A0A068BZL9_HUMAN Loading...

NADH-ubiquinone oxidoreductase chain 1

AlphaFold DB , UniProt , Accession A0A068BZL9, 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
1M64.7Low89.2Confident185 Ų18588.9 Ų88.991%0.91149%0.487SS*.  0-42.50-62.5-48.6-15100115M3 A4 N5M1-M3 PolarHBondContact O-N 3.16Å; M1-A4 PolarHBondContact O-N 3.12Å; M1-N5 PolarHBondContact O-N 2.67Å; M1-N5 VanDerWaalsContact O-N 3.13Å
2P82.3Confident89.7Confident108 Ų10887.2 Ų87.270%0.70148%0.483SS*.Hα-helixtrans-67-38.3-178.525.7-33.4000113.1A4 N5 L6P2-A4 VanDerWaalsContact C-N 3.33Å; P2-A4 PolarHBondContact O-N 3.07Å; P2-N5 PolarHBondContact O-N 2.66Å; P2-L6 PolarHBondContact O-N 3.14Å
3M88.4Confident90.1Very high120 Ų12081.4 Ų81.459%0.59145%0.451SS*.Hα-helixtrans-65.2-36176.1-170.562.4-172.800112.6M1 L6 L7M1-M3 PolarHBondContact O-N 3.16Å; M3-L6 HydrophobicContact CE-CD2 4.35Å; M3-L6 PolarHBondContact O-N 3.35Å; M3-L6 HydrophobicContact SD-CD2 4.28Å; M3-L7 HydrophobicContact CE-CD1 4.4Å; M3-L7 HydrophobicContact CE-CD2 4.38Å; M3-L7 HydrophobicContact CE-CG 4.26Å; M3-L7 HydrophobicContact CG-CD1 4.46Å; M3-L7 WeakPolarHBondContact O-CG 3.38Å; M3-L7 PolarHBondContact O-N 2.87Å
4A92.4Very high90.4Very high43 Ų4379.5 Ų79.536%0.35544%0.439SS..Hα-helixtrans-66-43.7176.100000111M1 P2 L6 L7 L8M1-A4 PolarHBondContact O-N 3.12Å; P2-A4 VanDerWaalsContact C-N 3.33Å; P2-A4 PolarHBondContact O-N 3.07Å; A4-L6 VanDerWaalsContact C-N 3.33Å; A4-L6 PolarHBondContact O-N 2.97Å; A4-L7 PolarHBondContact O-N 2.94Å; A4-L8 WeakPolarHBondContact O-CB 3.22Å; A4-L8 VanDerWaalsContact O-CG 3.27Å; A4-L8 WeakPolarHBondContact O-CG 3.35Å; A4-L8 PolarHBondContact O-N 3.31Å
5N91.6Very high90.7Very high89 Ų8979.5 Ų79.548%0.47644%0.437SS..Hα-helixtrans-62.2-39.9175.4-69.12.1000112.1M1 P2 L8 L9 L95M1-N5 PolarHBondContact O-N 2.67Å; M1-N5 VanDerWaalsContact O-N 3.13Å; P2-N5 PolarHBondContact O-N 2.66Å; N5-L8 PolarHBondContact O-N 2.98Å; N5-L9 PolarHBondContact O-N 3.29Å; N5-L95 HydrophobicContact CB-CD1 3.7Å
6L92.6Very high91Very high63 Ų6377.4 Ų77.433%0.3343%0.434SS..Hα-helixtrans-63-43.5176.1-178.4146.3000111.7P2 M3 A4 L9 I10P2-L6 PolarHBondContact O-N 3.14Å; M3-L6 HydrophobicContact CE-CD2 4.35Å; M3-L6 PolarHBondContact O-N 3.35Å; M3-L6 HydrophobicContact SD-CD2 4.28Å; A4-L6 VanDerWaalsContact C-N 3.33Å; A4-L6 PolarHBondContact O-N 2.97Å; L6-L9 PolarHBondContact O-N 3.12Å; L6-I10 HydrophobicContact CD2-CD1 3.46Å; L6-I10 VanDerWaalsContact CD2-CD1 3.46Å; L6-I10 HydrophobicContact CD2-CG1 4.45Å; L6-I10 HydrophobicContact CG-CD1 3.89Å; L6-I10 WeakPolarHBondContact O-CG1 3.36Å; L6-I10 PolarHBondContact O-N 2.95Å
7L92.8Very high91.2Very high88 Ų8873.2 Ų73.246%0.46141%0.41SS..Hα-helixtrans-65.6-40.9175.6-71.9169.8000112M3 A4 L9 I10 V11M3-L7 HydrophobicContact CE-CD1 4.4Å; M3-L7 HydrophobicContact CE-CD2 4.38Å; M3-L7 HydrophobicContact CE-CG 4.26Å; M3-L7 HydrophobicContact CG-CD1 4.46Å; M3-L7 WeakPolarHBondContact O-CG 3.38Å; M3-L7 PolarHBondContact O-N 2.87Å; A4-L7 PolarHBondContact O-N 2.94Å; L7-L9 PolarHBondContact O-N 2.85Å; L7-I10 PolarHBondContact O-N 3.21Å; L7-V11 WeakPolarHBondContact O-CB 3.15Å; L7-V11 WeakPolarHBondContact O-CG2 3.18Å; L7-V11 PolarHBondContact O-N 3.34Å
8L93.6Very high91.4Very high125 Ų12570.2 Ų70.265%0.65440%0.396SS*.Hα-helixtrans-66.2-20.7175.4-73.1168.1000113A4 N5 P12A4-L8 WeakPolarHBondContact O-CB 3.22Å; A4-L8 VanDerWaalsContact O-CG 3.27Å; A4-L8 WeakPolarHBondContact O-CG 3.35Å; A4-L8 PolarHBondContact O-N 3.31Å; N5-L8 PolarHBondContact O-N 2.98Å; L8-P12 WeakPolarHBondContact O-CD 3.39Å; L8-P12 WeakPolarHBondContact O-CG 3.48Å
9L93.4Very high91.6Very high37 Ų3769.9 Ų69.919%0.19439%0.39CS..Hα-helixtrans-81.8-54.7170.8-176.969.1000110.9N5 L6 L7 P12 I13 W86 L95N5-L9 PolarHBondContact O-N 3.29Å; L6-L9 PolarHBondContact O-N 3.12Å; L7-L9 PolarHBondContact O-N 2.85Å; L9-P12 WeakPolarHBondContact O-CD 3.38Å; L9-I13 HydrophobicContact CD1-CD1 3.85Å; L9-I13 HydrophobicContact CG-CD1 3.74Å; L9-I13 WeakPolarHBondContact O-CD1 3.08Å; L9-I13 WeakPolarHBondContact O-CG1 3.44Å; L9-I13 PolarHBondContact O-N 2.94Å; L9-W86 HydrophobicContact CD2-CB 4.28Å; L9-L95 HydrophobicContact CD2-CB 4.24Å; L9-L95 HydrophobicContact CD2-CD2 3.89Å
10I94.4Very high91.7Very high45 Ų4567.1 Ų67.123%0.23137%0.374CS..Hα-helixtrans-69.1-43-169.5-64.8173.8000112.2L6 L7 I13 L14 L83L6-I10 HydrophobicContact CD2-CD1 3.46Å; L6-I10 VanDerWaalsContact CD2-CD1 3.46Å; L6-I10 HydrophobicContact CD2-CG1 4.45Å; L6-I10 HydrophobicContact CG-CD1 3.89Å; L6-I10 WeakPolarHBondContact O-CG1 3.36Å; L6-I10 PolarHBondContact O-N 2.95Å; L7-I10 PolarHBondContact O-N 3.21Å; I10-I13 PolarHBondContact O-N 3.45Å; I10-L14 HydrophobicContact CG2-CD1 3.95Å; I10-L14 HydrophobicContact CG2-CG 4.33Å; I10-L14 WeakPolarHBondContact O-CG 2.86Å; I10-L14 PolarHBondContact O-N 2.92Å; I10-L83 HydrophobicContact CG2-CD1 4.16Å; I10-L83 HydrophobicContact CG2-CD2 4.16Å
11V95.2Very high91.7Very high75 Ų7565.7 Ų65.746%0.45537%0.365SS..Hα-helixtrans-63.3-49-174.7173.20000111.6L7 I13 L14 I15L7-V11 WeakPolarHBondContact O-CB 3.15Å; L7-V11 WeakPolarHBondContact O-CG2 3.18Å; L7-V11 PolarHBondContact O-N 3.34Å; V11-I13 VanDerWaalsContact C-N 3.33Å; V11-I13 PolarHBondContact O-N 3.37Å; V11-L14 PolarHBondContact O-N 3.34Å; V11-I15 HydrophobicContact CG1-CD1 3.82Å; V11-I15 WeakPolarHBondContact O-CG1 3.09Å; V11-I15 PolarHBondContact O-N 3.48Å
12P95Very high93.2Very high68 Ų6857.4 Ų57.444%0.44232%0.324SS..Hα-helixtrans-62.5-34.7175.3-27.339000114L8 L9 I15 A16L8-P12 WeakPolarHBondContact O-CD 3.39Å; L8-P12 WeakPolarHBondContact O-CG 3.48Å; L9-P12 WeakPolarHBondContact O-CD 3.38Å; P12-I15 PolarHBondContact O-N 2.92Å; P12-A16 VanDerWaalsContact O-CB 3.28Å; P12-A16 WeakPolarHBondContact O-CB 3.33Å; P12-A16 PolarHBondContact O-N 3.16Å
13I95.2Very high93.7Very high12 Ų1255 Ų556%0.06231%0.307CS..Hα-helixtrans-63.4-44.7177-68.1163.2000110.8L9 I10 V11 I15 A16 M17 L83 W86 T229L9-I13 HydrophobicContact CD1-CD1 3.85Å; L9-I13 HydrophobicContact CG-CD1 3.74Å; L9-I13 WeakPolarHBondContact O-CD1 3.08Å; L9-I13 WeakPolarHBondContact O-CG1 3.44Å; L9-I13 PolarHBondContact O-N 2.94Å; I10-I13 PolarHBondContact O-N 3.45Å; V11-I13 VanDerWaalsContact C-N 3.33Å; V11-I13 PolarHBondContact O-N 3.37Å; I13-I15 VanDerWaalsContact C-N 3.32Å; I13-I15 PolarHBondContact O-N 3.46Å; I13-A16 PolarHBondContact O-N 3.27Å; I13-M17 WeakPolarHBondContact O-CB 3.3Å; I13-M17 PolarHBondContact O-N 3.32Å; I13-L83 HydrophobicContact CG2-CD2 4.45Å; I13-W86 HydrophobicContact CD1-CB 3.91Å; I13-W86 HydrophobicContact CD1-CD2 3.46Å; I13-W86 VanDerWaalsContact CD1-CD2 3.46Å; I13-W86 HydrophobicContact CD1-CE3 3.66Å; I13-W86 HydrophobicContact CD1-CG 3.58Å; I13-W86 HydrophobicContact CD1-CZ3 4.32Å; I13-W86 HydrophobicContact CG1-CD2 4.09Å; I13-W86 HydrophobicContact CG1-CE3 4.07Å; I13-W86 HydrophobicContact CG1-CH2 4.39Å; I13-W86 HydrophobicContact CG1-CZ2 4.45Å; I13-W86 HydrophobicContact CG1-CZ3 4.23Å; I13-W86 HydrophobicContact CG2-CD2 4.41Å; I13-W86 HydrophobicContact CG2-CZ2 3.9Å; I13-T229 HydrophobicContact CG2-CG2 3.97Å
14L94.1Very high93.9Very high55 Ų5549.5 Ų49.529%0.28828%0.28SS..Hα-helixtrans-65-37.8177.1-68.4174.9000111.8I10 V11 M17 A18I10-L14 HydrophobicContact CG2-CD1 3.95Å; I10-L14 HydrophobicContact CG2-CG 4.33Å; I10-L14 WeakPolarHBondContact O-CG 2.86Å; I10-L14 PolarHBondContact O-N 2.92Å; V11-L14 PolarHBondContact O-N 3.34Å; L14-M17 HydrophobicContact CD2-CE 4.06Å; L14-M17 WeakPolarHBondContact O-CE 3.3Å; L14-A18 PolarHBondContact O-N 3.2Å
15I95.3Very high94Very high79 Ų7952.3 Ų52.341%0.40528%0.282SS..Hα-helixtrans-65.8-44.1174.2-65.8167.3000110.5V11 P12 I13 M17 A18 F19V11-I15 HydrophobicContact CG1-CD1 3.82Å; V11-I15 WeakPolarHBondContact O-CG1 3.09Å; V11-I15 PolarHBondContact O-N 3.48Å; P12-I15 PolarHBondContact O-N 2.92Å; I13-I15 VanDerWaalsContact C-N 3.32Å; I13-I15 PolarHBondContact O-N 3.46Å; I15-M17 VanDerWaalsContact C-N 3.34Å; I15-M17 PolarHBondContact O-N 2.98Å; I15-A18 WeakPolarHBondContact O-CB 3.33Å; I15-A18 PolarHBondContact O-N 3.15Å; I15-F19 HydrophobicContact CG2-CD2 3.73Å; I15-F19 HydrophobicContact CG2-CE2 3.67Å; I15-F19 VanDerWaalsContact O-CD2 3.29Å; I15-F19 WeakPolarHBondContact O-CD2 3.09Å; I15-F19 PolarHBondContact O-N 3.22Å
16A94.8Very high94.1Very high47 Ų4750 Ų5039%0.38827%0.268SS..Hα-helixtrans-61.1-43.3177.800000111.4P12 I13 A18 F19 L20 I232P12-A16 VanDerWaalsContact O-CB 3.28Å; P12-A16 WeakPolarHBondContact O-CB 3.33Å; P12-A16 PolarHBondContact O-N 3.16Å; I13-A16 PolarHBondContact O-N 3.27Å; A16-A18 PolarHBondContact O-N 3.04Å; A16-F19 PolarHBondContact O-N 3.14Å; A16-L20 WeakPolarHBondContact O-CB 3.35Å; A16-L20 PolarHBondContact O-N 3.03Å; A16-I232 HydrophobicContact CB-CD1 4.29Å
