T229 VanDerWaalsContact O-CG2 3.29Å; M225-T229 WeakPolarHBondContact O-CG2 3.32Å; M225-T229 PolarHBondContact O-N 3.24Å; M225-T229 PolarHBondContact O-OG1 3.39Å
226A93.9Very high92.5Very high4 Ų416.9 Ų16.93%0.0339%0.092CC..Hα-helixtrans-64.1-42.5178.400000113.3A78 A82 L222 F223 F224 T229 N230A78-A226 HydrophobicContact CB-CB 3.92Å; A82-A226 HydrophobicContact CB-CB 4.02Å; L222-A226 WeakPolarHBondContact O-CB 3.41Å; L222-A226 PolarHBondContact O-N 3.18Å; F223-A226 WeakPolarHBondContact O-CB 3.49Å; F223-A226 PolarHBondContact O-N 3.15Å; F223-A226 VanDerWaalsContact O-N 3.13Å; F224-A226 VanDerWaalsContact C-N 3.32Å; F224-A226 PolarHBondContact O-N 3.48Å; A226-T229 WeakPolarHBondContact CA-OG1 3.34Å; A226-T229 PolarHBondContact O-OG1 3.33Å; A226-N230 WeakPolarHBondContact O-CB 3.49Å; A226-N230 PolarHBondContact O-N 2.96Å; A226-N230 PolarHBondContact O-ND2 3.21Å
227E92.1Very high93Very high26 Ų2616.4 Ų16.412%0.1219%0.088CC..Hα-helixtrans-63.4-46.4177.3-73.9179.5-174.100111.6F223 F224 N230 I231F223-E227 WeakPolarHBondContact O-CG 3.43Å; F223-E227 PolarHBondContact O-N 3.45Å; F224-E227 PolarHBondContact O-N 2.95Å; E227-N230 WeakPolarHBondContact O-CB 3.4Å; E227-N230 PolarHBondContact O-N 3.36Å; E227-I231 WeakPolarHBondContact O-CG1 3.49Å; E227-I231 PolarHBondContact O-N 3.43Å
228Y93.2Very high93.4Very high19 Ų1916.5 Ų16.58%0.0759%0.088CC..Hα-helixtrans-69.1-36.2179.2-76.6-65000113.2M17 L20 M21 E24 R195 F224 M225 N230 I231 I232M17-Y228 VanDerWaalsContact CG-CB 3.45Å; M17-Y228 HydrophobicContact CG-CG 4.46Å; L20-Y228 HydrophobicContact CD2-CD1 3.2Å; L20-Y228 HydrophobicContact CD2-CE1 3.68Å; L20-Y228 HydrophobicContact CD2-CG 4.17Å; M21-Y228 HydrophobicContact CG-CD2 3.75Å; M21-Y228 HydrophobicContact CG-CE1 4.4Å; M21-Y228 HydrophobicContact CG-CE2 3.63Å; M21-Y228 HydrophobicContact CG-CG 4.27Å; M21-Y228 HydrophobicContact SD-CD2 4.11Å; M21-Y228 HydrophobicContact SD-CE2 4Å; E24-Y228 WeakPolarHBondContact OE2-CE1 3.28Å; E24-Y228 VanDerWaalsContact OE2-CZ 3.29Å; E24-Y228 PolarHBondContact OE2-OH 3.39Å; R195-Y228 PolarHBondContact NH2-OH 3.02Å; R195-Y228 VanDerWaalsContact NH2-OH 3.15Å; F224-Y228 AromaticContact CD1-CE2 3.99Å; F224-Y228 HydrophobicContact CD1-CE2 3.99Å; F224-Y228 WeakPolarHBondContact O-CD2 3.43Å; F224-Y228 PolarHBondContact O-N 3.44Å; M225-Y228 PolarHBondContact O-N 3.06Å; Y228-N230 VanDerWaalsContact C-N 3.3Å; Y228-I231 HydrophobicContact CD1-CD1 3.87Å; Y228-I231 HydrophobicContact CE1-CD1 4.29Å; Y228-I231 PolarHBondContact O-N 3.12Å; Y228-I232 WeakPolarHBondContact O-CG1 3.4Å; Y228-I232 PolarHBondContact O-N 3.49Å
229T95.3Very high93.8Very high0 Ų015.7 Ų15.70%08%0.08CC..Hα-helixtrans-65.2-37.4172.152.30000111I13 M17 A82 M225 A226 I232 M233I13-T229 HydrophobicContact CG2-CG2 3.93Å; M17-T229 HydrophobicContact CB-CG2 3.96Å; M17-T229 HydrophobicContact CG-CG2 4.08Å; A82-T229 VanDerWaalsContact CB-OG1 3.25Å; A82-T229 WeakPolarHBondContact CB-OG1 3.07Å; M225-T229 VanDerWaalsContact O-CG2 3.29Å; M225-T229 WeakPolarHBondContact O-CG2 3.32Å; M225-T229 PolarHBondContact O-N 3.24Å; M225-T229 PolarHBondContact O-OG1 3.39Å; A226-T229 WeakPolarHBondContact CA-OG1 3.34Å; A226-T229 PolarHBondContact O-OG1 3.33Å; T229-I232 PolarHBondContact O-N 3.48Å; T229-M233 WeakPolarHBondContact O-CB 3.42Å; T229-M233 PolarHBondContact O-N 3.13Å
230N94.6Very high94Very high32 Ų3214.2 Ų14.217%0.1717%0.07CC..Hα-helixtrans-64.7-36.4173.9-75-18.5000112.6A82 A226 E227 Y228 M233 M234A82-N230 WeakPolarHBondContact CA-OD1 3.48Å; A82-N230 VanDerWaalsContact CB-OD1 3.28Å; A82-N230 WeakPolarHBondContact CB-OD1 3.18Å; A226-N230 WeakPolarHBondContact O-CB 3.49Å; A226-N230 PolarHBondContact O-N 2.96Å; A226-N230 PolarHBondContact O-ND2 3.21Å; E227-N230 WeakPolarHBondContact O-CB 3.4Å; E227-N230 PolarHBondContact O-N 3.36Å; Y228-N230 VanDerWaalsContact C-N 3.3Å; N230-M233 PolarHBondContact O-N 3.39Å; N230-M234 WeakPolarHBondContact O-CB 3.44Å; N230-M234 WeakPolarHBondContact O-CG 3.4Å; N230-M234 PolarHBondContact O-N 2.85Å
231I94.8Very high94.3Very high6 Ų611.6 Ų11.63%0.0316%0.058CC..Hα-helixtrans-60.8-47.6174.5-69.3164.9000111.2T193 R195 E227 Y228 N235 F270T193-I231 HydrophobicContact CG2-CG1 4.18Å; R195-I231 HydrophobicContact CG-CD1 3.85Å; R195-I231 HydrophobicContact CG-CG1 4.17Å; R195-I231 VanDerWaalsContact NE-CD1 3.31Å; E227-I231 WeakPolarHBondContact O-CG1 3.49Å; E227-I231 PolarHBondContact O-N 3.43Å; Y228-I231 HydrophobicContact CD1-CD1 3.87Å; Y228-I231 HydrophobicContact CE1-CD1 4.29Å; Y228-I231 PolarHBondContact O-N 3.12Å; I231-N235 PolarHBondContact O-N 3.28Å; I231-N235 PolarHBondContact O-ND2 3.32Å; I231-F270 HydrophobicContact CG2-CD2 3.88Å; I231-F270 HydrophobicContact CG2-CE2 4.41Å
232I95.9Very high94.5Very high18 Ų1811.6 Ų11.69%0.0926%0.058CC..Hα-helixtrans-67.2-43.4179-54.8169.2000109.2A16 M17 L20 W86 Y228 T229 M234 N235 T236A16-I232 HydrophobicContact CB-CD1 4.3Å; M17-I232 HydrophobicContact CB-CD1 4.37Å; L20-I232 HydrophobicContact CB-CD1 4.31Å; L20-I232 HydrophobicContact CD1-CD1 3.97Å; L20-I232 HydrophobicContact CD1-CG1 3.59Å; W86-I232 HydrophobicContact CH2-CB 4.1Å; W86-I232 HydrophobicContact CH2-CG2 3.54Å; W86-I232 HydrophobicContact CZ2-CB 3.94Å; W86-I232 HydrophobicContact CZ2-CG2 3.93Å; Y228-I232 WeakPolarHBondContact O-CG1 3.4Å; Y228-I232 PolarHBondContact O-N 3.49Å; T229-I232 PolarHBondContact O-N 3.48Å; I232-M234 PolarHBondContact O-N 2.78Å; I232-N235 CarbonylContact O-C 3.31Å; I232-N235 PolarHBondContact O-N 3.2Å; I232-T236 HydrophobicContact CG2-CG2 4.2Å; I232-T236 VanDerWaalsContact O-CG2 3.26Å; I232-T236 WeakPolarHBondContact O-CG2 3.47Å; I232-T236 PolarHBondContact O-N 3.26Å; I232-T236 PolarHBondContact O-OG1 3.21Å
233M95.9Very high94.6Very high0 Ų011.2 Ų11.20%06%0.056CC..Hα-helixtrans-59.2-48.8-180-173-80.6-62.400111.9L85 W86 L89 T229 N230 N235 T236 L237L85-M233 HydrophobicContact CB-CE 3.83Å; L85-M233 HydrophobicContact CB-CG 3.86Å; L85-M233 HydrophobicContact CB-SD 3.95Å; L85-M233 HydrophobicContact CD1-CE 3.51Å; L85-M233 HydrophobicContact CD2-CE 4.1Å; L85-M233 HydrophobicContact CD2-SD 4.48Å; L85-M233 HydrophobicContact CG-CE 4.01Å; W86-M233 HydrophobicContact CD2-CG 4.48Å; W86-M233 HydrophobicContact CZ2-CB 3.9Å; L89-M233 HydrophobicContact CD1-CG 4.1Å; T229-M233 WeakPolarHBondContact O-CB 3.42Å; T229-M233 PolarHBondContact O-N 3.13Å; N230-M233 PolarHBondContact O-N 3.39Å; M233-N235 VanDerWaalsContact C-N 3.3Å; M233-N235 PolarHBondContact O-N 3.26Å; M233-T236 WeakPolarHBondContact CA-OG1 3.34Å; M233-T236 PolarHBondContact O-N 3.06Å; M233-T236 VanDerWaalsContact O-N 3.08Å; M233-T236 PolarHBondContact O-OG1 2.76Å; M233-L237 PolarHBondContact O-N 3.5Å
234M95.1Very high94.5Very high7 Ų711 Ų113%0.0346%0.055CC..Hα-helixtrans-61.9-39.7177.4-70.7-55.6179.200111.8T189 E192 T193 N230 I232 T236 L237 T238T189-M234 HydrophobicContact CG2-CB 4.43Å; T189-M234 HydrophobicContact CG2-SD 4.44Å; E192-M234 HydrophobicContact CG-CE 3.98Å; E192-M234 WeakPolarHBondContact OE1-CE 3.31Å; E192-M234 VanDerWaalsContact OE2-CE 3.25Å; E192-M234 WeakPolarHBondContact OE2-CE 3.35Å; T193-M234 HydrophobicContact CG2-CB 4.25Å; T193-M234 HydrophobicContact CG2-CG 3.79Å; N230-M234 WeakPolarHBondContact O-CB 3.44Å; N230-M234 WeakPolarHBondContact O-CG 3.4Å; N230-M234 PolarHBondContact O-N 2.85Å; I232-M234 PolarHBondContact O-N 2.78Å; M234-T236 VanDerWaalsContact C-N 3.35Å; M234-L237 PolarHBondContact O-N 2.8Å; M234-T238 WeakPolarHBondContact O-CG2 3.42Å; M234-T238 PolarHBondContact O-N 3.25Å