17M95.1Very high94.1Very high6 Ų649.2 Ų49.23%0.0326%0.263CS..Hα-helixtrans-58.7-45.4172.9169.4-81.7-6300111.8I13 L14 I15 F19 L20 M21 M225 T229 I232I13-M17 WeakPolarHBondContact O-CB 3.3Å; I13-M17 PolarHBondContact O-N 3.32Å; L14-M17 HydrophobicContact CD2-CE 4.06Å; L14-M17 WeakPolarHBondContact O-CE 3.3Å; I15-M17 VanDerWaalsContact C-N 3.34Å; I15-M17 PolarHBondContact O-N 2.98Å; M17-F19 VanDerWaalsContact C-N 3.34Å; M17-F19 PolarHBondContact O-N 3.19Å; M17-L20 WeakPolarHBondContact O-CB 3.4Å; M17-L20 PolarHBondContact O-N 2.92Å; M17-L20 VanDerWaalsContact O-N 3.13Å; M17-M21 PolarHBondContact O-N 3.27Å; M17-M21 HydrophobicContact SD-CE 3.95Å; M17-M225 HydrophobicContact CE-CB 3.77Å; M17-M225 HydrophobicContact CE-CG 3.33Å; M17-M225 HydrophobicContact CE-SD 3.7Å; M17-M225 HydrophobicContact SD-CB 4.32Å; M17-M225 HydrophobicContact SD-CG 3.91Å; M17-T229 HydrophobicContact CB-CG2 3.97Å; M17-T229 HydrophobicContact CG-CG2 4.09Å; M17-I232 HydrophobicContact CB-CD1 4.4Å
18A93.8Very high94.1Very high18 Ų1846.1 Ų46.115%0.14925%0.247CC..Hα-helixtrans-60.8-43.6179.300000111.7L14 I15 A16 M21 P48L14-A18 PolarHBondContact O-N 3.2Å; I15-A18 WeakPolarHBondContact O-CB 3.33Å; I15-A18 PolarHBondContact O-N 3.15Å; A16-A18 PolarHBondContact O-N 3.04Å; A18-M21 PolarHBondContact O-N 3.48Å; A18-P48 HydrophobicContact CB-CB 3.87Å; A18-P48 VanDerWaalsContact O-CB 3.27Å; A18-P48 WeakPolarHBondContact O-CB 3.44Å; A18-P48 WeakPolarHBondContact O-CG 3.28Å
19F94.9Very high94Very high66 Ų6640.2 Ų40.229%0.28922%0.216SC..Hα-helixtrans-71.6-29.6175.4-77.3-68.6000113.2I15 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 3.29Å; I15-F19 WeakPolarHBondContact O-CD2 3.09Å; I15-F19 PolarHBondContact O-N 3.22Å; A16-F19 PolarHBondContact O-N 3.14Å; M17-F19 VanDerWaalsContact C-N 3.34Å; M17-F19 PolarHBondContact O-N 3.19Å; F19-M21 VanDerWaalsContact C-N 3.28Å; F19-M21 PolarHBondContact O-N 3.29Å; F19-L22 WeakPolarHBondContact O-CB 3.45Å; F19-L22 PolarHBondContact O-N 3.09Å; F19-T23 WeakPolarHBondContact O-CG2 3.46Å; F19-T23 PolarHBondContact O-N 3.06Å; F19-L45 HydrophobicContact CE1-CD2 4.14Å; F19-P48 HydrophobicContact CD1-CG 4.43Å; F19-F49 HydrophobicContact CZ-CE2 4.18Å
20L94.6Very high94.1Very high13 Ų1345.1 Ų45.17%0.06823%0.233CC..Hα-helixtrans-59.9-41175.6-175.1139.9000111.1A16 M17 L22 T23 E24 Y228 I232 T267A16-L20 WeakPolarHBondContact O-CB 3.35Å; A16-L20 PolarHBondContact O-N 3.03Å; M17-L20 WeakPolarHBondContact O-CB 3.4Å; M17-L20 PolarHBondContact O-N 2.92Å; M17-L20 VanDerWaalsContact O-N 3.13Å; L20-L22 VanDerWaalsContact C-N 3.27Å; L20-L22 PolarHBondContact O-N 3.42Å; L20-T23 VanDerWaalsContact CA-OG1 3.31Å; L20-T23 WeakPolarHBondContact CA-OG1 3.29Å; L20-T23 PolarHBondContact O-N 3.16Å; L20-T23 VanDerWaalsContact O-N 3.12Å; L20-T23 PolarHBondContact O-OG1 3.09Å; L20-E24 WeakPolarHBondContact O-CB 3.21Å; L20-E24 PolarHBondContact O-N 3.12Å; L20-Y228 HydrophobicContact CD2-CD1 3.19Å; L20-Y228 HydrophobicContact CD2-CE1 3.67Å; L20-Y228 HydrophobicContact CD2-CG 4.11Å; L20-I232 HydrophobicContact CB-CD1 4.3Å; L20-I232 HydrophobicContact CD1-CD1 3.94Å; L20-I232 HydrophobicContact CD1-CG1 3.54Å; L20-T267 HydrophobicContact CD1-CG2 4.39Å
21M92.4Very high94Very high37 Ų3747 Ų4718%0.18224%0.242CC..Hα-helixtrans-57.3-39173.5-64-168-77.600112.9M17 A18 F19 R25 Y228M17-M21 PolarHBondContact O-N 3.27Å; M17-M21 HydrophobicContact SD-CE 3.95Å; A18-M21 PolarHBondContact O-N 3.48Å; F19-M21 VanDerWaalsContact C-N 3.28Å; F19-M21 PolarHBondContact O-N 3.29Å; M21-R25 WeakPolarHBondContact O-CG 3.5Å; M21-R25 PolarHBondContact O-N 2.87Å; M21-Y228 HydrophobicContact CG-CD2 3.76Å; M21-Y228 HydrophobicContact CG-CE1 4.45Å; M21-Y228 HydrophobicContact CG-CE2 3.63Å; M21-Y228 HydrophobicContact CG-CG 4.28Å; M21-Y228 HydrophobicContact SD-CD2 4.11Å; M21-Y228 HydrophobicContact SD-CE2 3.95Å
22L94.6Very high93.9Very high11 Ų1148.3 Ų48.36%0.05824%0.243CC..Hα-helixtrans-69.7-44.2175.1171.3137.2000111.7F19 L20 E24 R25 K26 G44 Q47 P48F19-L22 WeakPolarHBondContact O-CB 3.45Å; F19-L22 PolarHBondContact O-N 3.09Å; L20-L22 VanDerWaalsContact C-N 3.27Å; L20-L22 PolarHBondContact O-N 3.42Å; L22-E24 VanDerWaalsContact C-N 3.28Å; L22-E24 PolarHBondContact O-N 3.17Å; L22-R25 PolarHBondContact O-N 3.24Å; L22-K26 HydrophobicContact CD2-CD 4.12Å; L22-K26 PolarHBondContact O-N 3.29Å; L22-G44 VanDerWaalsContact CD1-C 3.48Å; L22-G44 WeakPolarHBondContact CD1-O 3.4Å; L22-Q47 HydrophobicContact CD1-CB 4.14Å; L22-P48 HydrophobicContact CB-CG 3.84Å; L22-P48 HydrophobicContact CD1-CG 4.37Å
23T93.6Very high93.9Very high57 Ų5753.1 Ų53.135%0.3526%0.264SS..Hα-helixtrans-60.7-41.5178.960.90000111.1F19 L20 K26 I27F19-T23 WeakPolarHBondContact O-CG2 3.46Å; F19-T23 PolarHBondContact O-N 3.06Å; L20-T23 VanDerWaalsContact CA-OG1 3.31Å; L20-T23 WeakPolarHBondContact CA-OG1 3.29Å; L20-T23 PolarHBondContact O-N 3.16Å; L20-T23 VanDerWaalsContact O-N 3.12Å; L20-T23 PolarHBondContact O-OG1 3.09Å; T23-K26 PolarHBondContact O-N 3.05Å; T23-I27 WeakPolarHBondContact O-CB 3.48Å; T23-I27 VanDerWaalsContact O-CG1 3.29Å; T23-I27 WeakPolarHBondContact O-CG1 3.31Å; T23-I27 PolarHBondContact O-N 3.41Å
24E93.6Very high93.8Very high5 Ų559.1 Ų59.12%0.02329%0.286CS..Hα-helixtrans-57.9-53.9174.7173.2165-146.800111.7L20 L22 K26 I27 L28 Y228 L271 R274L20-E24 WeakPolarHBondContact O-CB 3.21Å; L20-E24 PolarHBondContact O-N 3.12Å; L22-E24 VanDerWaalsContact C-N 3.28Å; L22-E24 PolarHBondContact O-N 3.17Å; E24-K26 PolarHBondContact O-N 3.23Å; E24-K26 VanDerWaalsContact O-N 3.16Å; E24-I27 PolarHBondContact O-N 3.35Å; E24-L28 HydrophobicContact CG-CD1 3.49Å; E24-L28 VanDerWaalsContact CG-CD1 3.49Å; E24-L28 HydrophobicContact CG-CG 3.97Å; E24-L28 VanDerWaalsContact O-CB 3.25Å; E24-L28 WeakPolarHBondContact O-CB 3.32Å; E24-L28 WeakPolarHBondContact O-CG 3.44Å; E24-L28 PolarHBondContact O-N 3.49Å; E24-Y228 WeakPolarHBondContact OE2-CE1 3.27Å; E24-Y228 VanDerWaalsContact OE2-CZ 3.32Å; E24-Y228 PolarHBondContact OE2-OH 3.42Å; E24-L271 HydrophobicContact CB-CD1 4.2Å; E24-L271 HydrophobicContact CB-CD2 3.68Å; E24-L271 HydrophobicContact CG-CD2 3.67Å; E24-R274 WeakPolarHBondContact OE1-CD 3.5Å; E24-R274 IonicContact OE1-CZ 3.22Å; E24-R274 IonicContact OE1-NE 2.85Å; E24-R274 IonicContact OE1-NH1 3.02Å; E24-R274 PolarHBondContact OE1-NH1 2.88Å
25R93.7Very high93.7Very high103 Ų10363.9 Ų63.939%0.38930%0.304SS..Hα-helixtrans-59.5-32.1179.9-69.6-177.5-177.8165.911.5112.9M21 L22 G29 P37 D51M21-R25 WeakPolarHBondContact O-CG 3.5Å; M21-R25 PolarHBondContact O-N 2.87Å; L22-R25 PolarHBondContact O-N 3.24Å; R25-G29 PolarHBondContact O-N 2.77Å; R25-G29 VanDerWaalsContact O-N 3.09Å; R25-P37 HydrophobicContact CB-CG 3.87Å; R25-P37 HydrophobicContact CG-CG 4.48Å; R25-D51 IonicContact CZ-OD2 3.14Å; R25-D51 IonicContact NH1-OD1 3.93Å; R25-D51 IonicContact NH1-OD2 2.73Å; R25-D51 PolarHBondContact NH1-OD2 3.3Å; R25-D51 IonicContact NH2-OD2 3.21Å; R25-D51 PolarHBondContact NH2-OD2 3.44Å
26K93.5Very high93.6Very high41 Ų4160.6 Ų60.618%0.17829%0.29CS..Hα-helixtrans-73.6-49.8175.5-76.2-172.6174.5-178.80112.3L22 T23 E24 G29 Y30 Y43L22-K26 HydrophobicContact CD2-CD 4.12Å; L22-K26 PolarHBondContact O-N 3.29Å; T23-K26 PolarHBondContact O-N 3.05Å; E24-K26 PolarHBondContact O-N 3.23Å; E24-K26 VanDerWaalsContact O-N 3.16Å; K26-G29 PolarHBondContact O-N 2.73Å; K26-Y30 HydrophobicContact CB-CE2 4.47Å; K26-Y30 WeakPolarHBondContact O-CD2 3.29Å; K26-Y30 PolarHBondContact O-N 3.28Å; K26-Y43 WeakPolarHBondContact CE-O 3.32Å; K26-Y43 PolarHBondContact NZ-O 3.38Å
27I93.3Very high93.5Very high46 Ų4659.7 Ų59.724%0.23628%0.28CS..Hα-helixtrans-61.3-49-179.7-68.7174.1000109.9T23 E24 G29 Y30 M31 L271T23-I27 WeakPolarHBondContact O-CB 3.48Å; T23-I27 VanDerWaalsContact O-CG1 3.29Å; T23-I27 WeakPolarHBondContact O-CG1 3.31Å; T23-I27 PolarHBondContact O-N 3.41Å; E24-I27 PolarHBondContact O-N 3.35Å; I27-G29 VanDerWaalsContact C-N 3.29Å; I27-G29 PolarHBondContact O-N 3.02Å; I27-Y30 PolarHBondContact O-N 3.01Å; I27-M31 HydrophobicContact CG2-CE 3.44Å; I27-M31 VanDerWaalsContact CG2-CE 3.44Å; I27-M31 HydrophobicContact CG2-CG 4.44Å; I27-M31 HydrophobicContact CG2-SD 3.57Å; I27-M31 VanDerWaalsContact CG2-SD 3.57Å; I27-M31 WeakPolarHBondContact O-CB 3.28Å; I27-M31 VanDerWaalsContact O-CG 3.32Å; I27-M31 WeakPolarHBondContact O-CG 3.29Å; I27-M31 PolarHBondContact O-N 3.41Å; I27-L271 HydrophobicContact CD1-CD1 3.83Å; I27-L271 HydrophobicContact CG2-CB 4.34Å