235N96.1Very high94.4Very high0 Ų09.7 Ų9.70%05%0.049CC..Hα-helixtrans-69.2-31.2175-75.8-58000113.1I231 I232 M233 T238 T239 L266 T267 F270I231-N235 PolarHBondContact O-N 3.28Å; I231-N235 PolarHBondContact O-ND2 3.32Å; I232-N235 CarbonylContact O-C 3.31Å; I232-N235 PolarHBondContact O-N 3.2Å; M233-N235 VanDerWaalsContact C-N 3.3Å; M233-N235 PolarHBondContact O-N 3.26Å; N235-T238 WeakPolarHBondContact CA-OG1 3.43Å; N235-T238 PolarHBondContact O-OG1 3.27Å; N235-T239 WeakPolarHBondContact O-CG2 3.42Å; N235-T239 PolarHBondContact O-N 3.44Å; N235-T239 VanDerWaalsContact O-N 3.16Å; N235-T239 PolarHBondContact O-OG1 3.3Å; N235-L266 HydrophobicContact CB-CB 4.31Å; N235-T267 HydrophobicContact CB-CG2 3.7Å; N235-F270 WeakPolarHBondContact ND2-CD2 3.19Å; N235-F270 VanDerWaalsContact OD1-CE1 3.28Å; N235-F270 WeakPolarHBondContact OD1-CE1 3.44Å
236T95.8Very high94.1Very high4 Ų412.5 Ų12.53%0.0257%0.069CC..Hα-helixtrans-66.9-43.1170.660.40000110.7W86 L89 I232 M233 M234 T238 T239 T240 F259 T263W86-T236 HydrophobicContact CH2-CG2 3.89Å; W86-T236 HydrophobicContact CZ3-CG2 3.94Å; L89-T236 WeakPolarHBondContact CD1-OG1 3.1Å; I232-T236 HydrophobicContact CG2-CG2 4.2Å; I232-T236 VanDerWaalsContact O-CG2 3.26Å; I232-T236 WeakPolarHBondContact O-CG2 3.47Å; I232-T236 PolarHBondContact O-N 3.26Å; I232-T236 PolarHBondContact O-OG1 3.21Å; M233-T236 WeakPolarHBondContact CA-OG1 3.34Å; M233-T236 PolarHBondContact O-N 3.06Å; M233-T236 VanDerWaalsContact O-N 3.08Å; M233-T236 PolarHBondContact O-OG1 2.76Å; M234-T236 VanDerWaalsContact C-N 3.35Å; T236-T238 PolarHBondContact O-N 3Å; T236-T239 PolarHBondContact O-N 3.34Å; T236-T239 PolarHBondContact O-OG1 3.14Å; T236-T240 WeakPolarHBondContact O-CG2 3.36Å; T236-T240 PolarHBondContact O-N 3.09Å; T236-F259 HydrophobicContact CG2-CE1 4.31Å; T236-T263 HydrophobicContact CG2-CG2 3.78Å
237L96.3Very high93.8Very high4 Ų416.8 Ų16.82%0.0219%0.085CC..Hα-helixtrans-65.2-42.7177.5-173.3128.5000112.3L89 I105 W185 M233 M234 T239 T240 I241L89-L237 HydrophobicContact CD2-CB 4.31Å; L89-L237 HydrophobicContact CD2-CD1 4.27Å; I105-L237 HydrophobicContact CB-CD1 4.39Å; I105-L237 HydrophobicContact CD1-CD1 3.28Å; I105-L237 HydrophobicContact CG1-CD1 4.39Å; I105-L237 HydrophobicContact CG2-CD1 3.7Å; W185-L237 HydrophobicContact CH2-CD2 3.52Å; W185-L237 HydrophobicContact CZ2-CD2 3.07Å; M233-L237 PolarHBondContact O-N 3.5Å; M234-L237 PolarHBondContact O-N 2.8Å; L237-T239 VanDerWaalsContact C-N 3.28Å; L237-T239 PolarHBondContact O-N 2.93Å; L237-T240 WeakPolarHBondContact CA-OG1 3.37Å; L237-T240 PolarHBondContact O-N 2.88Å; L237-T240 VanDerWaalsContact O-N 3.09Å; L237-T240 PolarHBondContact O-OG1 3.02Å; L237-I241 HydrophobicContact CD2-CD1 3.37Å; L237-I241 HydrophobicContact CD2-CG1 4.48Å; L237-I241 HydrophobicContact CG-CD1 3.82Å; L237-I241 HydrophobicContact CG-CG1 4.5Å; L237-I241 WeakPolarHBondContact O-CG1 3.42Å; L237-I241 PolarHBondContact O-N 3.26Å
238T96.8Very high93.4Very high5 Ų519.4 Ų19.43%0.03110%0.1CC..Hα-helixtrans-57.9-41.5174.765.40000111.1T189 M234 N235 T236 I241 F242 L266T189-T238 HydrophobicContact CG2-CG2 4.12Å; M234-T238 WeakPolarHBondContact O-CG2 3.42Å; M234-T238 PolarHBondContact O-N 3.25Å; N235-T238 WeakPolarHBondContact CA-OG1 3.43Å; N235-T238 PolarHBondContact O-OG1 3.27Å; T236-T238 PolarHBondContact O-N 3Å; T238-I241 PolarHBondContact O-N 3.48Å; T238-F242 PolarHBondContact O-N 3.01Å; T238-L266 WeakPolarHBondContact OG1-CD1 3.44Å
239T96.4Very high93Very high0 Ų022 Ų220%013%0.125CC..Hα-helixtrans-66.7-38.9174.457.30000113.2N235 T236 L237 I241 L243 G244 F259 K262 T263 L266N235-T239 WeakPolarHBondContact O-CG2 3.42Å; N235-T239 PolarHBondContact O-N 3.44Å; N235-T239 VanDerWaalsContact O-N 3.16Å; N235-T239 PolarHBondContact O-OG1 3.3Å; T236-T239 PolarHBondContact O-N 3.34Å; T236-T239 PolarHBondContact O-OG1 3.14Å; L237-T239 VanDerWaalsContact C-N 3.28Å; L237-T239 PolarHBondContact O-N 2.93Å; T239-I241 VanDerWaalsContact C-N 3.32Å; T239-I241 PolarHBondContact O-N 2.98Å; T239-L243 CarbonylContact O-C 3.52Å; T239-L243 WeakPolarHBondContact O-CA 3.31Å; T239-L243 PolarHBondContact O-N 2.87Å; T239-G244 PolarHBondContact O-N 3.37Å; T239-G244 VanDerWaalsContact O-N 3.14Å; T239-F259 WeakPolarHBondContact OG1-CE2 3.12Å; T239-F259 VanDerWaalsContact OG1-CZ 3.32Å; T239-F259 WeakPolarHBondContact OG1-CZ 3.25Å; T239-K262 HydrophobicContact CG2-CB 3.93Å; T239-T263 HydrophobicContact CG2-CG2 3.55Å; T239-T263 WeakPolarHBondContact OG1-CG2 3.46Å; T239-L266 HydrophobicContact CG2-CD1 3.5Å; T239-L266 HydrophobicContact CG2-CG 4.3Å
240T95.1Very high92.6Very high2 Ų229.6 Ų29.61%0.01217%0.165CC..Hα-helixtrans-63.2-38.5177.159.60000112.1P90 Q169 T236 L237 F259P90-T240 HydrophobicContact CG-CG2 4.07Å; Q169-T240 PolarHBondContact NE2-O 3.16Å; T236-T240 WeakPolarHBondContact O-CG2 3.36Å; T236-T240 PolarHBondContact O-N 3.09Å; L237-T240 WeakPolarHBondContact CA-OG1 3.37Å; L237-T240 PolarHBondContact O-N 2.88Å; L237-T240 VanDerWaalsContact O-N 3.09Å; L237-T240 PolarHBondContact O-OG1 3.02Å; T240-F259 HydrophobicContact CG2-CE2 3.46Å; T240-F259 VanDerWaalsContact CG2-CE2 3.46Å; T240-F259 HydrophobicContact CG2-CZ 3.6Å
241I95.6Very high92.3Very high0 Ų029.3 Ų29.30%017%0.166CC..Hα-helixtrans-79.8-42.7-175.5-63.6165.4000111.7L150 T153 L165 Q169 L174 W185 L237 T238 T239L150-I241 HydrophobicContact CD2-CD1 3.39Å; T153-I241 HydrophobicContact CG2-CG2 4.28Å; L165-I241 HydrophobicContact CD1-CG1 4.21Å; Q169-I241 PolarHBondContact NE2-O 3.03Å; L174-I241 WeakPolarHBondContact CB-O 3.28Å; L174-I241 HydrophobicContact CD2-CG2 4.31Å; L174-I241 VanDerWaalsContact CD2-O 3.26Å; L174-I241 WeakPolarHBondContact CD2-O 3.26Å; W185-I241 HydrophobicContact CH2-CD1 4.41Å; W185-I241 HydrophobicContact CZ2-CD1 4.19Å; L237-I241 HydrophobicContact CD2-CD1 3.37Å; L237-I241 HydrophobicContact CD2-CG1 4.48Å; L237-I241 HydrophobicContact CG-CD1 3.82Å; L237-I241 HydrophobicContact CG-CG1 4.5Å; L237-I241 WeakPolarHBondContact O-CG1 3.42Å; L237-I241 PolarHBondContact O-N 3.26Å; T238-I241 PolarHBondContact O-N 3.48Å; T239-I241 VanDerWaalsContact C-N 3.32Å; T239-I241 PolarHBondContact O-N 2.98Å
242F96Very high92Very high6 Ų631 Ų313%0.02618%0.177CC..Hα-helixtrans-111.8-28.4-168.9-66.3-73.8000114.9T153 Q169 L174 L175 S178 A182 W185 T238T153-F242 HydrophobicContact CG2-CE1 3.66Å; T153-F242 HydrophobicContact CG2-CZ 3.65Å; Q169-F242 VanDerWaalsContact OE1-C 3.3Å; Q169-F242 PolarHBondContact OE1-O 3.24Å; L174-F242 PolarHBondContact N-O 3.09Å; L175-F242 HydrophobicContact CB-CB 4.13Å; L175-F242 WeakPolarHBondContact CB-O 3.36Å; L175-F242 HydrophobicContact CD1-CB 4.49Å; L175-F242 PolarHBondContact N-O 2.88Å; S178-F242 VanDerWaalsContact OG-CE1 3.31Å; S178-F242 WeakPolarHBondContact OG-CE1 3.09Å; A182-F242 HydrophobicContact CB-CD1 3.54Å; A182-F242 HydrophobicContact CB-CD2 4.36Å; A182-F242 HydrophobicContact CB-CE1 3.6Å; A182-F242 HydrophobicContact CB-CE2 4.44Å; A182-F242 HydrophobicContact CB-CG 3.93Å; A182-F242 HydrophobicContact CB-CZ 4.06Å; W185-F242 HydrophobicContact CB-CE2 3.78Å; W185-F242 HydrophobicContact CB-CZ 4Å; W185-F242 AromaticContact CD1-CD2 3.89Å; W185-F242 AromaticContact CD1-CE2 3.37Å; W185-F242 AromaticContact CD2-CE2 3.99Å; W185-F242 HydrophobicContact CD2-CE2 3.99Å; W185-F242 HydrophobicContact CG-CD2 4.33Å; W185-F242 AromaticContact CG-CE2 3.39Å; W185-F242 HydrophobicContact CG-CE2 3.39Å; W185-F242 HydrophobicContact CG-CZ 4.05Å; W185-F242 AromaticContact NE1-CE2 3.93Å; T238-F242 PolarHBondContact O-N 3.01Å
243L94.6Very high91.8Very high30 Ų3036 Ų3616%0.15720%0.2CC..SBendtrans-125.441.4-170.6-65.8175.1000111.6W173 L175 T239 K262 L266W173-L243 HydrophobicContact CD2-CD2 4.35Å; W173-L243 HydrophobicContact CE3-CD2 4.1Å; L175-L243 HydrophobicContact CB-CD2 4.17Å; L175-L243 HydrophobicContact CD1-CD2 3.92Å; L175-L243 HydrophobicContact CD1-CG 4.26Å; T239-L243 CarbonylContact O-C 3.52Å; T239-L243 WeakPolarHBondContact O-CA 3.31Å; T239-L243 PolarHBondContact O-N 2.87Å; L243-K262 HydrophobicContact CB-CD 4.25Å; L243-K262 VanDerWaalsContact O-CD 3.32Å; L243-K262 WeakPolarHBondContact O-CD 3.38Å; L243-K262 PolarHBondContact O-NZ 3.38Å; L243-L266 HydrophobicContact CD1-CD1 4.25Å; L243-L266 HydrophobicContact CD1-CD2 4.49Å