28L91.9Very high93.4Very high23 Ų2362 Ų6212%0.1229%0.292CS..Hα-helixtrans-55-45.6173.1-69175.2000111.4E24 Q32 R274 T275E24-L28 HydrophobicContact CG-CD1 3.49Å; E24-L28 VanDerWaalsContact CG-CD1 3.49Å; E24-L28 HydrophobicContact CG-CG 3.97Å; E24-L28 VanDerWaalsContact O-CB 3.25Å; E24-L28 WeakPolarHBondContact O-CB 3.32Å; E24-L28 WeakPolarHBondContact O-CG 3.44Å; E24-L28 PolarHBondContact O-N 3.49Å; L28-Q32 VanDerWaalsContact O-CB 3.29Å; L28-Q32 WeakPolarHBondContact O-CB 3.17Å; L28-Q32 WeakPolarHBondContact O-CG 3.25Å; L28-Q32 PolarHBondContact O-N 3.36Å; L28-R274 HydrophobicContact CD2-CG 4.02Å; L28-T275 HydrophobicContact CD2-CG2 3.25Å; L28-T275 HydrophobicContact CG-CG2 4.39Å
29G92.4Very high93.3Very high0 Ų067.7 Ų67.70%033%0.325CS..Hα-helixtrans-56.9-55.8178.100000111.5R25 K26 I27 M31 Q32 L33 R34R25-G29 PolarHBondContact O-N 2.77Å; R25-G29 VanDerWaalsContact O-N 3.09Å; K26-G29 PolarHBondContact O-N 2.73Å; I27-G29 VanDerWaalsContact C-N 3.29Å; I27-G29 PolarHBondContact O-N 3.02Å; G29-M31 VanDerWaalsContact C-N 3.35Å; G29-M31 PolarHBondContact O-N 3.47Å; G29-Q32 CarbonylContact O-C 3.57Å; G29-Q32 WeakPolarHBondContact O-CA 3.19Å; G29-Q32 PolarHBondContact O-N 3.17Å; G29-Q32 VanDerWaalsContact O-N 3.09Å; G29-L33 PolarHBondContact O-N 2.84Å; G29-R34 CarbonylContact C-O 3.38Å; G29-R34 CarbonylContact O-C 3.41Å; G29-R34 WeakPolarHBondContact O-CG 3.43Å; G29-R34 PolarHBondContact O-N 2.87Å
30Y93.9Very high93Very high140 Ų14067.2 Ų67.255%0.54933%0.328SS..Hα-helixtrans-63.3-39-177.3-75-65000112.7K26 I27 Q32 L33 R34K26-Y30 HydrophobicContact CB-CE2 4.47Å; K26-Y30 WeakPolarHBondContact O-CD2 3.29Å; K26-Y30 PolarHBondContact O-N 3.28Å; I27-Y30 PolarHBondContact O-N 3.01Å; Y30-Q32 VanDerWaalsContact C-N 3.26Å; Y30-Q32 PolarHBondContact O-N 3.45Å; Y30-L33 PolarHBondContact O-N 3.21Å; Y30-L33 VanDerWaalsContact O-N 3.14Å; Y30-R34 PolarHBondContact N-O 3.14Å
31M92.7Very high92.9Very high84 Ų8467.9 Ų67.941%0.41434%0.338SS..Hα-helixtrans-65.5-31175.3-71.4172.1174.800112.3I27 G29 L33 W272 T275I27-M31 HydrophobicContact CG2-CE 3.44Å; I27-M31 VanDerWaalsContact CG2-CE 3.44Å; I27-M31 HydrophobicContact CG2-CG 4.44Å; I27-M31 HydrophobicContact CG2-SD 3.57Å; I27-M31 VanDerWaalsContact CG2-SD 3.57Å; I27-M31 WeakPolarHBondContact O-CB 3.28Å; I27-M31 VanDerWaalsContact O-CG 3.32Å; I27-M31 WeakPolarHBondContact O-CG 3.29Å; I27-M31 PolarHBondContact O-N 3.41Å; G29-M31 VanDerWaalsContact C-N 3.35Å; G29-M31 PolarHBondContact O-N 3.47Å; M31-L33 VanDerWaalsContact C-N 3.29Å; M31-L33 PolarHBondContact O-N 2.84Å; M31-W272 HydrophobicContact CE-CB 3.77Å; M31-W272 HydrophobicContact CE-CG 3.8Å; M31-W272 HydrophobicContact SD-CB 4.49Å; M31-T275 HydrophobicContact CB-CG2 3.93Å; M31-T275 HydrophobicContact CG-CG2 4.35Å; M31-T275 HydrophobicContact SD-CG2 3.49Å; M31-T275 WeakPolarHBondContact SD-CG2 3.43Å; M31-T275 PolarHBondContact SD-OG1 2.95Å
32Q93.4Very high92.8Very high104 Ų10470.2 Ų70.249%0.48636%0.356SS..THydrogen-bonded Turntrans-8915.7175-66.2172.6-7.100113.4L28 G29 Y30 R34L28-Q32 VanDerWaalsContact O-CB 3.29Å; L28-Q32 WeakPolarHBondContact O-CB 3.17Å; L28-Q32 WeakPolarHBondContact O-CG 3.25Å; L28-Q32 PolarHBondContact O-N 3.36Å; G29-Q32 CarbonylContact O-C 3.57Å; G29-Q32 WeakPolarHBondContact O-CA 3.19Å; G29-Q32 PolarHBondContact O-N 3.17Å; G29-Q32 VanDerWaalsContact O-N 3.09Å; Y30-Q32 VanDerWaalsContact C-N 3.26Å; Y30-Q32 PolarHBondContact O-N 3.45Å; Q32-R34 HydrophobicContact CB-CG 4.23Å; Q32-R34 PolarHBondContact O-N 3Å
33L94.3Very high92.7Very high168 Ų16878.2 Ų78.288%0.8839%0.386SS*.THydrogen-bonded Turntrans56.829.4-178.8-59.4172.6000114.5G29 Y30 M31G29-L33 PolarHBondContact O-N 2.84Å; Y30-L33 PolarHBondContact O-N 3.21Å; Y30-L33 VanDerWaalsContact O-N 3.14Å; M31-L33 VanDerWaalsContact C-N 3.29Å; M31-L33 PolarHBondContact O-N 2.84Å
34R94.9Very high92.6Very high138 Ų13875.5 Ų75.552%0.52137%0.37SS..SBendtrans-127.5169173.665.7-177.6178.9100.9-1111.3G29 Y30 Q32G29-R34 CarbonylContact C-O 3.38Å; G29-R34 CarbonylContact O-C 3.41Å; G29-R34 WeakPolarHBondContact O-CG 3.43Å; G29-R34 PolarHBondContact O-N 2.87Å; Y30-R34 PolarHBondContact N-O 3.14Å; Q32-R34 HydrophobicContact CB-CG 4.23Å; Q32-R34 PolarHBondContact O-N 3Å
35K91.4Very high92.6Very high155 Ų15579.2 Ų79.267%0.67439%0.389SS*.  trans-88141.3174.5-68.2-179.8-179.41780110.2
36G93.5Very high92.6Very high10 Ų1078.9 Ų78.910%0.10340%0.395CS..  trans-72.7-172.8165.500000112.5N38G36-N38 PolarHBondContact O-N 2.72Å; G36-N38 VanDerWaalsContact O-N 3.14Å
37P91.8Very high92.7Very high28 Ų2878.3 Ų78.318%0.18239%0.393CS..SBendtrans-58.6117177.9-20.731.4000111.1R25 G44 Q47R25-P37 HydrophobicContact CB-CG 3.87Å; R25-P37 HydrophobicContact CG-CG 4.48Å; P37-G44 WeakPolarHBondContact O-CA 3.46Å; P37-Q47 HydrophobicContact CB-CB 4.4Å; P37-Q47 HydrophobicContact CB-CG 4.08Å; P37-Q47 HydrophobicContact CG-CG 4.37Å
38N93.2Very high92.7Very high54 Ų5476.3 Ų76.329%0.28938%0.382SS..  trans-128.1-5-179.7-74.5-16.1000113.6G36G36-N38 PolarHBondContact O-N 2.72Å; G36-N38 VanDerWaalsContact O-N 3.14Å
39V91.7Very high92.7Very high139 Ų13980.6 Ų80.684%0.84240%0.4SS*.SBendtrans-94.4-42.4-171.9-178.20000112.5G41V39-G41 PolarHBondContact O-N 2.63Å
40V89.4Confident92.7Very high56 Ų5682.6 Ų82.634%0.33942%0.417SS..SBendtrans-77.387.5-178.3-175.90000109.6G44 L46 Q47 A50V40-G44 CarbonylContact O-C 3.18Å; V40-G44 WeakPolarHBondContact O-CA 3.31Å; V40-L46 HydrophobicContact CG1-CB 4.21Å; V40-L46 PolarHBondContact O-N 2.85Å; V40-Q47 VanDerWaalsContact CG2-OE1 3.25Å; V40-A50 HydrophobicContact CG1-CB 3.96Å
41G91.6Very high92.6Very high27 Ų2777.3 Ų77.328%0.27840%0.398SS..SBendtrans84173.6-175.400000113.9V39 Y43 G44V39-G41 PolarHBondContact O-N 2.63Å; G41-Y43 PolarHBondContact O-N 3.24Å; G41-Y43 VanDerWaalsContact O-N 3.16Å; G41-G44 PolarHBondContact O-N 3.12Å
42P91.2Very high92.5Very high86 Ų8675.1 Ų75.156%0.55839%0.393SS*.G310 helixtrans-61120.3-179.325.3-32.8000109.9G44 L45P42-G44 PolarHBondContact O-N 3.48Å; P42-L45 HydrophobicContact CG-CD1 4.42Å; P42-L45 WeakPolarHBondContact O-CG 3.07Å; P42-L45 PolarHBondContact O-N 2.84Å; P42-L45 VanDerWaalsContact O-N 3.12Å
43Y91.3Very high92.4Very high178 Ų17876.6 Ų76.670%0.69840%0.402SS*.G310 helixtrans49.631.1-172.7-58.4-80.4000113.7K26 G41 L45K26-Y43 WeakPolarHBondContact CE-O 3.32Å; K26-Y43 PolarHBondContact NZ-O 3.38Å; G41-Y43 PolarHBondContact O-N 3.24Å; G41-Y43 VanDerWaalsContact O-N 3.16Å; Y43-L45 VanDerWaalsContact C-N 3.31Å; Y43-L45 PolarHBondContact O-N 3.27Å
44G92.2Very high92.4Very high0 Ų075.2 Ų75.20%039%0.389CS..G310 helixtrans76.25.9178.300000116L22 P37 V40 G41 P42 L46 Q47L22-G44 VanDerWaalsContact CD1-C 3.48Å; L22-G44 WeakPolarHBondContact CD1-O 3.4Å; P37-G44 WeakPolarHBondContact O-CA 3.46Å; V40-G44 CarbonylContact O-C 3.18Å; V40-G44 WeakPolarHBondContact O-CA 3.31Å; G41-G44 PolarHBondContact O-N 3.12Å; P42-G44 PolarHBondContact O-N 3.48Å; G44-L46 PolarHBondContact O-N 3.13Å; G44-Q47 WeakPolarHBondContact O-CB 3.48Å; G44-Q47 PolarHBondContact O-N 2.87Å
45L93.4Very high92.2Very high83 Ų8370.9 Ų70.944%0.43538%0.376SS..THydrogen-bonded Turntrans-54.7-25.4-174-76.3170.7000114.6F19 P42 Y43 P48F19-L45 HydrophobicContact CE1-CD2 4.14Å; P42-L45 HydrophobicContact CG-CD1 4.42Å; P42-L45 WeakPolarHBondContact O-CG 3.07Å; P42-L45 PolarHBondContact O-N 2.84Å; P42-L45 VanDerWaalsContact O-N 3.12Å; Y43-L45 VanDerWaalsContact C-N 3.31Å; Y43-L45 PolarHBondContact O-N 3.27Å; L45-P48 WeakPolarHBondContact O-CD 3.12Å
46L94.4Very high92.1Very high96 Ų9669.4 Ų69.450%0.50337%0.37SS..THydrogen-bonded Turntrans-88.6-3179.1-64.7174.4000113.6V40 G44 F49 A50V40-L46 HydrophobicContact CG1-CB 4.21Å; V40-L46 PolarHBondContact O-N 2.85Å; G44-L46 PolarHBondContact O-N 3.13Å; L46-F49 HydrophobicContact CD2-CD2 4.26Å; L46-F49 PolarHBondContact O-N 2.78Å; L46-A50 PolarHBondContact O-N 3.47Å; L46-A50 VanDerWaalsContact O-N 3.12Å
47Q94.3Very high92.1Very high30 Ų3073.8 Ų73.814%0.1440%0.395CS..Hα-helixtrans-56.6-45-179.4-173.571.647.100113.5L22 P37 V40 G44 F49 A50 D51L22-Q47 HydrophobicContact CD1-CB 4.14Å; P37-Q47 HydrophobicContact CB-CB 4.4Å; P37-Q47 HydrophobicContact CB-CG 4.08Å; P37-Q47 HydrophobicContact CG-CG 4.37Å; V40-Q47 VanDerWaalsContact CG2-OE1 3.25Å; G44-Q47 WeakPolarHBondContact O-CB 3.48Å; G44-Q47 PolarHBondContact O-N 2.87Å; Q47-F49 VanDerWaalsContact C-N 3.28Å; Q47-F49 PolarHBondContact O-N 3.32Å; Q47-A50 PolarHBondContact O-N 3.07Å; Q47-D51 PolarHBondContact NE2-OD1 3.38Å; Q47-D51 PolarHBondContact O-N 3.02Å
48P93.2Very high92.1Very high3 Ų378.2 Ų78.22%0.01941%0.411CS..Hα-helixtrans-61.8-37.3-179.2-24.236.1000112.9A18 F19 L22 L45 D51 A52A18-P48 HydrophobicContact CB-CB 3.87Å; A18-P48 VanDerWaalsContact O-CB 3.27Å; A18-P48 WeakPolarHBondContact O-CB 3.44Å; A18-P48 WeakPolarHBondContact O-CG 3.28Å; F19-P48 HydrophobicContact CD1-CG 4.43Å; L22-P48 HydrophobicContact CB-CG 3.84Å; L22-P48 HydrophobicContact CD1-CG 4.37Å; L45-P48 WeakPolarHBondContact O-CD 3.12Å; P48-D51 PolarHBondContact O-N 2.86Å; P48-A52 WeakPolarHBondContact O-CB 3.15Å; P48-A52 PolarHBondContact O-N 3.49Å
49F91.8Very high91.9Very high113 Ų11382.8 Ų82.850%0.49643%0.431SS..Hα-helixtrans-69.3-39.2177.5-62.8-71.4000111.7F19 L46 Q47 A52 M53F19-F49 HydrophobicContact CZ-CE2 4.18Å; L46-F49 HydrophobicContact CD2-CD2 4.26Å; L46-F49 PolarHBondContact O-N 2.78Å; Q47-F49 VanDerWaalsContact C-N 3.28Å; Q47-F49 PolarHBondContact O-N 3.32Å; F49-A52 PolarHBondContact O-N 3.43Å; F49-M53 WeakPolarHBondContact O-CB 3.42Å; F49-M53 PolarHBondContact O-N 3.2Å
50A93.3Very high91.6Very high43 Ų4379.6 Ų79.636%0.35541%0.413SS..Hα-helixtrans-64-41.8174.600000111.9V40 L46 Q47 M53 K54V40-A50 HydrophobicContact CG1-CB 3.96Å; L46-A50 PolarHBondContact O-N 3.47Å; L46-A50 VanDerWaalsContact O-N 3.12Å; Q47-A50 PolarHBondContact O-N 3.07Å; A50-M53 PolarHBondContact O-N 3.06Å; A50-K54 VanDerWaalsContact O-CB 3.3Å; A50-K54 WeakPolarHBondContact O-CB 3.3Å; A50-K54 PolarHBondContact O-N 3.19Å
51D91.3Very high91.3Very high28 Ų2881.9 Ų81.915%0.1542%0.423CS..Hα-helixtrans-66-42.9177.2-73.1-1.6000111.3R25 Q47 P48 K54 L55R25-D51 IonicContact CZ-OD2 3.14Å; R25-D51 IonicContact NH1-OD1 3.93Å; R25-D51 IonicContact NH1-OD2 2.73Å; R25-D51 PolarHBondContact NH1-OD2 3.3Å; R25-D51 IonicContact NH2-OD2 3.21Å; R25-D51 PolarHBondContact NH2-OD2 3.44Å; Q47-D51 PolarHBondContact NE2-OD1 3.38Å; Q47-D51 PolarHBondContact O-N 3.02Å; P48-D51 PolarHBondContact O-N 2.86Å; D51-K54 PolarHBondContact O-N 3.16Å; D51-L55 WeakPolarHBondContact O-CG 3.28Å; D51-L55 PolarHBondContact O-N 3Å
52A91Very high90.9Very high38 Ų3887 Ų8731%0.31444%0.437SS..Hα-helixtrans-60.6-50.3174.800000111.3P48 F49 K54 L55 F56P48-A52 WeakPolarHBondContact O-CB 3.15Å; P48-A52 PolarHBondContact O-N 3.49Å; F49-A52 PolarHBondContact O-N 3.43Å; A52-K54 VanDerWaalsContact C-N 3.29Å; A52-K54 PolarHBondContact O-N 2.92Å; A52-L55 PolarHBondContact O-N 3.4Å; A52-L55 VanDerWaalsContact O-N 3.15Å; A52-F56 HydrophobicContact CB-CE2 4.43Å; A52-F56 WeakPolarHBondContact O-CD2 3.37Å; A52-F56 PolarHBondContact O-N 3.29Å
53M92.1Very high90.4Very high135 Ų13584 Ų8467%0.66542%0.417SS*.Hα-helixtrans-60-40.2178.7-172.3176-176.200111.6F49 A50 T57F49-M53 WeakPolarHBondContact O-CB 3.42Å; F49-M53 PolarHBondContact O-N 3.2Å; A50-M53 PolarHBondContact O-N 3.06Å; M53-T57 HydrophobicContact CG-CG2 4.26Å; M53-T57 WeakPolarHBondContact O-CB 3.48Å; M53-T57 VanDerWaalsContact O-CG2 3.22Å; M53-T57 WeakPolarHBondContact O-CG2 3.5Å; M53-T57 PolarHBondContact O-N 3.39Å; M53-T57 PolarHBondContact O-OG1 3.02Å
54K92.9Very high89.8Confident140 Ų14080.8 Ų80.861%0.60943%0.428SS*.Hα-helixtrans-61.3-45.3174.9178.6-174.1175.7-175.20112.1A50 D51 A52 T57 K58A50-K54 VanDerWaalsContact O-CB 3.3Å; A50-K54 WeakPolarHBondContact O-CB 3.3Å; A50-K54 PolarHBondContact O-N 3.19Å; D51-K54 PolarHBondContact O-N 3.16Å; A52-K54 VanDerWaalsContact C-N 3.29Å; A52-K54 PolarHBondContact O-N 2.92Å; K54-T57 PolarHBondContact O-OG1 3.32Å; K54-K58 WeakPolarHBondContact O-CB 3.48Å; K54-K58 PolarHBondContact O-N 3.06Å; K54-K58 VanDerWaalsContact O-N 3.16Å
55L90.9Very high89.2Confident46 Ų4685 Ų8524%0.24145%0.454CS..Hα-helixtrans-69.6-34.7-177.3-72171.7000112.4D51 A52 A217 G218 F220 A221D51-L55 WeakPolarHBondContact O-CG 3.28Å; D51-L55 PolarHBondContact O-N 3Å; A52-L55 PolarHBondContact O-N 3.4Å; A52-L55 VanDerWaalsContact O-N 3.15Å; L55-A217 CarbonylContact O-C 3.31Å; L55-A217 VanDerWaalsContact O-C 3.31Å; L55-A217 WeakPolarHBondContact O-CA 3.2Å; L55-A217 WeakPolarHBondContact O-CB 3.41Å; L55-G218 PolarHBondContact O-N 3.28Å; L55-F220 HydrophobicContact CD2-CD1 4.18Å; L55-A221 HydrophobicContact CB-CB 4.11Å; L55-A221 HydrophobicContact CD1-CB 3.86Å
56F90.7Very high88.7Confident124 Ų12481.8 Ų81.854%0.54444%0.438SS..Hα-helixtrans-81.9-24.6178.9-69.6-61000114.3A52 M225A52-F56 HydrophobicContact CB-CE2 4.43Å; A52-F56 WeakPolarHBondContact O-CD2 3.37Å; A52-F56 PolarHBondContact O-N 3.29Å; F56-M225 HydrophobicContact CZ-CE 4.18Å
57T92.3Very high88.5Confident103 Ų10379.8 Ų79.863%0.63243%0.43SS*.Hα-helixtrans-85.2-20.5176.151.70000113M53 K54M53-T57 HydrophobicContact CG-CG2 4.26Å; M53-T57 WeakPolarHBondContact O-CB 3.48Å; M53-T57 VanDerWaalsContact O-CG2 3.22Å; M53-T57 WeakPolarHBondContact O-CG2 3.5Å; M53-T57 PolarHBondContact O-N 3.39Å; M53-T57 PolarHBondContact O-OG1 3.02Å; K54-T57 PolarHBondContact O-OG1 3.32Å
58K92.6Very high88.1Confident121 Ų12183.7 Ų83.753%0.52645%0.451SS..SBendtrans-69.8142.8178.4-168.7174.9-177.4-173.60110.7K54 A217K54-K58 WeakPolarHBondContact O-CB 3.48Å; K54-K58 PolarHBondContact O-N 3.06Å; K54-K58 VanDerWaalsContact O-N 3.16Å; K58-A217 HydrophobicContact CB-CB 3.83Å; K58-A217 HydrophobicContact CG-CB 4.21Å; K58-A217 VanDerWaalsContact O-CB 3.3Å; K58-A217 WeakPolarHBondContact O-CB 3.43Å
59E89.2Confident87.9Confident150 Ų15088.6 Ų88.670%0.70148%0.481SS*.  trans-58.6128177.5-172.8178.317700111.1L61E59-L61 PolarHBondContact O-N 3.39Å
60P85.1Confident87.9Confident71 Ų7185 Ų8546%0.46147%0.466SS..  trans-74.4106.5173.529.6-31.9000109.7K62P60-K62 PolarHBondContact O-N 2.99Å
61L82.8Confident87.7Confident105 Ų10583.1 Ų83.155%0.5545%0.45SS..  trans-69.4127171.4-66.6166.2000109.2E59 Y71 A216E59-L61 PolarHBondContact O-N 3.39Å; L61-Y71 PolarHBondContact O-OH 3.07Å; L61-A216 HydrophobicContact CB-CB 3.77Å; L61-A216 HydrophobicContact CD1-CB 3.89Å; L61-A216 HydrophobicContact CG-CB 4.03Å
62K82.4Confident87.6Confident133 Ų13385.7 Ų85.758%0.57846%0.463SS*.  trans-116.6116.6171.8-69-178.8-178.4177.50108.4P60P60-K62 PolarHBondContact O-N 2.99Å
63P81.4Confident87.7Confident23 Ų2386.6 Ų86.615%0.14947%0.465CS..  trans-65.8138.5178.9-12.923.8000111.1T65 S66 Y71 E214P63-T65 PolarHBondContact O-N 2.66Å; P63-S66 WeakPolarHBondContact O-CB 3.07Å; P63-S66 PolarHBondContact O-N 3.28Å; P63-S66 PolarHBondContact O-OG 2.88Å; P63-Y71 HydrophobicContact CG-CE2 4.25Å; P63-E214 HydrophobicContact CG-CB 3.83Å; P63-E214 HydrophobicContact CG-CG 4.31Å
64A77.9Confident87.7Confident111 Ų11180.2 Ų80.292%0.91743%0.433SS*.THydrogen-bonded Turntrans-64.9-25.4178.400000113.3
65T80.5Confident87.8Confident89 Ų8973.6 Ų73.655%0.54641%0.405SS..THydrogen-bonded Turntrans-88-2.4-179.250.60000113.5P63 N124P63-T65 PolarHBondContact O-N 2.66Å; T65-N124 VanDerWaalsContact O-CB 3.23Å; T65-N124 WeakPolarHBondContact O-CB 3.48Å; T65-N124 PolarHBondContact O-ND2 3.45Å
66S83.8Confident87.9Confident16 Ų1674.5 Ų74.511%0.11241%0.412CS..SBendtrans-84.6149.4-172.467.90000113.7P63 I68 A122P63-S66 WeakPolarHBondContact O-CB 3.07Å; P63-S66 PolarHBondContact O-N 3.28Å; P63-S66 PolarHBondContact O-OG 2.88Å; S66-I68 PolarHBondContact O-N 3.28Å; S66-A122 CarbonylContact C-O 3.45Å; S66-A122 WeakPolarHBondContact CA-O 3.47Å; S66-A122 WeakPolarHBondContact CB-O 3.45Å
67T89.3Confident88.1Confident53 Ų5370.5 Ų70.533%0.32540%0.396SS..  trans-81.9103.5168.453.80000109.6T69 L70 Y71 W121 A122T67-T69 VanDerWaalsContact C-N 3.29Å; T67-T69 PolarHBondContact O-N 3.35Å; T67-L70 PolarHBondContact O-N 3.02Å; T67-Y71 WeakPolarHBondContact O-CB 3.47Å; T67-Y71 PolarHBondContact O-N 3.23Å; T67-W121 HydrophobicContact CG2-CZ3 4.29Å; T67-A122 PolarHBondContact N-O 3.45Å; T67-A122 WeakPolarHBondContact OG1-CA 3.29Å
68I85.9Confident88.3Confident112 Ų11265.9 Ų65.957%0.57437%0.369SS*.Hα-helixtrans-56.7-39.6-168.4-63.9159.7000112.9S66 I72S66-I68 PolarHBondContact O-N 3.28Å; I68-I72 HydrophobicContact CG2-CD1 3.83Å; I68-I72 WeakPolarHBondContact O-CG1 3.16Å; I68-I72 PolarHBondContact O-N 3.29Å; I68-I72 VanDerWaalsContact O-N 3.14Å
69T89.9Confident88.4Confident106 Ų10661.5 Ų61.565%0.6535%0.351SS*.Hα-helixtrans-62.1-53.9-177.850.70000111.1T67 I72 T73T67-T69 VanDerWaalsContact C-N 3.29Å; T67-T69 PolarHBondContact O-N 3.35Å; T69-I72 PolarHBondContact O-N 3.44Å; T69-T73 VanDerWaalsContact O-CG2 3.27Å; T69-T73 WeakPolarHBondContact O-CG2 3.49Å; T69-T73 PolarHBondContact O-N 3.16Å; T69-T73 PolarHBondContact O-OG1 3.12Å; T69-T73 VanDerWaalsContact O-OG1 3.09Å
70L90.5Very high88.7Confident37 Ų3757.9 Ų57.919%0.19434%0.339CS..Hα-helixtrans-68.8-35.5180-68.4174.5000112.5T67 I72 T73 A74 W118 W121 A122T67-L70 PolarHBondContact O-N 3.02Å; L70-I72 VanDerWaalsContact C-N 3.28Å; L70-I72 PolarHBondContact O-N 3.11Å; L70-T73 WeakPolarHBondContact CA-OG1 3.45Å; L70-T73 PolarHBondContact O-N 2.71Å; L70-T73 PolarHBondContact O-OG1 3.28Å; L70-A74 WeakPolarHBondContact O-CB 3.49Å; L70-A74 PolarHBondContact O-N 2.66Å; L70-W118 HydrophobicContact CD2-CB 4.42Å; L70-W118 HydrophobicContact CD2-CD2 3.92Å; L70-W118 HydrophobicContact CD2-CE3 4.04Å; L70-W118 HydrophobicContact CD2-CG 4.1Å; L70-W121 HydrophobicContact CD1-CE3 3.43Å; L70-W121 VanDerWaalsContact CD1-CE3 3.43Å; L70-W121 HydrophobicContact CD1-CZ3 3.4Å; L70-W121 VanDerWaalsContact CD1-CZ3 3.4Å; L70-A122 HydrophobicContact CB-CB 3.67Å