244G89.1Confident91.6Very high1 Ų140.2 Ų40.21%0.0122%0.222CC..  trans-50150.7176.300000112.5W173 T239 K262W173-G244 PolarHBondContact NE1-O 3.06Å; T239-G244 PolarHBondContact O-N 3.37Å; T239-G244 VanDerWaalsContact O-N 3.14Å; G244-K262 PolarHBondContact O-NZ 2.82Å
245T88.4Confident91.4Very high6 Ų640 Ų404%0.03722%0.22CC..  trans-110.2147.9177.141.80000109.2Y247 Y255 K262T245-Y247 PolarHBondContact O-N 2.67Å; T245-Y255 WeakPolarHBondContact O-CD2 3.43Å; T245-Y255 WeakPolarHBondContact O-CE2 3.36Å; T245-Y255 WeakPolarHBondContact OG1-CD2 3.13Å; T245-Y255 WeakPolarHBondContact OG1-CE2 3.19Å; T245-Y255 VanDerWaalsContact OG1-CZ 3.32Å; T245-K262 HydrophobicContact CG2-CD 3.84Å
246T84.6Confident91.3Very high93 Ų9342.1 Ų42.157%0.57123%0.234SC*.  trans-64.613217649.90000109.6
247Y88.1Confident91.2Very high93 Ų9345.4 Ų45.437%0.36525%0.254SS..  trans-93.9117.3175.8175.3-106.5000109.7P92 T245 A249 P252P92-Y247 HydrophobicContact CB-CD2 3.56Å; P92-Y247 HydrophobicContact CB-CE2 3.64Å; P92-Y247 HydrophobicContact CG-CD2 4Å; P92-Y247 HydrophobicContact CG-CE2 3.66Å; T245-Y247 PolarHBondContact O-N 2.67Å; Y247-A249 HydrophobicContact CE1-CB 4.08Å; Y247-P252 HydrophobicContact CE2-CB 4.42Å
248D84.8Confident91.1Very high82 Ų8251.6 Ų51.644%0.43928%0.278SS..  trans-104.5121.6167.3-170.9-6.2000108.8L250 S251D248-L250 PolarHBondContact O-N 2.68Å; D248-L250 PolarHBondContact OD1-N 3.07Å; D248-S251 CarbonylContact O-C 3Å; D248-S251 PolarHBondContact O-N 2.92Å
249A83.4Confident91Very high74 Ų7451.4 Ų51.461%0.61228%0.277SS*.THydrogen-bonded Turntrans-65.3-24.6-176.500000113Y247Y247-A249 HydrophobicContact CE1-CB 4.08Å
250L86.9Confident91Very high159 Ų15954.5 Ų54.583%0.83230%0.295SS*.THydrogen-bonded Turntrans-76.8-25.4179.7-68.8169.6000112.8D248D248-L250 PolarHBondContact O-N 2.68Å; D248-L250 PolarHBondContact OD1-N 3.07Å
251S88.8Confident91Very high26 Ų2658.3 Ų58.318%0.18232%0.319CS..  trans-141.373.9-175.458.50000111.2D248 E253 L254D248-S251 CarbonylContact O-C 3Å; D248-S251 PolarHBondContact O-N 2.92Å; S251-E253 PolarHBondContact O-N 2.83Å; S251-E253 VanDerWaalsContact O-N 3.16Å; S251-L254 PolarHBondContact O-N 3.12Å; S251-L254 VanDerWaalsContact O-N 3.12Å; S251-L254 WeakPolarHBondContact OG-CD1 3.37Å
252P88.8Confident91Very high41 Ų4160.4 Ų60.427%0.26633%0.328SS..Hα-helixtrans-62.3-21.2179.626.8-35000112.8P92 Y247 L254 Y255 T256P92-P252 HydrophobicContact CG-CB 3.93Å; Y247-P252 HydrophobicContact CE2-CB 4.42Å; P252-L254 VanDerWaalsContact C-N 3.3Å; P252-L254 PolarHBondContact O-N 2.66Å; P252-Y255 WeakPolarHBondContact O-CB 3.42Å; P252-Y255 PolarHBondContact O-N 3.3Å; P252-T256 PolarHBondContact O-N 3.1Å
253E91.2Very high91Very high123 Ų12360.5 Ų60.558%0.57533%0.329SS*.Hα-helixtrans-67.4-28.8176.7-5581.8-173.700112.7S251 Y255 T256 T257S251-E253 PolarHBondContact O-N 2.83Å; S251-E253 VanDerWaalsContact O-N 3.16Å; E253-Y255 VanDerWaalsContact C-N 3.34Å; E253-T256 WeakPolarHBondContact CA-OG1 3.15Å; E253-T256 PolarHBondContact O-N 3.04Å; E253-T256 PolarHBondContact O-OG1 3.23Å; E253-T257 VanDerWaalsContact O-CG2 3.32Å; E253-T257 WeakPolarHBondContact O-CG2 3.46Å; E253-T257 PolarHBondContact O-N 3.24Å; E253-T257 PolarHBondContact O-OG1 3.42Å; E253-T257 VanDerWaalsContact O-OG1 3.07Å
254L91.5Very high91Very high89 Ų8964 Ų6447%0.46635%0.347SS..Hα-helixtrans-66.6-40.7175.3-67.3-176.4000110.6S251 P252 T256 T257 Y258S251-L254 PolarHBondContact O-N 3.12Å; S251-L254 VanDerWaalsContact O-N 3.12Å; S251-L254 WeakPolarHBondContact OG-CD1 3.37Å; P252-L254 VanDerWaalsContact C-N 3.3Å; P252-L254 PolarHBondContact O-N 2.66Å; L254-T256 PolarHBondContact O-N 3.17Å; L254-T257 WeakPolarHBondContact CA-OG1 3.25Å; L254-T257 PolarHBondContact O-N 3.35Å; L254-T257 PolarHBondContact O-OG1 3.13Å; L254-Y258 HydrophobicContact CB-CE2 4.35Å; L254-Y258 WeakPolarHBondContact O-CD2 3.26Å; L254-Y258 PolarHBondContact O-N 3.21Å; L254-Y258 VanDerWaalsContact O-N 3.08Å
255Y92.3Very high91.4Very high1 Ų169 Ų690%0.00437%0.373CS..Hα-helixtrans-58.2-50174179.2-81.1000110.7P92 I166 T245 P252 E253 T257 Y258 F259P92-Y255 HydrophobicContact CB-CD1 3.51Å; P92-Y255 HydrophobicContact CB-CD2 4.38Å; P92-Y255 HydrophobicContact CB-CE1 3.89Å; P92-Y255 HydrophobicContact CB-CG 3.81Å; P92-Y255 HydrophobicContact CG-CD1 4.12Å; P92-Y255 HydrophobicContact CG-CG 4.41Å; I166-Y255 HydrophobicContact CD1-CE1 4.45Å; I166-Y255 HydrophobicContact CD1-CE2 3.92Å; I166-Y255 VanDerWaalsContact CD1-OH 3.24Å; I166-Y255 WeakPolarHBondContact CD1-OH 3.35Å; I166-Y255 HydrophobicContact CG1-CE2 4.14Å; I166-Y255 WeakPolarHBondContact CG1-OH 3.47Å; I166-Y255 HydrophobicContact CG2-CE2 3.76Å; T245-Y255 WeakPolarHBondContact O-CD2 3.43Å; T245-Y255 WeakPolarHBondContact O-CE2 3.36Å; T245-Y255 WeakPolarHBondContact OG1-CD2 3.13Å; T245-Y255 WeakPolarHBondContact OG1-CE2 3.19Å; T245-Y255 VanDerWaalsContact OG1-CZ 3.32Å; P252-Y255 WeakPolarHBondContact O-CB 3.42Å; P252-Y255 PolarHBondContact O-N 3.3Å; E253-Y255 VanDerWaalsContact C-N 3.34Å; Y255-T257 VanDerWaalsContact C-N 3.34Å; Y255-T257 PolarHBondContact O-N 3.09Å; Y255-Y258 PolarHBondContact O-N 3.31Å; Y255-F259 HydrophobicContact CD1-CB 4.35Å; Y255-F259 HydrophobicContact CE1-CB 4.08Å; Y255-F259 HydrophobicContact CE1-CD2 4.37Å; Y255-F259 HydrophobicContact CE1-CG 4.23Å; Y255-F259 WeakPolarHBondContact O-CB 3.3Å; Y255-F259 PolarHBondContact O-N 3.16Å
256T93.4Very high91.7Very high45 Ų4569.6 Ų69.628%0.27638%0.376SS..Hα-helixtrans-63.6-39.4-17760.40000112.1P92 P252 E253 L254 F259 V260P92-T256 VanDerWaalsContact CD-CG2 3.41Å; P252-T256 PolarHBondContact O-N 3.1Å; E253-T256 WeakPolarHBondContact CA-OG1 3.15Å; E253-T256 PolarHBondContact O-N 3.04Å; E253-T256 PolarHBondContact O-OG1 3.23Å; L254-T256 PolarHBondContact O-N 3.17Å; T256-F259 PolarHBondContact O-N 3.2Å; T256-V260 VanDerWaalsContact O-CB 3.31Å; T256-V260 WeakPolarHBondContact O-CB 3.47Å; T256-V260 WeakPolarHBondContact O-CG2 3.36Å; T256-V260 PolarHBondContact O-N 3.36Å
257T93.1Very high92.2Very high73 Ų7365.6 Ų65.645%0.44835%0.351SS..Hα-helixtrans-66.6-45178.453.50000112.6E253 L254 Y255 T261E253-T257 VanDerWaalsContact O-CG2 3.32Å; E253-T257 WeakPolarHBondContact O-CG2 3.46Å; E253-T257 PolarHBondContact O-N 3.24Å; E253-T257 PolarHBondContact O-OG1 3.42Å; E253-T257 VanDerWaalsContact O-OG1 3.07Å; L254-T257 WeakPolarHBondContact CA-OG1 3.25Å; L254-T257 PolarHBondContact O-N 3.35Å; L254-T257 PolarHBondContact O-OG1 3.13Å; Y255-T257 VanDerWaalsContact C-N 3.34Å; Y255-T257 PolarHBondContact O-N 3.09Å; T257-T261 WeakPolarHBondContact O-CB 3.44Å; T257-T261 VanDerWaalsContact O-CG2 3.27Å; T257-T261 WeakPolarHBondContact O-CG2 3.45Å; T257-T261 PolarHBondContact O-N 3.4Å; T257-T261 PolarHBondContact O-OG1 2.89Å
258Y94.3Very high92.4Very high135 Ų13563.6 Ų63.653%0.52935%0.351SS..Hα-helixtrans-66.7-38.3175.2-69.9-57000112.4L254 Y255 T261 K262L254-Y258 HydrophobicContact CB-CE2 4.35Å; L254-Y258 WeakPolarHBondContact O-CD2 3.26Å; L254-Y258 PolarHBondContact O-N 3.21Å; L254-Y258 VanDerWaalsContact O-N 3.08Å; Y255-Y258 PolarHBondContact O-N 3.31Å; Y258-T261 WeakPolarHBondContact CA-OG1 3.33Å; Y258-T261 PolarHBondContact O-OG1 3.34Å; Y258-K262 WeakPolarHBondContact O-CG 3.33Å; Y258-K262 PolarHBondContact O-N 3.2Å; Y258-K262 VanDerWaalsContact O-N 3.12Å