71Y89.2Confident89.2Confident5 Ų554.7 Ų54.72%0.0232%0.318CS..Hα-helixtrans-62.3-35.9178.2-173.6-88.4000112.1L61 P63 T67 P75 E214 Y215L61-Y71 PolarHBondContact O-OH 3.07Å; P63-Y71 HydrophobicContact CG-CE2 4.25Å; T67-Y71 WeakPolarHBondContact O-CB 3.47Å; T67-Y71 PolarHBondContact O-N 3.23Å; Y71-P75 WeakPolarHBondContact O-CD 3.39Å; Y71-E214 HydrophobicContact CE2-CB 4.5Å; Y71-E214 PolarHBondContact OH-O 2.95Å; Y71-Y215 HydrophobicContact CD1-CE1 4.06Å; Y71-Y215 HydrophobicContact CD2-CD1 4.36Å; Y71-Y215 AromaticContact CD2-CE1 3.62Å; Y71-Y215 HydrophobicContact CD2-CE1 3.62Å; Y71-Y215 HydrophobicContact CD2-CE2 4.05Å; Y71-Y215 AromaticContact CD2-CZ 3.44Å; Y71-Y215 VanDerWaalsContact CD2-CZ 3.44Å; Y71-Y215 WeakPolarHBondContact CD2-OH 3.3Å; Y71-Y215 HydrophobicContact CE1-CD1 4.06Å; Y71-Y215 AromaticContact CE1-CE1 3.91Å; Y71-Y215 HydrophobicContact CE1-CE1 3.91Å; Y71-Y215 AromaticContact CE2-CD1 3.74Å; Y71-Y215 HydrophobicContact CE2-CD1 3.74Å; Y71-Y215 HydrophobicContact CE2-CD2 4.04Å; Y71-Y215 AromaticContact CE2-CE1 3.47Å; Y71-Y215 HydrophobicContact CE2-CE1 3.47Å; Y71-Y215 VanDerWaalsContact CE2-CE1 3.47Å; Y71-Y215 AromaticContact CE2-CE2 3.79Å; Y71-Y215 HydrophobicContact CE2-CE2 3.79Å; Y71-Y215 HydrophobicContact CE2-CG 4.03Å; Y71-Y215 AromaticContact CE2-CZ 3.5Å; Y71-Y215 VanDerWaalsContact CE2-CZ 3.5Å; Y71-Y215 AromaticContact CG-CE1 3.93Å; Y71-Y215 HydrophobicContact CG-CE1 3.93Å; Y71-Y215 AromaticContact CZ-CD1 3.57Å; Y71-Y215 AromaticContact CZ-CE1 3.62Å; Y71-Y215 WeakPolarHBondContact O-CE1 3.29Å; Y71-Y215 WeakPolarHBondContact OH-CA 3.47Å
72I90.1Very high89.8Confident82 Ų8249.7 Ų49.742%0.42129%0.292SS..Hα-helixtrans-83-39.3177-63.5171000111.2I68 T69 L70 T76I68-I72 HydrophobicContact CG2-CD1 3.83Å; I68-I72 WeakPolarHBondContact O-CG1 3.16Å; I68-I72 PolarHBondContact O-N 3.29Å; I68-I72 VanDerWaalsContact O-N 3.14Å; T69-I72 PolarHBondContact O-N 3.44Å; L70-I72 VanDerWaalsContact C-N 3.28Å; L70-I72 PolarHBondContact O-N 3.11Å; I72-T76 WeakPolarHBondContact O-CG2 3.27Å
73T92.6Very high90.4Very high57 Ų5745 Ų4535%0.3527%0.273SS..Hα-helixtrans-73.2-34.3-175.958.30000112.8T69 L70 T76 L77T69-T73 VanDerWaalsContact O-CG2 3.27Å; T69-T73 WeakPolarHBondContact O-CG2 3.49Å; T69-T73 PolarHBondContact O-N 3.16Å; T69-T73 PolarHBondContact O-OG1 3.12Å; T69-T73 VanDerWaalsContact O-OG1 3.09Å; L70-T73 WeakPolarHBondContact CA-OG1 3.45Å; L70-T73 PolarHBondContact O-N 2.71Å; L70-T73 PolarHBondContact O-OG1 3.28Å; T73-T76 WeakPolarHBondContact CA-OG1 3.39Å; T73-T76 PolarHBondContact O-N 3.27Å; T73-T76 PolarHBondContact O-OG1 3.08Å; T73-L77 WeakPolarHBondContact O-CB 3.41Å; T73-L77 PolarHBondContact O-N 3.43Å
74A92.9Very high91.1Very high0 Ų047.8 Ų47.80%029%0.286CS..Hα-helixtrans-59.2-51-175.500000114.1L70 T76 L77 A78 W118 F223L70-A74 WeakPolarHBondContact O-CB 3.49Å; L70-A74 PolarHBondContact O-N 2.66Å; A74-T76 VanDerWaalsContact C-N 3.31Å; A74-T76 PolarHBondContact O-N 2.92Å; A74-L77 PolarHBondContact O-N 2.65Å; A74-A78 PolarHBondContact O-N 2.91Å; A74-W118 HydrophobicContact CB-CB 3.97Å; A74-F223 HydrophobicContact CB-CZ 4.21Å
75P93.3Very high91.9Very high1 Ų142.6 Ų42.61%0.00624%0.243CC..Hα-helixtrans-63.6-35.2175.8-11.718.4000113.3Y71 A78 L79 Y215 P219 L222 F223Y71-P75 WeakPolarHBondContact O-CD 3.39Å; P75-A78 PolarHBondContact O-N 3.25Å; P75-L79 PolarHBondContact O-N 3.45Å; P75-Y215 HydrophobicContact CG-CD1 4.05Å; P75-Y215 HydrophobicContact CG-CE1 3.61Å; P75-P219 WeakPolarHBondContact CB-O 3.25Å; P75-P219 HydrophobicContact CG-CB 4.08Å; P75-L222 HydrophobicContact CB-CB 3.72Å; P75-L222 HydrophobicContact CB-CD1 3.86Å; P75-L222 HydrophobicContact CB-CG 4.45Å; P75-F223 HydrophobicContact CB-CD2 4.07Å; P75-F223 HydrophobicContact CB-CE2 3.77Å; P75-F223 HydrophobicContact CB-CZ 4.01Å; P75-F223 HydrophobicContact CG-CD2 4.22Å; P75-F223 HydrophobicContact CG-CE2 3.54Å; P75-F223 HydrophobicContact CG-CZ 3.89Å
76T93.9Very high92.7Very high66 Ų6638.9 Ų38.941%0.40522%0.219SC..Hα-helixtrans-67.3-39.7176.862.90000111.4I72 T73 A74 L79 T80 L222I72-T76 WeakPolarHBondContact O-CG2 3.27Å; T73-T76 WeakPolarHBondContact CA-OG1 3.39Å; T73-T76 PolarHBondContact O-N 3.27Å; T73-T76 PolarHBondContact O-OG1 3.08Å; A74-T76 VanDerWaalsContact C-N 3.31Å; A74-T76 PolarHBondContact O-N 2.92Å; T76-L79 PolarHBondContact O-N 3.36Å; T76-T80 VanDerWaalsContact O-CG2 3.31Å; T76-T80 WeakPolarHBondContact O-CG2 3.38Å; T76-T80 PolarHBondContact O-N 2.99Å; T76-T80 PolarHBondContact O-OG1 2.99Å; T76-L222 HydrophobicContact CG2-CD1 4.27Å
77L95.5Very high93.1Very high39 Ų3939.2 Ų39.220%0.20422%0.221CC..Hα-helixtrans-65-40.5176.3-168.1112.8000111.2T73 A74 L79 T80 I81 W118T73-L77 WeakPolarHBondContact O-CB 3.41Å; T73-L77 PolarHBondContact O-N 3.43Å; A74-L77 PolarHBondContact O-N 2.65Å; L77-L79 PolarHBondContact O-N 3.45Å; L77-T80 WeakPolarHBondContact CA-OG1 3.5Å; L77-T80 PolarHBondContact O-N 2.91Å; L77-T80 PolarHBondContact O-OG1 2.97Å; L77-I81 HydrophobicContact CD2-CD1 3.47Å; L77-I81 VanDerWaalsContact CD2-CD1 3.47Å; L77-I81 HydrophobicContact CG-CD1 3.7Å; L77-I81 HydrophobicContact CG-CG1 4.37Å; L77-I81 WeakPolarHBondContact O-CB 3.47Å; L77-I81 WeakPolarHBondContact O-CD1 3.49Å; L77-I81 WeakPolarHBondContact O-CG1 3.4Å; L77-I81 PolarHBondContact O-N 3.5Å; L77-W118 HydrophobicContact CD1-CZ3 4.08Å; L77-W118 HydrophobicContact CD2-CZ3 4.49Å
78A94.6Very high93.4Very high6 Ų636.9 Ų36.95%0.0521%0.206CC..Hα-helixtrans-57.5-49.9176.800000111.5A74 P75 A82 F223 A226A74-A78 PolarHBondContact O-N 2.91Å; P75-A78 PolarHBondContact O-N 3.25Å; A78-A82 WeakPolarHBondContact O-CB 3.4Å; A78-A82 PolarHBondContact O-N 3.04Å; A78-F223 HydrophobicContact CB-CD1 3.8Å; A78-F223 HydrophobicContact CB-CE1 3.79Å; A78-A226 HydrophobicContact CB-CB 3.87Å
79L95.3Very high93.7Very high29 Ų2931.9 Ų31.915%0.15218%0.181CC..Hα-helixtrans-68.9-40.1-179.6-174.868.5000112.3P75 T76 L77 A82 L83 L222 M225P75-L79 PolarHBondContact O-N 3.45Å; T76-L79 PolarHBondContact O-N 3.36Å; L77-L79 PolarHBondContact O-N 3.45Å; L79-A82 PolarHBondContact O-N 3.1Å; L79-L83 HydrophobicContact CD1-CD1 4.43Å; L79-L83 HydrophobicContact CD1-CG 4.43Å; L79-L83 HydrophobicContact CG-CD1 4.13Å; L79-L83 HydrophobicContact CG-CG 4.5Å; L79-L83 WeakPolarHBondContact O-CG 3.07Å; L79-L83 PolarHBondContact O-N 3.25Å; L79-L222 HydrophobicContact CB-CD2 4.47Å; L79-L222 HydrophobicContact CD2-CD2 3.61Å; L79-M225 HydrophobicContact CD1-CB 4.04Å
80T95.6Very high93.8Very high74 Ų7426.8 Ų26.845%0.45415%0.15SC..Hα-helixtrans-64-43.2179.454.10000111.5T76 L77 L83 L84T76-T80 VanDerWaalsContact O-CG2 3.31Å; T76-T80 WeakPolarHBondContact O-CG2 3.38Å; T76-T80 PolarHBondContact O-N 2.99Å; T76-T80 PolarHBondContact O-OG1 2.99Å; L77-T80 WeakPolarHBondContact CA-OG1 3.5Å; L77-T80 PolarHBondContact O-N 2.91Å; L77-T80 PolarHBondContact O-OG1 2.97Å; T80-L83 PolarHBondContact O-N 3.28Å; T80-L84 WeakPolarHBondContact O-CB 3.19Å; T80-L84 VanDerWaalsContact O-CG 3.23Å; T80-L84 WeakPolarHBondContact O-CG 3.4Å; T80-L84 PolarHBondContact O-N 3.5Å
81I95.8Very high93.7Very high5 Ų527.9 Ų27.93%0.02615%0.154CC..Hα-helixtrans-63.1-45.8176-65.8168000110.4L77 L83 L84 L85 T108 L111 A112L77-I81 HydrophobicContact CD2-CD1 3.47Å; L77-I81 VanDerWaalsContact CD2-CD1 3.47Å; L77-I81 HydrophobicContact CG-CD1 3.7Å; L77-I81 HydrophobicContact CG-CG1 4.37Å; L77-I81 WeakPolarHBondContact O-CB 3.47Å; L77-I81 WeakPolarHBondContact O-CD1 3.49Å; L77-I81 WeakPolarHBondContact O-CG1 3.4Å; L77-I81 PolarHBondContact O-N 3.5Å; I81-L83 VanDerWaalsContact C-N 3.26Å; I81-L83 PolarHBondContact O-N 3.43Å; I81-L84 PolarHBondContact O-N 3.42Å; I81-L84 VanDerWaalsContact O-N 3.13Å; I81-L85 HydrophobicContact CG2-CD1 4.1Å; I81-L85 WeakPolarHBondContact O-CG 3.4Å; I81-L85 PolarHBondContact O-N 3.33Å; I81-L85 VanDerWaalsContact O-N 3.13Å; I81-T108 VanDerWaalsContact CG2-O 3.26Å; I81-T108 WeakPolarHBondContact CG2-O 3.48Å; I81-L111 HydrophobicContact CD1-CB 4.02Å; I81-L111 HydrophobicContact CD1-CD2 3.78Å; I81-L111 HydrophobicContact CD1-CG 3.71Å; I81-L111 HydrophobicContact CG1-CD2 4.07Å; I81-L111 HydrophobicContact CG1-CG 4.5Å; I81-A112 HydrophobicContact CG2-CB 3.98Å
82A95.6Very high93.6Very high0 Ų028.1 Ų28.10%016%0.157CC..Hα-helixtrans-60.2-36-179.700000112.7A78 L79 W86 A226 T229 N230A78-A82 WeakPolarHBondContact O-CB 3.4Å; A78-A82 PolarHBondContact O-N 3.04Å; L79-A82 PolarHBondContact O-N 3.1Å; A82-W86 PolarHBondContact O-NE1 3.38Å; A82-A226 HydrophobicContact CB-CB 4.07Å; A82-T229 VanDerWaalsContact CB-OG1 3.23Å; A82-T229 WeakPolarHBondContact CB-OG1 3.42Å; A82-N230 WeakPolarHBondContact CA-OD1 3.39Å; A82-N230 VanDerWaalsContact CB-OD1 3.27Å; A82-N230 WeakPolarHBondContact CB-OD1 3.45Å