259F95.4Very high92.9Very high1 Ų162.3 Ų62.30%0.00434%0.344CS..Hα-helixtrans-62.6-50.7176-178.4-101.4000111M91 T236 T239 T240 Y255 T256 T261 K262 T263M91-F259 HydrophobicContact CG-CD1 4.08Å; M91-F259 HydrophobicContact CG-CE1 3.78Å; M91-F259 HydrophobicContact SD-CE1 4.22Å; T236-F259 HydrophobicContact CG2-CE1 4.31Å; T239-F259 WeakPolarHBondContact OG1-CE2 3.12Å; T239-F259 VanDerWaalsContact OG1-CZ 3.32Å; T239-F259 WeakPolarHBondContact OG1-CZ 3.25Å; T240-F259 HydrophobicContact CG2-CE2 3.46Å; T240-F259 VanDerWaalsContact CG2-CE2 3.46Å; T240-F259 HydrophobicContact CG2-CZ 3.6Å; Y255-F259 HydrophobicContact CD1-CB 4.35Å; Y255-F259 HydrophobicContact CE1-CB 4.08Å; Y255-F259 HydrophobicContact CE1-CD2 4.37Å; Y255-F259 HydrophobicContact CE1-CG 4.23Å; Y255-F259 WeakPolarHBondContact O-CB 3.3Å; Y255-F259 PolarHBondContact O-N 3.16Å; T256-F259 PolarHBondContact O-N 3.2Å; F259-T261 PolarHBondContact O-N 3.31Å; F259-K262 PolarHBondContact O-N 3.06Å; F259-T263 HydrophobicContact CD1-CG2 4.29Å; F259-T263 HydrophobicContact CE1-CG2 3.95Å; F259-T263 HydrophobicContact CE2-CG2 4.42Å; F259-T263 HydrophobicContact CZ-CG2 4.02Å; F259-T263 WeakPolarHBondContact O-CG2 3.26Å; F259-T263 PolarHBondContact O-N 3.37Å; F259-T263 PolarHBondContact O-OG1 3.25Å
260V95.1Very high93.4Very high65 Ų6559.2 Ų59.239%0.39432%0.317SS..Hα-helixtrans-64-38.3180171.40000112.1T256 T263 L264T256-V260 VanDerWaalsContact O-CB 3.31Å; T256-V260 WeakPolarHBondContact O-CB 3.47Å; T256-V260 WeakPolarHBondContact O-CG2 3.36Å; T256-V260 PolarHBondContact O-N 3.36Å; V260-T263 WeakPolarHBondContact CA-OG1 3.4Å; V260-T263 PolarHBondContact O-N 3.33Å; V260-T263 PolarHBondContact O-OG1 3.11Å; V260-L264 HydrophobicContact CG1-CD1 3.91Å; V260-L264 HydrophobicContact CG1-CG 4.26Å; V260-L264 WeakPolarHBondContact O-CB 3.25Å; V260-L264 VanDerWaalsContact O-CG 3.24Å; V260-L264 WeakPolarHBondContact O-CG 3.44Å; V260-L264 PolarHBondContact O-N 3.03Å
261T95.3Very high93.6Very high82 Ų8252.1 Ų52.150%0.50328%0.28SS..Hα-helixtrans-65.5-40.2176.750.10000112T257 Y258 F259 L265T257-T261 WeakPolarHBondContact O-CB 3.44Å; T257-T261 VanDerWaalsContact O-CG2 3.27Å; T257-T261 WeakPolarHBondContact O-CG2 3.45Å; T257-T261 PolarHBondContact O-N 3.4Å; T257-T261 PolarHBondContact O-OG1 2.89Å; Y258-T261 WeakPolarHBondContact CA-OG1 3.33Å; Y258-T261 PolarHBondContact O-OG1 3.34Å; F259-T261 PolarHBondContact O-N 3.31Å; T261-L265 PolarHBondContact O-N 3.42Å
262K96.1Very high93.9Very high43 Ų4357.7 Ų57.719%0.18730%0.297CS..Hα-helixtrans-64.5-42.4173.8-73.2173.7170.4-174.20112.2T239 L243 G244 T245 Y258 F259 L265 L266T239-K262 HydrophobicContact CG2-CB 3.93Å; L243-K262 HydrophobicContact CB-CD 4.25Å; L243-K262 VanDerWaalsContact O-CD 3.32Å; L243-K262 WeakPolarHBondContact O-CD 3.38Å; L243-K262 PolarHBondContact O-NZ 3.38Å; G244-K262 PolarHBondContact O-NZ 2.82Å; T245-K262 HydrophobicContact CG2-CD 3.84Å; Y258-K262 WeakPolarHBondContact O-CG 3.33Å; Y258-K262 PolarHBondContact O-N 3.2Å; Y258-K262 VanDerWaalsContact O-N 3.12Å; F259-K262 PolarHBondContact O-N 3.06Å; K262-L265 WeakPolarHBondContact O-CB 3.41Å; K262-L265 PolarHBondContact O-N 2.6Å; K262-L266 PolarHBondContact O-N 3.31Å
263T96.1Very high94.1Very high9 Ų956.7 Ų56.76%0.05529%0.289CS..Hα-helixtrans-65.7-42.4178.158.50000111.4T236 T239 F259 V260 L265 L266 T267T236-T263 HydrophobicContact CG2-CG2 3.78Å; T239-T263 HydrophobicContact CG2-CG2 3.55Å; T239-T263 WeakPolarHBondContact OG1-CG2 3.46Å; F259-T263 HydrophobicContact CD1-CG2 4.29Å; F259-T263 HydrophobicContact CE1-CG2 3.95Å; F259-T263 HydrophobicContact CE2-CG2 4.42Å; F259-T263 HydrophobicContact CZ-CG2 4.02Å; F259-T263 WeakPolarHBondContact O-CG2 3.26Å; F259-T263 PolarHBondContact O-N 3.37Å; F259-T263 PolarHBondContact O-OG1 3.25Å; V260-T263 WeakPolarHBondContact CA-OG1 3.4Å; V260-T263 PolarHBondContact O-N 3.33Å; V260-T263 PolarHBondContact O-OG1 3.11Å; T263-L265 VanDerWaalsContact C-N 3.29Å; T263-L265 PolarHBondContact O-N 3.11Å; T263-L266 PolarHBondContact O-N 3.11Å; T263-T267 WeakPolarHBondContact O-CG2 3.42Å; T263-T267 PolarHBondContact O-N 3.45Å; T263-T267 PolarHBondContact O-OG1 3.43Å
264L95.6Very high94Very high103 Ų10354.3 Ų54.354%0.53928%0.275SS..Hα-helixtrans-60.4-39.6174.2-72.6173.8000111.7V260 T267 S268V260-L264 HydrophobicContact CG1-CD1 3.91Å; V260-L264 HydrophobicContact CG1-CG 4.26Å; V260-L264 WeakPolarHBondContact O-CB 3.25Å; V260-L264 VanDerWaalsContact O-CG 3.24Å; V260-L264 WeakPolarHBondContact O-CG 3.44Å; V260-L264 PolarHBondContact O-N 3.03Å; L264-T267 WeakPolarHBondContact CA-OG1 3.14Å; L264-T267 PolarHBondContact O-N 2.89Å; L264-T267 PolarHBondContact O-OG1 3.37Å; L264-S268 WeakPolarHBondContact O-CB 3.23Å; L264-S268 PolarHBondContact O-N 2.99Å
265L95.9Very high93.9Very high105 Ų10552.1 Ų52.155%0.5527%0.265SS..Hα-helixtrans-61.4-47.6174.3-171153.7000111.3T261 K262 T263 T267 S268 L269T261-L265 PolarHBondContact O-N 3.42Å; K262-L265 WeakPolarHBondContact O-CB 3.41Å; K262-L265 PolarHBondContact O-N 2.6Å; T263-L265 VanDerWaalsContact C-N 3.29Å; T263-L265 PolarHBondContact O-N 3.11Å; L265-T267 PolarHBondContact O-N 2.84Å; L265-S268 PolarHBondContact O-N 3.14Å; L265-S268 PolarHBondContact O-OG 2.88Å; L265-L269 HydrophobicContact CD2-CD1 4.49Å; L265-L269 PolarHBondContact O-N 2.99Å
266L95.7Very high93.8Very high19 Ų1954.7 Ų54.710%0.09929%0.287CS..Hα-helixtrans-64-40.4177.4-69.4-176000112.9F186 N235 T238 T239 L243 K262 T263 S268 L269 F270F186-L266 HydrophobicContact CE2-CD2 4.21Å; N235-L266 HydrophobicContact CB-CB 4.31Å; T238-L266 WeakPolarHBondContact OG1-CD1 3.44Å; T239-L266 HydrophobicContact CG2-CD1 3.5Å; T239-L266 HydrophobicContact CG2-CG 4.3Å; L243-L266 HydrophobicContact CD1-CD1 4.25Å; L243-L266 HydrophobicContact CD1-CD2 4.49Å; K262-L266 PolarHBondContact O-N 3.31Å; T263-L266 PolarHBondContact O-N 3.11Å; L266-S268 VanDerWaalsContact C-N 3.3Å; L266-S268 PolarHBondContact O-N 2.93Å; L266-L269 WeakPolarHBondContact O-CA 3.44Å; L266-L269 VanDerWaalsContact O-CB 3.25Å; L266-L269 WeakPolarHBondContact O-CB 3.45Å; L266-L269 PolarHBondContact O-N 2.98Å; L266-F270 PolarHBondContact O-N 2.88Å
267T94.8Very high93.6Very high9 Ų959.5 Ų59.56%0.05530%0.301CS..Hα-helixtrans-62.9-37.417462.10000111.6L20 N235 T263 L264 L265 L269 F270 L271L20-T267 HydrophobicContact CD1-CG2 4.37Å; N235-T267 HydrophobicContact CB-CG2 3.7Å; T263-T267 WeakPolarHBondContact O-CG2 3.42Å; T263-T267 PolarHBondContact O-N 3.45Å; T263-T267 PolarHBondContact O-OG1 3.43Å; L264-T267 WeakPolarHBondContact CA-OG1 3.14Å; L264-T267 PolarHBondContact O-N 2.89Å; L264-T267 PolarHBondContact O-OG1 3.37Å; L265-T267 PolarHBondContact O-N 2.84Å; T267-L269 VanDerWaalsContact C-N 3.26Å; T267-L269 PolarHBondContact O-N 3.39Å; T267-F270 WeakPolarHBondContact O-CB 3.36Å; T267-F270 PolarHBondContact O-N 3.16Å; T267-L271 WeakPolarHBondContact O-CG 3.44Å; T267-L271 PolarHBondContact O-N 3.41Å; T267-L271 VanDerWaalsContact O-N 3.09Å
268S93.1Very high93.4Very high51 Ų5161 Ų6136%0.35731%0.312SS..Hα-helixtrans-65.2-32.2173.678.80000112.3L264 L265 L266 L271 W272L264-S268 WeakPolarHBondContact O-CB 3.23Å; L264-S268 PolarHBondContact O-N 2.99Å; L265-S268 PolarHBondContact O-N 3.14Å; L265-S268 PolarHBondContact O-OG 2.88Å; L266-S268 VanDerWaalsContact C-N 3.3Å; L266-S268 PolarHBondContact O-N 2.93Å; S268-L271 PolarHBondContact O-N 3.16Å; S268-W272 WeakPolarHBondContact O-CB 3.46Å; S268-W272 PolarHBondContact O-N 3.22Å
269L94.4Very high93.1Very high55 Ų5558.6 Ų58.629%0.28830%0.302SS..Hα-helixtrans-68.4-40.9174.6-135.3165.9000111.2F186 L265 L266 T267 L271 W272 I273F186-L269 HydrophobicContact CE1-CD2 4.4Å; F186-L269 HydrophobicContact CZ-CB 4.33Å; F186-L269 HydrophobicContact CZ-CD2 4.17Å; L265-L269 HydrophobicContact CD2-CD1 4.49Å; L265-L269 PolarHBondContact O-N 2.99Å; L266-L269 WeakPolarHBondContact O-CA 3.44Å; L266-L269 VanDerWaalsContact O-CB 3.25Å; L266-L269 WeakPolarHBondContact O-CB 3.45Å; L266-L269 PolarHBondContact O-N 2.98Å; T267-L269 VanDerWaalsContact C-N 3.26Å; T267-L269 PolarHBondContact O-N 3.39Å; L269-L271 VanDerWaalsContact C-N 3.32Å; L269-L271 PolarHBondContact O-N 3.34Å; L269-W272 HydrophobicContact CD2-CE3 3.96Å; L269-W272 HydrophobicContact CD2-CZ3 4.38Å; L269-W272 HydrophobicContact CG-CE3 4.4Å; L269-W272 PolarHBondContact O-N 2.98Å; L269-I273 HydrophobicContact CD2-CD1 3.71Å; L269-I273 HydrophobicContact CD2-CG1 4.09Å; L269-I273 VanDerWaalsContact O-CG1 3.31Å; L269-I273 WeakPolarHBondContact O-CG1 3.42Å; L269-I273 PolarHBondContact O-N 3.41Å