83L95.2Very high93.7Very high33 Ų3329.6 Ų29.617%0.17317%0.165CC..Hα-helixtrans-76.8-35174.8-68.5174.4000113I10 I13 L79 T80 I81 L85 W86I10-L83 HydrophobicContact CG2-CD1 4.16Å; I10-L83 HydrophobicContact CG2-CD2 4.16Å; I13-L83 HydrophobicContact CG2-CD2 4.45Å; L79-L83 HydrophobicContact CD1-CD1 4.43Å; L79-L83 HydrophobicContact CD1-CG 4.43Å; L79-L83 HydrophobicContact CG-CD1 4.13Å; L79-L83 HydrophobicContact CG-CG 4.5Å; L79-L83 WeakPolarHBondContact O-CG 3.07Å; L79-L83 PolarHBondContact O-N 3.25Å; T80-L83 PolarHBondContact O-N 3.28Å; I81-L83 VanDerWaalsContact C-N 3.26Å; I81-L83 PolarHBondContact O-N 3.43Å; L83-L85 VanDerWaalsContact C-N 3.29Å; L83-L85 PolarHBondContact O-N 2.91Å; L83-W86 PolarHBondContact O-N 3.49Å
84L95.4Very high93.7Very high83 Ų8328 Ų2844%0.43516%0.156SC..Hα-helixtrans-63-35.1177.9-78.4167.9000112.5T80 I81 W86 T87T80-L84 WeakPolarHBondContact O-CB 3.19Å; T80-L84 VanDerWaalsContact O-CG 3.23Å; T80-L84 WeakPolarHBondContact O-CG 3.4Å; T80-L84 PolarHBondContact O-N 3.5Å; I81-L84 PolarHBondContact O-N 3.42Å; I81-L84 VanDerWaalsContact O-N 3.13Å; L84-W86 PolarHBondContact O-N 2.91Å; L84-W86 VanDerWaalsContact O-N 3.1Å; L84-T87 WeakPolarHBondContact O-CB 3.39Å; L84-T87 WeakPolarHBondContact O-CG2 3.29Å; L84-T87 PolarHBondContact O-N 2.74Å; L84-T87 VanDerWaalsContact O-N 3.08Å; L84-T87 PolarHBondContact O-OG1 3.47Å
85L95.6Very high93.7Very high2 Ų231 Ų311%0.0117%0.171CC..THydrogen-bonded Turntrans-59.1-20.1178.3-77.4159.2000113.7I81 L83 P88 I105 T108 M233I81-L85 HydrophobicContact CG2-CD1 4.1Å; I81-L85 WeakPolarHBondContact O-CG 3.4Å; I81-L85 PolarHBondContact O-N 3.33Å; I81-L85 VanDerWaalsContact O-N 3.13Å; L83-L85 VanDerWaalsContact C-N 3.29Å; L83-L85 PolarHBondContact O-N 2.91Å; L85-P88 WeakPolarHBondContact O-CD 3.24Å; L85-I105 HydrophobicContact CD2-CB 4.34Å; L85-I105 HydrophobicContact CD2-CG2 3.89Å; L85-T108 WeakPolarHBondContact CD2-OG1 3.31Å; L85-M233 HydrophobicContact CB-CE 3.8Å; L85-M233 HydrophobicContact CB-CG 3.87Å; L85-M233 HydrophobicContact CB-SD 3.91Å; L85-M233 HydrophobicContact CD1-CE 3.5Å; L85-M233 VanDerWaalsContact CD1-CE 3.5Å; L85-M233 HydrophobicContact CD2-CE 4.12Å; L85-M233 HydrophobicContact CD2-SD 4.44Å; L85-M233 HydrophobicContact CG-CE 4Å
86W95.8Very high93.7Very high10 Ų1034 Ų344%0.03819%0.19CC..THydrogen-bonded Turntrans-81.9-19.2177.8-68.883.4000114.5L9 I13 A82 L83 L84 L89 M91 I232 M233 T236L9-W86 HydrophobicContact CD2-CB 4.28Å; I13-W86 HydrophobicContact CD1-CB 3.91Å; I13-W86 HydrophobicContact CD1-CD2 3.46Å; I13-W86 VanDerWaalsContact CD1-CD2 3.46Å; I13-W86 HydrophobicContact CD1-CE3 3.66Å; I13-W86 HydrophobicContact CD1-CG 3.58Å; I13-W86 HydrophobicContact CD1-CZ3 4.32Å; I13-W86 HydrophobicContact CG1-CD2 4.09Å; I13-W86 HydrophobicContact CG1-CE3 4.07Å; I13-W86 HydrophobicContact CG1-CH2 4.39Å; I13-W86 HydrophobicContact CG1-CZ2 4.45Å; I13-W86 HydrophobicContact CG1-CZ3 4.23Å; I13-W86 HydrophobicContact CG2-CD2 4.41Å; I13-W86 HydrophobicContact CG2-CZ2 3.9Å; A82-W86 PolarHBondContact O-NE1 3.38Å; L83-W86 PolarHBondContact O-N 3.49Å; L84-W86 PolarHBondContact O-N 2.91Å; L84-W86 VanDerWaalsContact O-N 3.1Å; W86-L89 HydrophobicContact CD2-CD1 4.19Å; W86-L89 HydrophobicContact CE3-CD1 3.81Å; W86-L89 HydrophobicContact CZ3-CD1 4.37Å; W86-L89 PolarHBondContact O-N 2.88Å; W86-M91 HydrophobicContact CE3-CE 3.65Å; W86-M91 HydrophobicContact CZ3-CE 3.57Å; W86-I232 HydrophobicContact CH2-CB 3.95Å; W86-I232 HydrophobicContact CH2-CG2 3.56Å; W86-I232 HydrophobicContact CZ2-CB 3.93Å; W86-I232 HydrophobicContact CZ2-CG2 4.08Å; W86-M233 HydrophobicContact CD2-CB 4.44Å; W86-M233 HydrophobicContact CD2-CG 4.4Å; W86-M233 HydrophobicContact CZ2-CB 3.77Å; W86-T236 HydrophobicContact CH2-CG2 3.98Å; W86-T236 HydrophobicContact CZ3-CG2 3.96Å
87T93.4Very high93.7Very high24 Ų2435.5 Ų35.515%0.14720%0.195CC..THydrogen-bonded Turntrans-61.5-38.4-172.160.60000115L84 L95 V96L84-T87 WeakPolarHBondContact O-CB 3.39Å; L84-T87 WeakPolarHBondContact O-CG2 3.29Å; L84-T87 PolarHBondContact O-N 2.74Å; L84-T87 VanDerWaalsContact O-N 3.08Å; L84-T87 PolarHBondContact O-OG1 3.47Å; T87-L95 HydrophobicContact CG2-CD2 4.17Å; T87-L95 PolarHBondContact O-N 2.87Å; T87-V96 PolarHBondContact O-N 3.02Å; T87-V96 VanDerWaalsContact O-N 3.1Å
88P94.6Very high93.5Very high4 Ų436.2 Ų36.23%0.02620%0.199CC..THydrogen-bonded Turntrans-89-5.917939.2-40.6000113.8L85 P90 P94 L98 F104 I105 L162L85-P88 WeakPolarHBondContact O-CD 3.24Å; P88-P90 WeakPolarHBondContact O-CD 3.33Å; P88-P94 WeakPolarHBondContact O-CB 3.34Å; P88-L98 HydrophobicContact CB-CD1 4.34Å; P88-F104 HydrophobicContact CG-CD1 3.92Å; P88-F104 HydrophobicContact CG-CE1 4.27Å; P88-I105 HydrophobicContact CG-CD1 3.9Å; P88-I105 HydrophobicContact CG-CG1 3.7Å; P88-L162 HydrophobicContact CB-CD1 4.09Å; P88-L162 HydrophobicContact CG-CD1 4.27Å; P88-L162 WeakPolarHBondContact O-CD1 3.16Å
89L93.9Very high93.4Very high6 Ų642 Ų423%0.03123%0.229CC..  trans-69.3125.4-174.5-72.4176.7000111W86 M91 P94 I105 L162 M233 T236 L237W86-L89 HydrophobicContact CD2-CD1 4.19Å; W86-L89 HydrophobicContact CE3-CD1 3.81Å; W86-L89 HydrophobicContact CZ3-CD1 4.37Å; W86-L89 PolarHBondContact O-N 2.88Å; L89-M91 PolarHBondContact O-N 3.32Å; L89-P94 WeakPolarHBondContact O-CA 3.4Å; L89-I105 HydrophobicContact CD2-CD1 4.04Å; L89-L162 HydrophobicContact CD2-CD1 4.41Å; L89-M233 HydrophobicContact CD1-CG 4.12Å; L89-T236 WeakPolarHBondContact CD1-OG1 2.99Å; L89-L237 HydrophobicContact CD2-CD1 4.16Å
90P91.6Very high93.4Very high0 Ų045.3 Ų45.30%025%0.246CC..  trans-81.2118.1-177.332.9-36.1000111.4P88 P92 L162 I166 T240P88-P90 WeakPolarHBondContact O-CD 3.33Å; P90-P92 WeakPolarHBondContact CB-O 3.38Å; P90-L162 HydrophobicContact CG-CB 3.91Å; P90-I166 HydrophobicContact CB-CD1 3.82Å; P90-I166 HydrophobicContact CG-CD1 4.09Å; P90-T240 HydrophobicContact CG-CG2 4.08Å
91M88.4Confident93.3Very high60 Ų6041.8 Ų41.830%0.29623%0.225SC..SBendtrans-132.485.1172.5-63.6-171-140.400112.5W86 L89 N93 F259W86-M91 HydrophobicContact CE3-CE 3.65Å; W86-M91 HydrophobicContact CZ3-CE 3.57Å; L89-M91 PolarHBondContact O-N 3.32Å; M91-N93 PolarHBondContact N-O 3.21Å; M91-N93 PolarHBondContact O-N 2.83Å; M91-F259 HydrophobicContact CG-CD1 4.21Å; M91-F259 HydrophobicContact CG-CE1 3.91Å; M91-F259 HydrophobicContact SD-CE1 4.35Å
92P87.3Confident93.2Very high10 Ų1041.9 Ų41.97%0.06523%0.225CC..SBend-52.9-20.1-51.326.6-35.3000113.8P90 Y247 P252 Y255 T256P90-P92 WeakPolarHBondContact CB-O 3.38Å; P92-Y247 HydrophobicContact CB-CD2 3.56Å; P92-Y247 HydrophobicContact CB-CE2 3.63Å; P92-Y247 HydrophobicContact CG-CD2 3.98Å; P92-Y247 HydrophobicContact CG-CE2 3.63Å; P92-P252 HydrophobicContact CG-CB 3.98Å; P92-Y255 HydrophobicContact CB-CD1 3.54Å; P92-Y255 HydrophobicContact CB-CD2 4.41Å; P92-Y255 HydrophobicContact CB-CE1 3.92Å; P92-Y255 HydrophobicContact CB-CG 3.84Å; P92-Y255 HydrophobicContact CG-CD1 4.14Å; P92-Y255 HydrophobicContact CG-CG 4.44Å; P92-T256 VanDerWaalsContact CD-CG2 3.42Å
93N90.8Very high93.1Very high112 Ų11245.5 Ų45.560%0.59925%0.245SC*.SBendtrans-99.2130.1175.5-64.3-39.9000109.5M91M91-N93 PolarHBondContact N-O 3.21Å; M91-N93 PolarHBondContact O-N 2.83Å
94P93.6Very high93.1Very high23 Ų2346.9 Ų46.915%0.14925%0.249CC..  trans-73.4158175.131.5-35.4000111.3P88 L89 V96 N97P88-P94 WeakPolarHBondContact O-CB 3.34Å; L89-P94 WeakPolarHBondContact O-CA 3.4Å; P94-V96 VanDerWaalsContact C-N 3.31Å; P94-N97 HydrophobicContact CG-CB 3.89Å
95L93.1Very high93.1Very high63 Ų6343.3 Ų43.333%0.3323%0.23SC..SBendtrans-63.1-43.5172.5-176.977.2000110.4N5 L9 T87N5-L95 HydrophobicContact CB-CD1 3.7Å; L9-L95 HydrophobicContact CD2-CB 4.24Å; L9-L95 HydrophobicContact CD2-CD2 3.89Å; T87-L95 HydrophobicContact CG2-CD2 4.17Å; T87-L95 PolarHBondContact O-N 2.87Å
96V92.8Very high93Very high65 Ų6545.2 Ų45.239%0.39424%0.241SC..SBendtrans-125.5110175.2-173.90000108.2T87 P94 L98T87-V96 PolarHBondContact O-N 3.02Å; T87-V96 VanDerWaalsContact O-N 3.1Å; P94-V96 VanDerWaalsContact C-N 3.31Å; V96-L98 HydrophobicContact CG1-CD2 3.62Å; V96-L98 HydrophobicContact CG1-CG 3.9Å; V96-L98 PolarHBondContact O-N 3.35Å
97N92.8Very high92.9Very high97 Ų9747.3 Ų47.352%0.51926%0.26SS..  trans-76.9108.1174.8-169.13.4000109.6P94 N161P94-N97 HydrophobicContact CG-CB 3.89Å; N97-N161 PolarHBondContact OD1-ND2 2.9Å; N97-N161 PolarHBondContact OD1-OD1 3.39Å