270F93.2Very high92.6Very high9 Ų962.1 Ų62.14%0.03932%0.317CS..Hα-helixtrans-55.4-47.5169.7-93.941.5000111.5F186 L190 I231 N235 L266 T267 W272 I273 R274F186-F270 AromaticContact CD2-CE1 3.95Å; F186-F270 HydrophobicContact CD2-CE1 3.95Å; F186-F270 HydrophobicContact CE1-CD1 4.42Å; F186-F270 HydrophobicContact CE1-CE1 4.31Å; F186-F270 AromaticContact CE2-CD1 3.64Å; F186-F270 HydrophobicContact CE2-CD1 3.64Å; F186-F270 AromaticContact CE2-CE1 3.34Å; F186-F270 HydrophobicContact CE2-CE1 3.34Å; F186-F270 AromaticContact CZ-CD1 3.5Å; F186-F270 HydrophobicContact CZ-CD1 3.5Å; F186-F270 AromaticContact CZ-CE1 3.55Å; F186-F270 HydrophobicContact CZ-CE1 3.55Å; L190-F270 HydrophobicContact CD2-CB 4.42Å; L190-F270 HydrophobicContact CD2-CD1 3.71Å; L190-F270 HydrophobicContact CD2-CD2 3.72Å; L190-F270 HydrophobicContact CD2-CE1 3.75Å; L190-F270 HydrophobicContact CD2-CE2 3.8Å; L190-F270 HydrophobicContact CD2-CG 3.68Å; L190-F270 HydrophobicContact CD2-CZ 3.8Å; L190-F270 HydrophobicContact CG-CD1 4.16Å; L190-F270 HydrophobicContact CG-CE1 3.74Å; L190-F270 HydrophobicContact CG-CE2 4.25Å; L190-F270 HydrophobicContact CG-CZ 3.79Å; I231-F270 HydrophobicContact CG2-CD2 3.88Å; I231-F270 HydrophobicContact CG2-CE2 4.41Å; N235-F270 WeakPolarHBondContact ND2-CD2 3.19Å; N235-F270 VanDerWaalsContact OD1-CE1 3.28Å; N235-F270 WeakPolarHBondContact OD1-CE1 3.44Å; L266-F270 PolarHBondContact O-N 2.88Å; T267-F270 WeakPolarHBondContact O-CB 3.36Å; T267-F270 PolarHBondContact O-N 3.16Å; F270-W272 VanDerWaalsContact C-N 3.33Å; F270-W272 PolarHBondContact O-N 3Å; F270-I273 PolarHBondContact O-N 3.27Å; F270-R274 PolarHBondContact O-N 3.44Å; F270-R274 VanDerWaalsContact O-N 3.16Å
271L92.7Very high92.2Very high11 Ų1166.4 Ų66.46%0.05833%0.326CS..Hα-helixtrans-65.9-36.5179.2-63.3176.4000112.1E24 I27 T267 S268 L269 R274 T275E24-L271 HydrophobicContact CB-CD1 4.24Å; E24-L271 HydrophobicContact CB-CD2 3.66Å; E24-L271 HydrophobicContact CG-CD2 3.65Å; I27-L271 HydrophobicContact CD1-CD1 3.62Å; I27-L271 HydrophobicContact CG2-CB 4.2Å; T267-L271 WeakPolarHBondContact O-CG 3.44Å; T267-L271 PolarHBondContact O-N 3.41Å; T267-L271 VanDerWaalsContact O-N 3.09Å; S268-L271 PolarHBondContact O-N 3.16Å; L269-L271 VanDerWaalsContact C-N 3.32Å; L269-L271 PolarHBondContact O-N 3.34Å; L271-R274 WeakPolarHBondContact O-CB 3.46Å; L271-R274 PolarHBondContact O-N 3.37Å; L271-T275 PolarHBondContact O-N 2.76Å
272W93.4Very high91.7Very high143 Ų14365.4 Ų65.454%0.54231%0.314SS..Hα-helixtrans-66.2-45.2175.7-179.339.3000112.1M31 S268 L269 F270 R274 T275 A276M31-W272 HydrophobicContact CE-CB 3.79Å; M31-W272 HydrophobicContact CE-CG 3.79Å; S268-W272 WeakPolarHBondContact O-CB 3.46Å; S268-W272 PolarHBondContact O-N 3.22Å; L269-W272 HydrophobicContact CD2-CE3 3.96Å; L269-W272 HydrophobicContact CD2-CZ3 4.38Å; L269-W272 HydrophobicContact CG-CE3 4.4Å; L269-W272 PolarHBondContact O-N 2.98Å; F270-W272 VanDerWaalsContact C-N 3.33Å; F270-W272 PolarHBondContact O-N 3Å; W272-R274 VanDerWaalsContact C-N 3.25Å; W272-R274 PolarHBondContact O-N 3.49Å; W272-T275 PolarHBondContact O-N 3.2Å; W272-T275 PolarHBondContact O-OG1 3.33Å; W272-A276 PolarHBondContact O-N 2.8Å; W272-A276 VanDerWaalsContact O-N 3.12Å
273I93.2Very high91.2Very high20 Ų2067.2 Ų67.210%0.10333%0.326CS..Hα-helixtrans-57.9-40.8177.8-73.6168.9000111.1F186 L190 L269 F270 T275 A276 Y277F186-I273 HydrophobicContact CE1-CD1 3.43Å; F186-I273 VanDerWaalsContact CE1-CD1 3.43Å; F186-I273 HydrophobicContact CZ-CD1 3.98Å; L190-I273 HydrophobicContact CD1-CD1 3.89Å; L190-I273 HydrophobicContact CD1-CG2 4.22Å; L269-I273 HydrophobicContact CD2-CD1 3.71Å; L269-I273 HydrophobicContact CD2-CG1 4.09Å; L269-I273 VanDerWaalsContact O-CG1 3.31Å; L269-I273 WeakPolarHBondContact O-CG1 3.42Å; L269-I273 PolarHBondContact O-N 3.41Å; F270-I273 PolarHBondContact O-N 3.27Å; I273-T275 PolarHBondContact O-N 2.92Å; I273-A276 PolarHBondContact O-N 3.47Å; I273-A276 VanDerWaalsContact O-N 3.15Å; I273-Y277 HydrophobicContact CB-CD2 4.39Å; I273-Y277 HydrophobicContact CG1-CE2 4.36Å; I273-Y277 HydrophobicContact CG2-CD2 3.85Å; I273-Y277 HydrophobicContact CG2-CE2 4.38Å; I273-Y277 PolarHBondContact O-N 2.81Å
274R89.4Confident91Very high73 Ų7372 Ų7228%0.27535%0.347SS..Hα-helixtrans-56-36.1173.3165.7164.5-164.7171.712.8113.2E24 L28 T196 F270 L271 W272E24-R274 WeakPolarHBondContact OE1-CD 3.5Å; E24-R274 IonicContact OE1-CZ 3.89Å; E24-R274 IonicContact OE1-NE 3.55Å; E24-R274 IonicContact OE1-NH1 2.82Å; E24-R274 PolarHBondContact OE1-NH1 3.46Å; E24-R274 IonicContact OE2-NH1 3.79Å; L28-R274 HydrophobicContact CD2-CG 4.02Å; T196-R274 WeakPolarHBondContact OG1-CA 3.39Å; T196-R274 WeakPolarHBondContact OG1-CB 3.41Å; T196-R274 WeakPolarHBondContact OG1-CG 3.43Å; F270-R274 PolarHBondContact O-N 3.44Å; F270-R274 VanDerWaalsContact O-N 3.16Å; L271-R274 WeakPolarHBondContact O-CB 3.46Å; L271-R274 PolarHBondContact O-N 3.37Å; W272-R274 VanDerWaalsContact C-N 3.25Å; W272-R274 PolarHBondContact O-N 3.49Å
275T89.2Confident90.6Very high42 Ų4267 Ų6726%0.25832%0.321SS..Hα-helixtrans-80-27178.262.20000114.2L28 M31 L271 W272 I273L28-T275 HydrophobicContact CD2-CG2 3.31Å; L28-T275 HydrophobicContact CG-CG2 4.21Å; M31-T275 HydrophobicContact CB-CG2 3.94Å; M31-T275 HydrophobicContact CG-CG2 4.35Å; M31-T275 HydrophobicContact SD-CG2 3.49Å; M31-T275 WeakPolarHBondContact SD-CG2 3.49Å; M31-T275 PolarHBondContact SD-OG1 3.4Å; L271-T275 PolarHBondContact O-N 2.76Å; W272-T275 PolarHBondContact O-N 3.2Å; W272-T275 PolarHBondContact O-OG1 3.33Å; I273-T275 PolarHBondContact O-N 2.92Å
276A90.2Very high90.4Very high56 Ų5664.1 Ų64.146%0.46331%0.305SS..Hα-helixtrans-90.5-34.6-168.200000113.1W272 I273W272-A276 PolarHBondContact O-N 2.8Å; W272-A276 VanDerWaalsContact O-N 3.12Å; I273-A276 PolarHBondContact O-N 3.47Å; I273-A276 VanDerWaalsContact O-N 3.15Å
277Y90.5Very high90.3Very high146 Ų14667.1 Ų67.157%0.57332%0.319SS*.  trans-109.6143-168.7-65.8-74.3000113.9I273I273-Y277 HydrophobicContact CB-CD2 4.39Å; I273-Y277 HydrophobicContact CG1-CE2 4.36Å; I273-Y277 HydrophobicContact CG2-CD2 3.85Å; I273-Y277 HydrophobicContact CG2-CE2 4.38Å; I273-Y277 PolarHBondContact O-N 2.81Å
278P88.1Confident90.2Very high104 Ų10468.4 Ų68.468%0.67533%0.325SS*.PPolyproline II helixtrans-71.8161.3169.532.3-34.8000111.2P197P197-P278 WeakPolarHBondContact CB-O 3.38Å
279R87.1Confident90.2Very high84 Ų8466.1 Ų66.132%0.31731%0.309SS..PPolyproline II helixtrans-65.9141.9174.9-71.4179.5170.4154.3-3.4111.3T196 P197 D199T196-R279 HydrophobicContact CG2-CG 4.19Å; P197-R279 WeakPolarHBondContact O-CA 3.49Å; D199-R279 IonicContact OD2-CZ 2.87Å; D199-R279 IonicContact OD2-NE 3.55Å; D199-R279 IonicContact OD2-NH2 3.84Å; D199-R279 PolarHBondContact OD2-NH2 2.98Å
280F85.8Confident90.1Very high76 Ų7669.3 Ų69.333%0.33332%0.317SS..PPolyproline II helixtrans-77.6152.8168.6-81-78.4000111.1P197 F198 L200 Q284P197-F280 HydrophobicContact CB-CD2 3.64Å; P197-F280 HydrophobicContact CB-CE2 3.89Å; P197-F280 HydrophobicContact CG-CD2 3.82Å; P197-F280 HydrophobicContact CG-CE2 3.75Å; P197-F280 PolarHBondContact O-N 2.85Å; F198-F280 HydrophobicContact CD1-CB 4.45Å; F198-F280 AromaticContact CD1-CD2 3.77Å; F198-F280 HydrophobicContact CD1-CD2 3.77Å; F198-F280 HydrophobicContact CD1-CE2 4.49Å; F198-F280 HydrophobicContact CD1-CG 4.39Å; F198-F280 AromaticContact CE1-CD2 3.38Å; F198-F280 HydrophobicContact CE1-CD2 3.38Å; F198-F280 AromaticContact CE1-CE2 3.71Å; F198-F280 HydrophobicContact CE1-CE2 3.71Å; F198-F280 HydrophobicContact CE1-CG 4.12Å; F198-F280 HydrophobicContact CZ-CD2 4.09Å; F198-F280 AromaticContact CZ-CE2 4Å; F198-F280 HydrophobicContact CZ-CE2 4Å; L200-F280 WeakPolarHBondContact CD2-O 3.46Å; F280-Q284 HydrophobicContact CD1-CB 4.07Å