98L93.3Very high93Very high54 Ų5447.1 Ų47.128%0.28326%0.259SS..  trans-109.6129.9-179.9-63.2177.9000110P88 V96 L100 G101 F104P88-L98 HydrophobicContact CB-CD1 4.34Å; V96-L98 HydrophobicContact CG1-CD2 3.62Å; V96-L98 HydrophobicContact CG1-CG 3.9Å; V96-L98 PolarHBondContact O-N 3.35Å; L98-L100 PolarHBondContact O-N 2.87Å; L98-G101 PolarHBondContact O-N 3.43Å; L98-G101 VanDerWaalsContact O-N 3.16Å; L98-F104 HydrophobicContact CD1-CB 4.05Å; L98-F104 HydrophobicContact CD1-CD1 4.19Å; L98-F104 HydrophobicContact CD1-CD2 4.2Å; L98-F104 HydrophobicContact CD1-CG 3.88Å
99N92.4Very high92.8Very high129 Ų12947.1 Ų47.169%0.6926%0.259SS*.THydrogen-bonded Turntrans-59.3-33.4173.4-72.9-1.5000112.3F160 N161N99-F160 CarbonylContact O-C 3.4Å; N99-N161 PolarHBondContact O-N 3.41Å
100L94.1Very high92.7Very high97 Ų9748.9 Ų48.951%0.50827%0.271SS..THydrogen-bonded Turntrans-109.140.7177.8-57.5179.8000111.3L98 L102 L103 F104 F160L98-L100 PolarHBondContact O-N 2.87Å; L100-L102 VanDerWaalsContact C-N 3.3Å; L100-L102 PolarHBondContact O-N 3.05Å; L100-L103 HydrophobicContact CB-CB 4.37Å; 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 3.4Å; L100-F104 PolarHBondContact O-N 3.45Å; L100-F160 HydrophobicContact CD2-CB 3.97Å; L100-F160 HydrophobicContact CD2-CD2 3.95Å; L100-F160 HydrophobicContact CD2-CG 4.16Å
101G94Very high92.7Very high1 Ų152.6 Ų52.61%0.0129%0.291CS..Hα-helixtrans-57.1-39.4-175.300000113.7L98 F104 I105 F160L98-G101 PolarHBondContact O-N 3.43Å; L98-G101 VanDerWaalsContact O-N 3.16Å; G101-F104 WeakPolarHBondContact O-CB 3.35Å; G101-F104 PolarHBondContact O-N 3.42Å; G101-I105 PolarHBondContact O-N 3.39Å; G101-I105 VanDerWaalsContact O-N 3.12Å; G101-F160 PolarHBondContact N-O 3.09Å
102L93.2Very high92.9Very high6 Ų650.7 Ų50.73%0.03129%0.285CS..Hα-helixtrans-71.1-40.4-179.9-163.8152.1000112.7L100 F104 I105 L106 L150 L154 F160 L162L100-L102 VanDerWaalsContact C-N 3.3Å; L100-L102 PolarHBondContact O-N 3.05Å; L102-F104 VanDerWaalsContact C-N 3.27Å; L102-F104 PolarHBondContact O-N 3.14Å; L102-I105 PolarHBondContact O-N 2.94Å; L102-L106 PolarHBondContact O-N 3.01Å; L102-L150 HydrophobicContact CD1-CD2 3.69Å; L102-L150 HydrophobicContact CD2-CB 3.95Å; L102-L150 HydrophobicContact CD2-CD1 3.86Å; L102-L150 HydrophobicContact CD2-CD2 3.9Å; L102-L150 HydrophobicContact CD2-CG 4.09Å; L102-L150 HydrophobicContact CG-CD2 4.12Å; L102-L154 HydrophobicContact CD1-CD1 3.94Å; L102-L154 HydrophobicContact CD1-CD2 3.71Å; L102-L154 HydrophobicContact CD1-CG 4Å; L102-L154 HydrophobicContact CD2-CD1 3.95Å; L102-L154 HydrophobicContact CG-CD1 4.38Å; L102-F160 PolarHBondContact N-O 2.92Å; L102-F160 VanDerWaalsContact N-O 3.16Å; L102-L162 HydrophobicContact CB-CD2 4.43Å; L102-L162 HydrophobicContact CD1-CD2 4.36Å
103L94Very high93.1Very high77 Ų7751 Ų5140%0.40329%0.286SS..Hα-helixtrans-63.4-35.5173.3-71.2173000111.7L100 L106 A107 F160L100-L103 HydrophobicContact CB-CB 4.37Å; 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 3.4Å; L103-L106 PolarHBondContact O-N 2.88Å; L103-A107 WeakPolarHBondContact O-CB 3.43Å; L103-A107 PolarHBondContact O-N 3.47Å; L103-F160 HydrophobicContact CD1-CD1 4.15Å; L103-F160 HydrophobicContact CD1-CE1 4.23Å; L103-F160 HydrophobicContact CD1-CG 4.38Å; L103-F160 HydrophobicContact CD2-CD1 4.42Å; L103-F160 HydrophobicContact CD2-CE1 4.18Å; L103-F160 HydrophobicContact CG-CD1 3.84Å; L103-F160 HydrophobicContact CG-CE1 4.04Å; L103-F160 HydrophobicContact CG-CG 4.43Å
104F95.6Very high93.2Very high62 Ų6251.2 Ų51.227%0.27228%0.28SS..Hα-helixtrans-61.4-43.6173.3173.5-91.2000111.6P88 L98 L100 G101 L102 A107 T108P88-F104 HydrophobicContact CG-CD1 3.92Å; P88-F104 HydrophobicContact CG-CE1 4.27Å; L98-F104 HydrophobicContact CD1-CB 4.05Å; L98-F104 HydrophobicContact CD1-CD1 4.19Å; L98-F104 HydrophobicContact CD1-CD2 4.2Å; L98-F104 HydrophobicContact CD1-CG 3.88Å; L100-F104 PolarHBondContact O-N 3.45Å; G101-F104 WeakPolarHBondContact O-CB 3.35Å; G101-F104 PolarHBondContact O-N 3.42Å; L102-F104 VanDerWaalsContact C-N 3.27Å; L102-F104 PolarHBondContact O-N 3.14Å; F104-A107 PolarHBondContact O-N 3.23Å; F104-T108 HydrophobicContact CD1-CG2 4.39Å; F104-T108 HydrophobicContact CD2-CG2 4.21Å; F104-T108 HydrophobicContact CE1-CG2 4Å; F104-T108 HydrophobicContact CE2-CG2 3.79Å; F104-T108 HydrophobicContact CZ-CG2 3.69Å; F104-T108 WeakPolarHBondContact O-CB 3.31Å; F104-T108 WeakPolarHBondContact O-CG2 3.46Å; F104-T108 PolarHBondContact O-N 3.29Å; F104-T108 PolarHBondContact O-OG1 2.85Å
105I94.8Very high93.2Very high7 Ų750.5 Ų50.54%0.03628%0.275CS..Hα-helixtrans-60.6-46.7175.5-68.5-179.1000110.7L85 P88 L89 G101 L102 A107 T108 S109 L162 L237L85-I105 HydrophobicContact CD2-CB 4.34Å; L85-I105 HydrophobicContact CD2-CG2 3.89Å; P88-I105 HydrophobicContact CG-CD1 3.9Å; P88-I105 HydrophobicContact CG-CG1 3.7Å; L89-I105 HydrophobicContact CD2-CD1 4.04Å; G101-I105 PolarHBondContact O-N 3.39Å; G101-I105 VanDerWaalsContact O-N 3.12Å; L102-I105 PolarHBondContact O-N 2.94Å; I105-A107 PolarHBondContact O-N 3.4Å; I105-T108 PolarHBondContact O-N 3.48Å; I105-T108 PolarHBondContact O-OG1 3.42Å; I105-T108 VanDerWaalsContact O-OG1 3.12Å; I105-S109 WeakPolarHBondContact O-CB 3.48Å; I105-S109 PolarHBondContact O-N 2.99Å; I105-S109 PolarHBondContact O-OG 2.78Å; I105-L162 HydrophobicContact CD1-CD1 3.66Å; I105-L237 HydrophobicContact CD1-CD1 3.6Å; I105-L237 HydrophobicContact CG2-CD2 4Å
106L93.5Very high93.1Very high43 Ų4348.3 Ų48.323%0.22526%0.264CS..Hα-helixtrans-65.8-39.6-179.3-167.2135.9000112.8L102 L103 S109 S110 L146 A147 L150L102-L106 PolarHBondContact O-N 3.01Å; L103-L106 PolarHBondContact O-N 2.88Å; L106-S109 PolarHBondContact O-OG 2.76Å; L106-S109 VanDerWaalsContact O-OG 3.11Å; L106-S110 PolarHBondContact O-N 3.43Å; L106-S110 VanDerWaalsContact O-N 3.15Å; L106-L146 HydrophobicContact CD1-CD2 4.24Å; L106-A147 HydrophobicContact CD1-CB 3.76Å; L106-L150 HydrophobicContact CD1-CD1 3.81Å
107A94.1Very high93.1Very high54 Ų5447.8 Ų47.845%0.44626%0.258SS..Hα-helixtrans-66.8-42.5176.300000111.5L103 F104 I105 S110 L111L103-A107 WeakPolarHBondContact O-CB 3.43Å; L103-A107 PolarHBondContact O-N 3.47Å; F104-A107 PolarHBondContact O-N 3.23Å; I105-A107 PolarHBondContact O-N 3.4Å; A107-S110 PolarHBondContact O-N 3.03Å; A107-S110 PolarHBondContact O-OG 2.72Å; A107-L111 PolarHBondContact O-N 3.17Å
108T94.3Very high93.1Very high19 Ų1947.6 Ų47.612%0.11725%0.25CS..Hα-helixtrans-73.2-3218049.60000112.7I81 L85 F104 I105 L111 A112I81-T108 VanDerWaalsContact CG2-O 3.26Å; I81-T108 WeakPolarHBondContact CG2-O 3.48Å; L85-T108 WeakPolarHBondContact CD2-OG1 3.31Å; F104-T108 HydrophobicContact CD1-CG2 4.39Å; F104-T108 HydrophobicContact CD2-CG2 4.21Å; F104-T108 HydrophobicContact CE1-CG2 4Å; F104-T108 HydrophobicContact CE2-CG2 3.79Å; F104-T108 HydrophobicContact CZ-CG2 3.69Å; F104-T108 WeakPolarHBondContact O-CB 3.31Å; F104-T108 WeakPolarHBondContact O-CG2 3.46Å; F104-T108 PolarHBondContact O-N 3.29Å; F104-T108 PolarHBondContact O-OG1 2.85Å; I105-T108 PolarHBondContact O-N 3.48Å; I105-T108 PolarHBondContact O-OG1 3.42Å; I105-T108 VanDerWaalsContact O-OG1 3.12Å; T108-L111 WeakPolarHBondContact O-CB 3.17Å; T108-L111 PolarHBondContact O-N 3.16Å; T108-A112 PolarHBondContact O-N 2.76Å
109S91.8Very high93Very high5 Ų545 Ų454%0.03524%0.237CC..Hα-helixtrans-66.5-39.6172.673.70000111.8I105 L106 L111 A112 E192I105-S109 WeakPolarHBondContact O-CB 3.48Å; I105-S109 PolarHBondContact O-N 2.99Å; I105-S109 PolarHBondContact O-OG 2.78Å; L106-S109 PolarHBondContact O-OG 2.76Å; L106-S109 VanDerWaalsContact O-OG 3.11Å; S109-L111 PolarHBondContact O-N 2.9Å; S109-A112 WeakPolarHBondContact O-CB 3.4Å; S109-A112 PolarHBondContact O-N 2.95Å; S109-E192 VanDerWaalsContact CB-OE1 3.28Å; S109-E192 WeakPolarHBondContact CB-OE1 3.38Å; S109-E192 PolarHBondContact OG-OE1 3.4Å
110S91.3Very high92.9Very high42 Ų4238.9 Ų38.929%0.29420%0.204SC..Hα-helixtrans-61.7-28.1173.775.80000113.4L106 A107 A112 V113 E143L106-S110 PolarHBondContact O-N 3.43Å; L106-S110 VanDerWaalsContact O-N 3.15Å; A107-S110 PolarHBondContact O-N 3.03Å; A107-S110 PolarHBondContact O-OG 2.72Å; S110-A112 VanDerWaalsContact C-N 3.32Å; S110-A112 PolarHBondContact O-N 2.9Å; S110-V113 WeakPolarHBondContact O-CG2 3.32Å; S110-E143 WeakPolarHBondContact CA-OE1 3.15Å
111L92.3Very high92.7Very high79 Ų7941.5 Ų41.541%0.41421%0.207SC..Hα-helixtrans-71-27.5174.5-165.572.1000112.2I81 A107 T108 S109 V113 Y114I81-L111 HydrophobicContact CD1-CB 4.02Å; I81-L111 HydrophobicContact CD1-CD2 3.78Å; I81-L111 HydrophobicContact CD1-CG 3.71Å; I81-L111 HydrophobicContact CG1-CD2 4.07Å; I81-L111 HydrophobicContact CG1-CG 4.5Å; A107-L111 PolarHBondContact O-N 3.17Å; T108-L111 WeakPolarHBondContact O-CB 3.17Å; T108-L111 PolarHBondContact O-N 3.16Å; S109-L111 PolarHBondContact O-N 2.9Å; L111-V113 PolarHBondContact O-N 3.3Å; L111-Y114 HydrophobicContact CD1-CD2 3.83Å; L111-Y114 HydrophobicContact CD1-CE2 4.18Å; L111-Y114 HydrophobicContact CG-CD2 4.49Å; L111-Y114 PolarHBondContact O-N 2.91Å; L111-Y114 VanDerWaalsContact O-N 3.14Å