281R86.1Confident90.2Very high155 Ų15575.1 Ų75.159%0.58534%0.342SS*.PPolyproline II helixtrans-78.9147.9163.2-178.5173.9162.8165.9-1.6109.9D283 Q284 L285R281-D283 VanDerWaalsContact C-N 3.28Å; R281-D283 IonicContact CZ-OD2 3.14Å; R281-D283 IonicContact NE-OD2 2.8Å; R281-D283 PolarHBondContact NE-OD2 2.92Å; R281-D283 IonicContact NH2-OD2 2.76Å; R281-D283 PolarHBondContact NH2-OD2 3.22Å; R281-D283 PolarHBondContact O-N 3.4Å; R281-Q284 HydrophobicContact CB-CG 4.24Å; R281-Q284 WeakPolarHBondContact O-CB 3.37Å; R281-Q284 PolarHBondContact O-N 2.8Å; R281-L285 PolarHBondContact O-N 2.89Å
282Y84.6Confident90.3Very high60 Ų6078.5 Ų78.524%0.23536%0.36CS..Hα-helixtrans-49.2-45.6177.6177.4-94000113.5R134 A137 L200 Q284 L285 M286R134-Y282 HydrophobicContact CB-CD2 4.46Å; R134-Y282 HydrophobicContact CB-CE2 4.47Å; R134-Y282 HydrophobicContact CG-CD2 4.34Å; R134-Y282 HydrophobicContact CG-CE2 4.45Å; A137-Y282 HydrophobicContact CB-CE2 4.17Å; A137-Y282 WeakPolarHBondContact CB-OH 3.25Å; L200-Y282 HydrophobicContact CD1-CD2 3.81Å; L200-Y282 HydrophobicContact CD1-CG 4.37Å; Y282-Q284 VanDerWaalsContact C-N 3.31Å; Y282-Q284 PolarHBondContact O-N 3.23Å; Y282-L285 WeakPolarHBondContact O-CB 3.27Å; Y282-L285 PolarHBondContact O-N 3.41Å; Y282-M286 HydrophobicContact CD1-CG 4.32Å; Y282-M286 HydrophobicContact CE1-CG 3.88Å; Y282-M286 HydrophobicContact CE2-CG 4.24Å; Y282-M286 HydrophobicContact CE2-SD 4.41Å; Y282-M286 WeakPolarHBondContact O-CG 3.43Å; Y282-M286 PolarHBondContact O-N 2.91Å
283D87.2Confident90.3Very high82 Ų8272.5 Ų72.544%0.43934%0.338SS..Hα-helixtrans-64.4-35.5-179.7-53.4-36.6000112.8R281 H287R281-D283 VanDerWaalsContact C-N 3.28Å; R281-D283 IonicContact CZ-OD2 3.14Å; R281-D283 IonicContact NE-OD2 2.8Å; R281-D283 PolarHBondContact NE-OD2 2.92Å; R281-D283 IonicContact NH2-OD2 2.76Å; R281-D283 PolarHBondContact NH2-OD2 3.22Å; R281-D283 PolarHBondContact O-N 3.4Å; D283-H287 WeakPolarHBondContact O-CB 3.33Å; D283-H287 PolarHBondContact O-N 3.34Å
284Q90.5Very high90.3Very high108 Ų10873.3 Ų73.351%0.50534%0.343SS..Hα-helixtrans-71.1-38.9178.6-66172.8-2200111.1F280 R281 Y282 H287 L288F280-Q284 HydrophobicContact CD1-CB 4.07Å; R281-Q284 HydrophobicContact CB-CG 4.24Å; R281-Q284 WeakPolarHBondContact O-CB 3.37Å; R281-Q284 PolarHBondContact O-N 2.8Å; Y282-Q284 VanDerWaalsContact C-N 3.31Å; Y282-Q284 PolarHBondContact O-N 3.23Å; Q284-H287 PolarHBondContact O-N 3.48Å; Q284-L288 WeakPolarHBondContact O-CB 3.46Å; Q284-L288 PolarHBondContact O-N 2.9Å
285L88.6Confident90.7Very high0 Ų073 Ų730%035%0.35CS..Hα-helixtrans-59.5-49.5173.7176.4151.5000110.8Q138 Y142 F198 L200 R281 Y282 H287 L288 L289Q138-L285 HydrophobicContact CG-CD1 4.4Å; Y142-L285 HydrophobicContact CE2-CD1 3.8Å; Y142-L285 HydrophobicContact CE2-CD2 3.64Å; Y142-L285 HydrophobicContact CE2-CG 3.87Å; Y142-L285 VanDerWaalsContact OH-CD1 3.31Å; Y142-L285 WeakPolarHBondContact OH-CD1 3.26Å; Y142-L285 WeakPolarHBondContact OH-CG 3.08Å; F198-L285 HydrophobicContact CB-CD1 3.94Å; F198-L285 HydrophobicContact CD1-CD1 3.59Å; F198-L285 HydrophobicContact CD1-CG 4.21Å; F198-L285 HydrophobicContact CG-CD1 4.14Å; L200-L285 HydrophobicContact CD1-CB 4.22Å; L200-L285 HydrophobicContact CD1-CD1 3.51Å; L200-L285 HydrophobicContact CD1-CG 4.28Å; L200-L285 HydrophobicContact CG-CD1 4.25Å; R281-L285 PolarHBondContact O-N 2.89Å; Y282-L285 WeakPolarHBondContact O-CB 3.27Å; Y282-L285 PolarHBondContact O-N 3.41Å; L285-H287 VanDerWaalsContact C-N 3.3Å; L285-H287 PolarHBondContact O-N 2.9Å; L285-L288 WeakPolarHBondContact O-CB 3.33Å; L285-L288 PolarHBondContact O-N 3.34Å; L285-L289 HydrophobicContact CD2-CD1 3.95Å; L285-L289 PolarHBondContact O-N 2.89Å; L285-L289 VanDerWaalsContact O-N 3.14Å
286M90.6Very high91Very high43 Ų4375.1 Ų75.121%0.21236%0.359CS..Hα-helixtrans-63.6-38.8178.6-65.2-60-8100111.3Y282 L289 W290Y282-M286 HydrophobicContact CD1-CG 4.32Å; Y282-M286 HydrophobicContact CE1-CG 3.88Å; Y282-M286 HydrophobicContact CE2-CG 4.24Å; Y282-M286 HydrophobicContact CE2-SD 4.41Å; Y282-M286 WeakPolarHBondContact O-CG 3.43Å; Y282-M286 PolarHBondContact O-N 2.91Å; M286-L289 PolarHBondContact O-N 3.32Å; M286-W290 WeakPolarHBondContact O-CB 3.4Å; M286-W290 VanDerWaalsContact O-CD1 3.26Å; M286-W290 PolarHBondContact O-N 3.46Å
287H93.2Very high91.3Very high83 Ų8372.4 Ų72.438%0.38434%0.337SS..Hα-helixtrans-63.9-42.6175.1-169-65.6000112.6D283 Q284 L285 L289 K291D283-H287 WeakPolarHBondContact O-CB 3.33Å; D283-H287 PolarHBondContact O-N 3.34Å; Q284-H287 PolarHBondContact O-N 3.48Å; L285-H287 VanDerWaalsContact C-N 3.3Å; L285-H287 PolarHBondContact O-N 2.9Å; H287-L289 VanDerWaalsContact C-N 3.31Å; H287-L289 PolarHBondContact O-N 3.4Å; H287-K291 PolarHBondContact CD2-NZ 3.37Å; H287-K291 VanDerWaalsContact CD2-NZ 3.33Å; H287-K291 WeakPolarHBondContact NE2-CD 3.43Å; H287-K291 PolarHBondContact NE2-NZ 3.31Å; H287-K291 VanDerWaalsContact NE2-NZ 3.18Å; H287-K291 WeakPolarHBondContact O-CB 3.36Å; H287-K291 PolarHBondContact O-N 3.49Å
288L93.2Very high91.6Very high36 Ų3669.2 Ų69.219%0.18833%0.329CS..Iπ-helixtrans-56.4-48.6177.7-179.376.1000110.3I187 F198 Q284 L285 N292 F293I187-L288 HydrophobicContact CG2-CD2 4.37Å; F198-L288 HydrophobicContact CE1-CD2 4.02Å; F198-L288 HydrophobicContact CZ-CD2 4.04Å; Q284-L288 WeakPolarHBondContact O-CB 3.46Å; Q284-L288 PolarHBondContact O-N 2.9Å; L285-L288 WeakPolarHBondContact O-CB 3.33Å; L285-L288 PolarHBondContact O-N 3.34Å; L288-N292 WeakPolarHBondContact O-CA 3.31Å; L288-N292 VanDerWaalsContact O-CB 3.23Å; L288-N292 WeakPolarHBondContact O-CB 3.42Å; L288-N292 PolarHBondContact O-N 3.48Å; L288-N292 VanDerWaalsContact O-N 3.16Å; L288-F293 HydrophobicContact CD1-CE1 4.09Å; L288-F293 HydrophobicContact CD1-CZ 4.31Å; L288-F293 HydrophobicContact CD2-CE2 4.23Å; L288-F293 HydrophobicContact CD2-CZ 4.07Å; L288-F293 HydrophobicContact CG-CE1 4.21Å; L288-F293 HydrophobicContact CG-CE2 4.38Å; L288-F293 HydrophobicContact CG-CZ 4.12Å; L288-F293 PolarHBondContact O-N 2.78Å
289L92Very high92Very high2 Ų267.1 Ų67.11%0.0132%0.321CS..Iπ-helixtrans-70.3-55.1-177.4-78.8165.7000113.5S141 Y142 T145 L285 M286 H287 F293 L294S141-L289 WeakPolarHBondContact OG-CD1 3.39Å; Y142-L289 HydrophobicContact CD1-CD1 3.52Å; Y142-L289 HydrophobicContact CD1-CD2 3.1Å; Y142-L289 HydrophobicContact CD1-CG 3.7Å; Y142-L289 HydrophobicContact CD2-CD1 3.47Å; Y142-L289 VanDerWaalsContact CD2-CD1 3.47Å; Y142-L289 HydrophobicContact CE1-CD1 3.33Å; Y142-L289 HydrophobicContact CE1-CD2 3.13Å; Y142-L289 HydrophobicContact CE1-CG 3.35Å; Y142-L289 HydrophobicContact CE2-CD1 3.22Å; Y142-L289 HydrophobicContact CE2-CG 4.18Å; Y142-L289 HydrophobicContact CG-CD1 3.58Å; Y142-L289 HydrophobicContact CG-CD2 3.91Å; Y142-L289 HydrophobicContact CG-CG 4.27Å; T145-L289 HydrophobicContact CG2-CD2 4.01Å; L285-L289 HydrophobicContact CD2-CD1 3.95Å; L285-L289 PolarHBondContact O-N 2.89Å; L285-L289 VanDerWaalsContact O-N 3.14Å; M286-L289 PolarHBondContact O-N 3.32Å; H287-L289 VanDerWaalsContact C-N 3.31Å; H287-L289 PolarHBondContact O-N 3.4Å; L289-F293 HydrophobicContact CD2-CB 4.48Å; L289-F293 HydrophobicContact CD2-CD2 3.77Å; L289-F293 PolarHBondContact O-N 3.18Å; L289-L294 WeakPolarHBondContact O-CB 3.41Å; L289-L294 PolarHBondContact O-N 3.29Å
290W94.4Very high92.4Very high123 Ų12364.3 Ų64.347%0.46631%0.312SS..Iπ-helixtrans-75.8-35.3-170.3-75.293.5000112.7M286 L294M286-W290 WeakPolarHBondContact O-CB 3.4Å; M286-W290 VanDerWaalsContact O-CD1 3.26Å; M286-W290 PolarHBondContact O-N 3.46Å; W290-L294 HydrophobicContact CE3-CD2 4.48Å
291K93.6Very high92.9Very high131 Ų13162.1 Ų62.157%0.5730%0.303SS*.Iπ-helixtrans-101.4-25-175.4-53-154.8-154.8159.20114.1H287 P295H287-K291 PolarHBondContact CD2-NZ 3.37Å; H287-K291 VanDerWaalsContact CD2-NZ 3.33Å; H287-K291 WeakPolarHBondContact NE2-CD 3.43Å; H287-K291 PolarHBondContact NE2-NZ 3.31Å; H287-K291 VanDerWaalsContact NE2-NZ 3.18Å; H287-K291 WeakPolarHBondContact O-CB 3.36Å; H287-K291 PolarHBondContact O-N 3.49Å; K291-P295 WeakPolarHBondContact O-CG 3.36Å
292N94.6Very high93.4Very high81 Ų8161.1 Ų61.143%0.43331%0.307SS..Iπ-helixtrans-104.5-56.8179.5-53.3-6.1000111.3L288 L296L288-N292 WeakPolarHBondContact O-CA 3.31Å; L288-N292 VanDerWaalsContact O-CB 3.23Å; L288-N292 WeakPolarHBondContact O-CB 3.42Å; L288-N292 PolarHBondContact O-N 3.48Å; L288-N292 VanDerWaalsContact O-N 3.16Å; N292-L296 WeakPolarHBondContact O-CB 3.43Å; N292-L296 PolarHBondContact O-N 3.33Å
293F94.1Very high93.9Very high18 Ų1865.1 Ų65.18%0.07932%0.322CS..Iπ-helixtrans-72.6-44.9-174.3-71.80.3000112.9T145 M184 I187 L288 L289 L296 T297T145-F293 HydrophobicContact CG2-CB 4.1Å; M184-F293 HydrophobicContact CG-CD1 4.21Å; M184-F293 HydrophobicContact CG-CE1 4.2Å; M184-F293 HydrophobicContact SD-CD1 4.21Å; M184-F293 HydrophobicContact SD-CG 4.45Å; I187-F293 HydrophobicContact CB-CE2 3.94Å; I187-F293 HydrophobicContact CB-CZ 3.89Å; I187-F293 HydrophobicContact CD1-CZ 3.77Å; I187-F293 HydrophobicContact CG1-CZ 4.44Å; I187-F293 HydrophobicContact CG2-CE2 3.66Å; I187-F293 HydrophobicContact CG2-CZ 3.67Å; L288-F293 HydrophobicContact CD1-CE1 4.09Å; L288-F293 HydrophobicContact CD1-CZ 4.31Å; L288-F293 HydrophobicContact CD2-CE2 4.23Å; L288-F293 HydrophobicContact CD2-CZ 4.07Å; L288-F293 HydrophobicContact CG-CE1 4.21Å; L288-F293 HydrophobicContact CG-CE2 4.38Å; L288-F293 HydrophobicContact CG-CZ 4.12Å; L288-F293 PolarHBondContact O-N 2.78Å; L289-F293 HydrophobicContact CD2-CB 4.48Å; L289-F293 HydrophobicContact CD2-CD2 3.77Å; L289-F293 PolarHBondContact O-N 3.18Å; F293-L296 PolarHBondContact O-N 3.14Å; F293-T297 WeakPolarHBondContact O-CB 3.38Å; F293-T297 VanDerWaalsContact O-CG2 3.24Å; F293-T297 WeakPolarHBondContact O-CG2 3.24Å; F293-T297 PolarHBondContact O-N 2.97Å; F293-T297 PolarHBondContact O-OG1 2.8Å
294L94.1Very high94.3Very high37 Ų3761.5 Ų61.519%0.19430%0.302CS..Hα-helixtrans-60.1-48.8-177-171.2104.8000112.6V144 I148 L289 W290 L296 T297 L298V144-L294 HydrophobicContact CG1-CD1 3.64Å; I148-L294 HydrophobicContact CD1-CD1 4.42Å; L289-L294 WeakPolarHBondContact O-CB 3.41Å; L289-L294 PolarHBondContact O-N 3.29Å; W290-L294 HydrophobicContact CE3-CD2 4.48Å; L294-L296 VanDerWaalsContact C-N 3.34Å; L294-L296 PolarHBondContact O-N 3.04Å; L294-T297 WeakPolarHBondContact CA-OG1 3.35Å; L294-T297 PolarHBondContact O-N 2.79Å; L294-T297 PolarHBondContact O-OG1 3.16Å; L294-L298 HydrophobicContact CD2-CD1 4.26Å; L294-L298 HydrophobicContact CG-CD1 4.2Å; L294-L298 WeakPolarHBondContact O-CB 3.06Å; L294-L298 WeakPolarHBondContact O-CG 3.14Å; L294-L298 PolarHBondContact O-N 2.94Å
295P96.4Very high94.6Very high65 Ų6559.5 Ų59.542%0.42230%0.297SS..Hα-helixtrans-63.6-39177.6-24.137.2000112.8K291 A299K291-P295 WeakPolarHBondContact O-CG 3.36Å; P295-A299 WeakPolarHBondContact O-CB 3.48Å; P295-A299 PolarHBondContact O-N 3.46Å
296L96.6Very high94.9Very high87 Ų8762 Ų6246%0.45531%0.314SS..Hα-helixtrans-70-41.8-179.5-174.561.6000112.1M184 N292 F293 L294 A299 L300M184-L296 HydrophobicContact CE-CD2 4.24Å; M184-L296 HydrophobicContact CE-CG 4.2Å; M184-L296 HydrophobicContact SD-CB 4.2Å; M184-L296 HydrophobicContact SD-CD2 3.64Å; M184-L296 HydrophobicContact SD-CG 3.98Å; N292-L296 WeakPolarHBondContact O-CB 3.43Å; N292-L296 PolarHBondContact O-N 3.33Å; F293-L296 PolarHBondContact O-N 3.14Å; L294-L296 VanDerWaalsContact C-N 3.34Å; L294-L296 PolarHBondContact O-N 3.04Å; L296-A299 PolarHBondContact O-N 2.82Å; L296-L300 HydrophobicContact CD1-CD1 4.4Å; L296-L300 HydrophobicContact CG-CD1 4.07Å; L296-L300 WeakPolarHBondContact O-CB 3.47Å; L296-L300 VanDerWaalsContact O-CG 3.31Å; L296-L300 WeakPolarHBondContact O-CG 3.25Å; L296-L300 PolarHBondContact O-N 3.05Å
297T95.9Very high95Very high0 Ų061.6 Ų61.60%031%0.312CS..Hα-helixtrans-65.7-37.3176.651.30000111.9I149 M184 F293 L294 L300 L301I149-T297 HydrophobicContact CD1-CG2 3.85Å; I149-T297 HydrophobicContact CG1-CG2 3.51Å; M184-T297 HydrophobicContact CE-CG2 3.55Å; M184-T297 HydrophobicContact SD-CG2 3.74Å; F293-T297 WeakPolarHBondContact O-CB 3.38Å; F293-T297 VanDerWaalsContact O-CG2 3.24Å; F293-T297 WeakPolarHBondContact O-CG2 3.24Å; F293-T297 PolarHBondContact O-N 2.97Å; F293-T297 PolarHBondContact O-OG1 2.8Å; L294-T297 WeakPolarHBondContact CA-OG1 3.35Å; L294-T297 PolarHBondContact O-N 2.79Å; L294-T297 PolarHBondContact O-OG1 3.16Å; T297-L300 PolarHBondContact O-N 3.46Å; T297-L301 WeakPolarHBondContact O-CB 3.41Å; T297-L301 PolarHBondContact O-N 3.47Å
298L96.1Very high95Very high78 Ų7858.1 Ų58.141%0.40830%0.297SS..Hα-helixtrans-66-43.5172.3-73.3170.5000112.2I148 L294 L300 L301 M302I148-L298 HydrophobicContact CD1-CD2 4.17Å; L294-L298 HydrophobicContact CD2-CD1 4.26Å; L294-L298 HydrophobicContact CG-CD1 4.2Å; L294-L298 WeakPolarHBondContact O-CB 3.06Å; L294-L298 WeakPolarHBondContact O-CG 3.14Å; L294-L298 PolarHBondContact O-N 2.94Å; L298-L300 VanDerWaalsContact C-N 3.32Å; L298-L300 PolarHBondContact O-N 2.84Å; L298-L301 WeakPolarHBondContact O-CB 3.44Å; L298-L301 PolarHBondContact O-N 3.33Å; L298-M302 WeakPolarHBondContact O-CG 3.34Å; L298-M302 PolarHBondContact O-N 3.29Å; L298-M302 VanDerWaalsContact O-N 3.11Å
299A96.9Very high95.1Very high60 Ų6061.5 Ų61.550%0.49631%0.314SS..Hα-helixtrans-61.1-42.8175.600000111.6P295 L296 M302 W303P295-A299 WeakPolarHBondContact O-CB 3.48Å; P295-A299 PolarHBondContact O-N 3.46Å; L296-A299 PolarHBondContact O-N 2.82Å; A299-M302 PolarHBondContact O-N 2.84Å; A299-W303 PolarHBondContact O-N 3.1Å; A299-W303 VanDerWaalsContact O-N 3.1Å
300L96.1Very high95.2Very high25 Ų2566.8 Ų66.813%0.13135%0.347CS..Hα-helixtrans-67.7-38176-72167.3000111.8P180 L181 M184 L296 T297 L298 M302 W303 Y304P180-L300 HydrophobicContact CB-CD1 3.97Å; L181-L300 HydrophobicContact CD2-CB 3.94Å; L181-L300 HydrophobicContact CD2-CD1 3.77Å; L181-L300 HydrophobicContact CD2-CG 4.49Å; L181-L300 HydrophobicContact CG-CD1 4.18Å; M184-L300 HydrophobicContact CE-CD1 3.38Å; L296-L300 HydrophobicContact CD1-CD1 4.4Å; L296-L300 HydrophobicContact CG-CD1 4.07Å; L296-L300 WeakPolarHBondContact O-CB 3.47Å; L296-L300 VanDerWaalsContact O-CG 3.31Å; L296-L300 WeakPolarHBondContact O-CG 3.25Å; L296-L300 PolarHBondContact O-N 3.05Å; T297-L300 PolarHBondContact O-N 3.46Å; L298-L300 VanDerWaalsContact C-N 3.32Å; L298-L300 PolarHBondContact O-N 2.84Å; L300-M302 VanDerWaalsContact C-N 3.31Å; L300-M302 PolarHBondContact O-N 3.17Å; L300-W303 CarbonylContact O-C 3.58Å; L300-W303 WeakPolarHBondContact O-CA 3.45Å; L300-W303 WeakPolarHBondContact O-CB 3.49Å; L300-W303 PolarHBondContact O-N 3.35Å; L300-W303 VanDerWaalsContact O-N 3.08Å; L300-Y304 HydrophobicContact CB-CD2 4.25Å; L300-Y304 HydrophobicContact CB-CE2 4.14Å; L300-Y304 HydrophobicContact CD2-CE2 4.14Å; L300-Y304 WeakPolarHBondContact O-CD2 3.46Å; L300-Y304 PolarHBondContact O-N 2.83Å
301L96.9Very high95.2Very high30 Ų3065.9 Ų65.916%0.15735%0.35CS..Hα-helixtrans-55.4-48.3173.5-177.376.9000110.7I148 L151 L155 T297 L298 W303 Y304 V305I148-L301 HydrophobicContact CG2-CB 4.12Å; I148-L301 HydrophobicContact CG2-CD1 4.4Å; I148-L301 HydrophobicContact CG2-CD2 4.33Å; L151-L301 HydrophobicContact CB-CD1 4.36Å; L151-L301 HydrophobicContact CD2-CD1 3.88Å; L151-L301 HydrophobicContact CG-CD1 4.03Å; L155-L301 HydrophobicContact CD1-CD1 4.44Å; T297-L301 WeakPolarHBondContact O-CB 3.41Å; T297-L301 PolarHBondContact O-N 3.47Å; L298-L301 WeakPolarHBondContact O-CB 3.44Å; L298-L301 PolarHBondContact O-N 3.33Å; L301-W303 VanDerWaalsContact C-N 3.26Å; L301-W303 PolarHBondContact O-N 2.91Å; L301-Y304 PolarHBondContact O-N 3.12Å; L301-V305 VanDerWaalsContact O-CG2 3.29Å; L301-V305 WeakPolarHBondContact O-CG2 3.25Å; L301-V305 PolarHBondContact O-N 3.34Å
302M96.3Very high95.2Very high134 Ų13465 Ų6566%0.6636%0.36SS*.Hα-helixtrans-61.4-36.6177.2-64.9-58.7-68.200112.3L298 A299 L300 S306L298-M302 WeakPolarHBondContact O-CG 3.34Å; L298-M302 PolarHBondContact O-N 3.29Å; L298-M302 VanDerWaalsContact O-N 3.11Å; A299-M302 PolarHBondContact O-N 2.84Å; L300-M302 VanDerWaalsContact C-N 3.31Å; L300-M302 PolarHBondContact O-N 3.17Å; M302-S306 WeakPolarHBondContact O-CB 3.33Å; M302-S306 PolarHBondContact O-N 3.1Å; M302-S306 VanDerWaalsContact O-N 3.1Å; M302-S306 PolarHBondContact O-OG 3.17Å
303W95.6Very high95.1Very high145 Ų14564 Ų6455%0.54936%0.359SS..Hα-helixtrans-63.7-50.3173.1177.5-97.4000112.2A299 L300 L301 V305 S306 M307A299-W303 PolarHBondContact O-N 3.1Å; A299-W303 VanDerWaalsContact O-N 3.1Å; L300-W303 CarbonylContact O-C 3.58Å; L300-W303 WeakPolarHBondContact O-CA 3.45Å; L300-W303 WeakPolarHBondContact O-CB 3.49Å; L300-W303 PolarHBondContact O-N 3.35Å; L300-W303 VanDerWaalsContact O-N 3.08Å; L301-W303 VanDerWaalsContact C-N 3.26Å; L301-W303 PolarHBondContact O-N 2.91Å; W303-V305 VanDerWaalsContact C-N 3.27Å; W303-V305 PolarHBondContact O-N 3.08Å; W303-S306 PolarHBondContact O-N 2.85Å; W303-S306 PolarHBondContact O-OG 3.23Å; W303-S306 VanDerWaalsContact O-OG 3.12Å; W303-M307 HydrophobicContact CZ2-CG 4.26Å; W303-M307 VanDerWaalsContact O-CB 3.25Å; W303-M307 WeakPolarHBondContact O-CB 3.29Å; W303-M307 PolarHBondContact O-N 3.38Å
304Y95Very high95.1Very high6 Ų668.8 Ų68.82%0.02439%0.385CS..Hα-helixtrans-71.3-19.2-179.3-72.3-72.8000113.8M156 P177 S178 L181 L300 L301 P308M156-Y304 HydrophobicContact CG-CD1 4.17Å; M156-Y304 HydrophobicContact SD-CD1 3.95Å; M156-Y304 HydrophobicContact SD-CE1 3.76Å; P177-Y304 PolarHBondContact O-OH 3.25Å; S178-Y304 VanDerWaalsContact CA-OH 3.26Å; S178-Y304 WeakPolarHBondContact CA-OH 2.99Å; L181-Y304 HydrophobicContact CD1-CD2 3.55Å; L181-Y304 HydrophobicContact CD1-CE2 3.17Å; L181-Y304 HydrophobicContact CD1-CG 4.43Å; L181-Y304 HydrophobicContact CG-CD2 4.43Å; L181-Y304 HydrophobicContact CG-CE2 3.77Å; L300-Y304 HydrophobicContact CB-CD2 4.25Å; L300-Y304 HydrophobicContact CB-CE2 4.14Å; L300-Y304 HydrophobicContact CD2-CE2 4.14Å; L300-Y304 WeakPolarHBondContact O-CD2 3.46Å; L300-Y304 PolarHBondContact O-N 2.83Å; L301-Y304 PolarHBondContact O-N 3.12Å; Y304-P308 WeakPolarHBondContact O-CD 3.46Å; Y304-P308 VanDerWaalsContact O-CG 3.29Å; Y304-P308 WeakPolarHBondContact O-CG 3.47Å
305V95.6Very high95Very high66 Ų6668.1 Ų68.140%0.438%0.383SS..Hα-helixtrans-73.8-45.7167.4171.40000110.8L155 L301 W303 I309L155-V305 HydrophobicContact CD1-CB 4.38Å; L155-V305 HydrophobicContact CD1-CG2 3.47Å; L155-V305 VanDerWaalsContact CD1-CG2 3.47Å; L301-V305 VanDerWaalsContact O-CG2 3.29Å; L301-V305 WeakPolarHBondContact O-CG2 3.25Å; L301-V305 PolarHBondContact O-N 3.34Å; W303-V305 VanDerWaalsContact C-N 3.27Å; W303-V305 PolarHBondContact O-N 3.08Å; V305-I309 VanDerWaalsContact O-CD1 3.29Å; V305-I309 WeakPolarHBondContact O-CD1 2.98Å; V305-I309 WeakPolarHBondContact O-CG1 3.47Å
306S95.8Very high94.8Very high51 Ų5169.7 Ų69.736%0.35739%0.393SS..Hα-helixtrans-79.2-36.9-173.755.10000113.8M302 W303 I309 T310M302-S306 WeakPolarHBondContact O-CB 3.33Å; M302-S306 PolarHBondContact O-N 3.1Å; M302-S306 VanDerWaalsContact O-N 3.1Å; M302-S306 PolarHBondContact O-OG 3.17Å; W303-S306 PolarHBondContact O-N 2.85Å; W303-S306 PolarHBondContact O-OG 3.23Å; W303-S306 VanDerWaalsContact O-OG 3.12Å; S306-I309 WeakPolarHBondContact O-CB 3.47Å; S306-I309 PolarHBondContact O-N 3Å; S306-T310 WeakPolarHBondContact O-CG2 3.29Å; S306-T310 PolarHBondContact O-N 3.3Å; S306-T310 PolarHBondContact O-OG1 3.08Å
307M93.8Very high94.3Very high35 Ų3573.6 Ų73.617%0.17241%0.409CS..Hα-helixtrans-62.8-45.3-172.6-176.4-88.1-95.700114W303 I309 T310 I311W303-M307 HydrophobicContact CZ2-CG 4.26Å; W303-M307 VanDerWaalsContact O-CB 3.25Å; W303-M307 WeakPolarHBondContact O-CB 3.29Å; W303-M307 PolarHBondContact O-N 3.38Å; M307-I309 PolarHBondContact O-N 3.38Å; M307-T310 PolarHBondContact O-N 3.11Å; M307-T310 PolarHBondContact O-OG1 3.04Å; M307-T310 VanDerWaalsContact O-OG1 3.04Å; M307-I311 HydrophobicContact CG-CD1 3.74Å; M307-I311 HydrophobicContact CG-CG1 4.49Å; M307-I311 WeakPolarHBondContact O-CG1 3.45Å; M307-I311 PolarHBondContact O-N 3.39Å; M307-I311 VanDerWaalsContact O-N 3.08Å; M307-I311 HydrophobicContact SD-CD1 3.69Å
308P92.7Very high93.5Very high10 Ų1082.3 Ų82.37%0.06546%0.462CS..Hα-helixtrans-62.6-31.2175.6-23.334.8000113.1Y304 S312 S313 I314Y304-P308 WeakPolarHBondContact O-CD 3.46Å; Y304-P308 VanDerWaalsContact O-CG 3.29Å; Y304-P308 WeakPolarHBondContact O-CG 3.47Å; P308-S312 CarbonylContact O-C 3.56Å; P308-S312 WeakPolarHBondContact O-CA 3.29Å; P308-S312 PolarHBondContact O-N 3.27Å; P308-S312 VanDerWaalsContact O-N 3.17Å; P308-S313 WeakPolarHBondContact CA-OG 3.49Å; P308-S313 PolarHBondContact O-N 3.18Å; P308-I314 HydrophobicContact CB-CG1 4.31Å
309I94.8Very high93.4Very high108 Ų10882.5 Ų82.555%0.55447%0.465SS*.Hα-helixtrans-72.2-45.6178.6-58.2171.1000110.2V305 S306 M307 S312 I314V305-I309 VanDerWaalsContact O-CD1 3.29Å; V305-I309 WeakPolarHBondContact O-CD1 2.98Å; V305-I309 WeakPolarHBondContact O-CG1 3.47Å; S306-I309 WeakPolarHBondContact O-CB 3.47Å; S306-I309 PolarHBondContact O-N 3Å; M307-I309 PolarHBondContact O-N 3.38Å; I309-S312 PolarHBondContact O-N 3.01Å; I309-I314 HydrophobicContact CG1-CD1 4.33Å
310T95.2Very high93.2Very high112 Ų11283.7 Ų83.769%0.68746%0.463SS*.Hα-helixtrans-70.1-33.6-177.356.20000113S306 M307 S312S306-T310 WeakPolarHBondContact O-CG2 3.29Å; S306-T310 PolarHBondContact O-N 3.3Å; S306-T310 PolarHBondContact O-OG1 3.08Å; M307-T310 PolarHBondContact O-N 3.11Å; M307-T310 PolarHBondContact O-OG1 3.04Å; M307-T310 VanDerWaalsContact O-OG1 3.04Å; T310-S312 VanDerWaalsContact C-N 3.33Å
311I94.2Very high93Very high104 Ų10486.9 Ų86.953%0.53348%0.482SS..THydrogen-bonded Turntrans-90.7-0.5179.6-56.5178.2000111.3M307 S313M307-I311 HydrophobicContact CG-CD1 3.74Å; M307-I311 HydrophobicContact CG-CG1 4.49Å; M307-I311 WeakPolarHBondContact O-CG1 3.45Å; M307-I311 PolarHBondContact O-N 3.39Å; M307-I311 VanDerWaalsContact O-N 3.08Å; M307-I311 HydrophobicContact SD-CD1 3.69Å; I311-S313 PolarHBondContact O-N 3.34Å
312S92.7Very high92.8Very high112 Ų11290.3 Ų90.378%0.78350%0.501SS*.THydrogen-bonded Turntrans54.235.1-173.862.50000113.4P308 I309 T310P308-S312 CarbonylContact O-C 3.56Å; P308-S312 WeakPolarHBondContact O-CA 3.29Å; P308-S312 PolarHBondContact O-N 3.27Å; P308-S312 VanDerWaalsContact O-N 3.17Å; I309-S312 PolarHBondContact O-N 3.01Å; T310-S312 VanDerWaalsContact C-N 3.33Å
313S92.9Very high92.6Very high60 Ų6087.6 Ų87.642%0.4249%0.491SS..  trans-109.935-177.8580000112.6P308 I311 P315P308-S313 WeakPolarHBondContact CA-OG 3.49Å; P308-S313 PolarHBondContact O-N 3.18Å; I311-S313 PolarHBondContact O-N 3.34Å; S313-P315 WeakPolarHBondContact O-CD 3.48Å
314I93.4Very high92.4Very high119 Ų11983.7 Ų83.761%0.6149%0.487SS*.PPolyproline II helixtrans-63.8121.9176.1-58.9173.8000108.6P308 I309P308-I314 HydrophobicContact CB-CG1 4.31Å; I309-I314 HydrophobicContact CG1-CD1 4.33Å
315P92.5Very high92.2Very high24 Ų2489.3 Ų89.316%0.15652%0.52CS..PPolyproline II helixtrans-69.3153.6-179.329.8-37000111.8L155 M156 G158 S313L155-P315 WeakPolarHBondContact O-CD 3.45Å; L155-P315 VanDerWaalsContact O-CG 3.25Å; L155-P315 WeakPolarHBondContact O-CG 3.48Å; M156-P315 WeakPolarHBondContact O-CB 3.31Å; G158-P315 VanDerWaalsContact N-CG 3.35Å; S313-P315 WeakPolarHBondContact O-CD 3.48Å
316P92.1Very high91.9Very high97 Ų9791.1 Ų91.163%0.6353%0.529SS*.PPolyproline II helixtrans-67.4150.5175.830.3-35000111.4
317Q86.4Confident91.6Very high169 Ų16994.4 Ų94.479%0.7954%0.544SS*.  trans-82.9-17174.7-68.7-177.6-9.800113.1
318T78.8Confident91.4Very high183 Ų18399.8 Ų99.8100%1.12358%0.577SS**  trans-1320-174.956.90000111.1

Retrieved 318 of 318 residues in 1124.4 ms (Link to these results)

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