112A91Very high92.6Very high19 Ų1941.4 Ų41.416%0.15721%0.207CC..Hα-helixtrans-61.1-29.5-178.200000112.1I81 T108 S109 S110 Y114 S115I81-A112 HydrophobicContact CG2-CB 3.98Å; T108-A112 PolarHBondContact O-N 2.76Å; S109-A112 WeakPolarHBondContact O-CB 3.4Å; S109-A112 PolarHBondContact O-N 2.95Å; S110-A112 VanDerWaalsContact C-N 3.32Å; S110-A112 PolarHBondContact O-N 2.9Å; A112-Y114 PolarHBondContact O-N 3.48Å; A112-S115 WeakPolarHBondContact O-CB 3.22Å; A112-S115 PolarHBondContact O-N 3.48Å; A112-S115 VanDerWaalsContact O-N 3.07Å; A112-S115 PolarHBondContact O-OG 2.89Å
113V92.4Very high92.2Very high16 Ų1641.1 Ų41.110%0.09721%0.205CC..Hα-helixtrans-58.2-35.2177.9-173.50000112.1S110 L111 S115 I116 L117 V136 T139 E143S110-V113 WeakPolarHBondContact O-CG2 3.32Å; L111-V113 PolarHBondContact O-N 3.3Å; V113-S115 VanDerWaalsContact C-N 3.28Å; V113-S115 PolarHBondContact O-N 3.48Å; V113-I116 PolarHBondContact O-N 3.5Å; V113-L117 PolarHBondContact O-N 3.27Å; V113-V136 HydrophobicContact CG1-CB 4.09Å; V113-V136 HydrophobicContact CG1-CG1 3.99Å; V113-V136 HydrophobicContact CG1-CG2 3.65Å; V113-T139 VanDerWaalsContact CG1-OG1 3.26Å; V113-T139 WeakPolarHBondContact CG1-OG1 3.41Å; V113-T139 HydrophobicContact CG2-CG2 4.02Å; V113-T139 WeakPolarHBondContact CG2-OG1 3.35Å; V113-E143 WeakPolarHBondContact CG2-OE1 3.11Å
114Y92.5Very high91.9Very high118 Ų11842.7 Ų42.746%0.46321%0.214SC..Hα-helixtrans-65.8-31178.6-68.8-77.2000112.7L111 A112 I116 L117 W118L111-Y114 HydrophobicContact CD1-CD2 3.83Å; L111-Y114 HydrophobicContact CD1-CE2 4.18Å; L111-Y114 HydrophobicContact CG-CD2 4.49Å; L111-Y114 PolarHBondContact O-N 2.91Å; L111-Y114 VanDerWaalsContact O-N 3.14Å; A112-Y114 PolarHBondContact O-N 3.48Å; Y114-I116 VanDerWaalsContact C-N 3.29Å; Y114-I116 PolarHBondContact O-N 2.96Å; Y114-L117 PolarHBondContact O-N 3.3Å; Y114-W118 VanDerWaalsContact O-CB 3.27Å; Y114-W118 WeakPolarHBondContact O-CB 3.3Å; Y114-W118 PolarHBondContact O-N 3.33Å
115S92.9Very high91.6Very high7 Ų740.9 Ų40.95%0.04921%0.209CC..Hα-helixtrans-61.4-41.117671.20000111.6A112 V113 S119A112-S115 WeakPolarHBondContact O-CB 3.22Å; A112-S115 PolarHBondContact O-N 3.48Å; A112-S115 VanDerWaalsContact O-N 3.07Å; A112-S115 PolarHBondContact O-OG 2.89Å; V113-S115 VanDerWaalsContact C-N 3.28Å; V113-S115 PolarHBondContact O-N 3.48Å; S115-S119 WeakPolarHBondContact O-CB 3.23Å; S115-S119 PolarHBondContact O-N 2.99Å; S115-S119 PolarHBondContact O-OG 2.94Å
116I91.3Very high91.2Very high18 Ų1846.7 Ų46.79%0.09224%0.24CC..Hα-helixtrans-73.9-39.9180-57.7169.3000110.7V113 Y114 S119 G120 A135 F211V113-I116 PolarHBondContact O-N 3.5Å; Y114-I116 VanDerWaalsContact C-N 3.29Å; Y114-I116 PolarHBondContact O-N 2.96Å; I116-S119 WeakPolarHBondContact CA-OG 3.31Å; I116-S119 PolarHBondContact O-N 3.43Å; I116-S119 PolarHBondContact O-OG 3.33Å; I116-G120 PolarHBondContact O-N 3.26Å; I116-G120 VanDerWaalsContact O-N 3.13Å; I116-A135 HydrophobicContact CG2-CB 3.7Å; I116-F211 HydrophobicContact CG1-CZ 4.49Å; I116-F211 HydrophobicContact CG2-CB 4.06Å; I116-F211 HydrophobicContact CG2-CD1 3.82Å; I116-F211 HydrophobicContact CG2-CD2 4.11Å; I116-F211 HydrophobicContact CG2-CE1 4.27Å; I116-F211 HydrophobicContact CG2-CG 3.73Å
117L92.8Very high91Very high54 Ų5451.5 Ų51.528%0.28326%0.256SS..Hα-helixtrans-65.2-48.2177.7-176.664.8000111.6V113 Y114 S119 G120 W121 V136V113-L117 PolarHBondContact O-N 3.27Å; Y114-L117 PolarHBondContact O-N 3.3Å; L117-S119 VanDerWaalsContact C-N 3.3Å; L117-S119 PolarHBondContact O-N 3.24Å; L117-G120 PolarHBondContact O-N 3.01Å; L117-W121 PolarHBondContact O-N 3.35Å; L117-V136 HydrophobicContact CB-CG2 3.92Å; L117-V136 HydrophobicContact CD1-CG2 3.96Å; L117-V136 HydrophobicContact CG-CG2 4.39Å
118W93.3Very high90.7Very high92 Ų9249 Ų4935%0.34824%0.235SC..Hα-helixtrans-64.1-37.8178.9-69.2-3.3000111.2L70 A74 L77 Y114 A122L70-W118 HydrophobicContact CD2-CB 4.42Å; L70-W118 HydrophobicContact CD2-CD2 3.92Å; L70-W118 HydrophobicContact CD2-CE3 4.04Å; L70-W118 HydrophobicContact CD2-CG 4.1Å; A74-W118 HydrophobicContact CB-CB 3.97Å; L77-W118 HydrophobicContact CD1-CZ3 4.08Å; L77-W118 HydrophobicContact CD2-CZ3 4.49Å; Y114-W118 VanDerWaalsContact O-CB 3.27Å; Y114-W118 WeakPolarHBondContact O-CB 3.3Å; Y114-W118 PolarHBondContact O-N 3.33Å; W118-A122 WeakPolarHBondContact O-CB 3.19Å; W118-A122 PolarHBondContact O-N 3.47Å
119S90.9Very high90.6Very high0 Ų051.1 Ų51.10%025%0.245CC..Hα-helixtrans-65.3-43.1178.867.80000112.5S115 I116 L117 S123 F211 Y215S115-S119 WeakPolarHBondContact O-CB 3.23Å; S115-S119 PolarHBondContact O-N 2.99Å; S115-S119 PolarHBondContact O-OG 2.94Å; I116-S119 WeakPolarHBondContact CA-OG 3.31Å; I116-S119 PolarHBondContact O-N 3.43Å; I116-S119 PolarHBondContact O-OG 3.33Å; L117-S119 VanDerWaalsContact C-N 3.3Å; L117-S119 PolarHBondContact O-N 3.24Å; S119-S123 PolarHBondContact O-N 3.26Å; S119-F211 VanDerWaalsContact OG-CD2 3.27Å; S119-F211 WeakPolarHBondContact OG-CD2 2.98Å; S119-Y215 VanDerWaalsContact CA-OH 3.3Å; S119-Y215 WeakPolarHBondContact CA-OH 3.36Å; S119-Y215 WeakPolarHBondContact CB-OH 3.36Å
120G90.3Very high90.5Very high0 Ų054.5 Ų54.50%026%0.262CS..Hα-helixtrans-64.3-47.517700000112.2I116 L117 S123I116-G120 PolarHBondContact O-N 3.26Å; I116-G120 VanDerWaalsContact O-N 3.13Å; L117-G120 PolarHBondContact O-N 3.01Å; G120-S123 PolarHBondContact O-OG 3.26Å
121W91.6Very high90.3Very high152 Ų15252.5 Ų52.558%0.57625%0.248SC*.Hα-helixtrans-66.9-40.4179.2-16975.1000112.6T67 L70 L117 S123 N124T67-W121 HydrophobicContact CG2-CZ3 4.29Å; L70-W121 HydrophobicContact CD1-CE3 3.43Å; L70-W121 VanDerWaalsContact CD1-CE3 3.43Å; L70-W121 HydrophobicContact CD1-CZ3 3.4Å; L70-W121 VanDerWaalsContact CD1-CZ3 3.4Å; L117-W121 PolarHBondContact O-N 3.35Å; W121-S123 VanDerWaalsContact C-N 3.27Å; W121-S123 PolarHBondContact O-N 2.76Å; W121-N124 PolarHBondContact O-N 3.33Å
122A90.6Very high90.3Very high0 Ų048.8 Ų48.80%023%0.229CC..Hα-helixtrans-66.6-29.3-17800000113.4S66 T67 L70 W118 N124S66-A122 CarbonylContact C-O 3.45Å; S66-A122 WeakPolarHBondContact CA-O 3.47Å; S66-A122 WeakPolarHBondContact CB-O 3.45Å; T67-A122 PolarHBondContact N-O 3.45Å; T67-A122 WeakPolarHBondContact OG1-CA 3.29Å; L70-A122 HydrophobicContact CB-CB 3.67Å; W118-A122 WeakPolarHBondContact O-CB 3.19Å; W118-A122 PolarHBondContact O-N 3.47Å; A122-N124 VanDerWaalsContact C-N 3.26Å; A122-N124 PolarHBondContact O-N 3.17Å
123S85.8Confident90.3Very high0 Ų052.6 Ų52.60%025%0.246CC..THydrogen-bonded Turntrans-71.3-17.8-179.573.70000114.2S119 G120 W121 S125 A128S119-S123 PolarHBondContact O-N 3.26Å; G120-S123 PolarHBondContact O-OG 3.26Å; W121-S123 VanDerWaalsContact C-N 3.27Å; W121-S123 PolarHBondContact O-N 2.76Å; S123-S125 PolarHBondContact O-N 3.31Å; S123-S125 VanDerWaalsContact O-N 3.17Å; S123-A128 WeakPolarHBondContact OG-CB 3.47Å
124N88.1Confident90.2Very high110 Ų11055.1 Ų55.159%0.58825%0.254SS*.THydrogen-bonded Turntrans50.536.3179.5-158.915.3000114.2T65 W121 A122T65-N124 VanDerWaalsContact O-CB 3.23Å; T65-N124 WeakPolarHBondContact O-CB 3.48Å; T65-N124 PolarHBondContact O-ND2 3.45Å; W121-N124 PolarHBondContact O-N 3.33Å; A122-N124 VanDerWaalsContact C-N 3.26Å; A122-N124 PolarHBondContact O-N 3.17Å
125S87.6Confident90Very high23 Ų2349.5 Ų49.516%0.16123%0.232CC..  trans-115.1140.8170.876.10000110.3S123 Y127 A128 L129S123-S125 PolarHBondContact O-N 3.31Å; S123-S125 VanDerWaalsContact O-N 3.17Å; S125-Y127 VanDerWaalsContact C-N 3.29Å; S125-Y127 PolarHBondContact O-N 3.4Å; S125-A128 PolarHBondContact O-N 3.13Å; S125-A128 WeakPolarHBondContact OG-CB 3.27Å; S125-A128 PolarHBondContact OG-N 3.32Å; S125-L129 PolarHBondContact O-N 2.99Å
126N87.6Confident89.9Confident129 Ų12950.3 Ų50.369%0.6924%0.236SC*.Hα-helixtrans-62.2-38.2-176.9-68.9-19.6000111.9L129 I130N126-L129 PolarHBondContact O-N 3.41Å; N126-I130 WeakPolarHBondContact O-CD1 3.09Å; N126-I130 VanDerWaalsContact O-CG1 3.26Å; N126-I130 WeakPolarHBondContact O-CG1 3Å; N126-I130 PolarHBondContact O-N 3.41Å
127Y89.3Confident89.9Confident145 Ų14550.8 Ų50.857%0.56924%0.243SC*.Hα-helixtrans-68.1-41.7179.3-70.5-75.6000112.4S125 L129 I130 G131 L207S125-Y127 VanDerWaalsContact C-N 3.29Å; S125-Y127 PolarHBondContact O-N 3.4Å; Y127-L129 VanDerWaalsContact C-N 3.33Å; Y127-L129 PolarHBondContact O-N 3.01Å; Y127-I130 PolarHBondContact O-N 3.19Å; Y127-G131 PolarHBondContact O-N 3.26Å; Y127-L207 HydrophobicContact CD1-CD2 3.96Å
128A88.3Confident89.8Confident0 Ų048.2 Ų48.20%023%0.229CC..Hα-helixtrans-68.1-35.2177.700000112.4S123 S125 G131 A132 G210 I213S123-A128 WeakPolarHBondContact OG-CB 3.47Å; S125-A128 PolarHBondContact O-N 3.13Å; S125-A128 WeakPolarHBondContact OG-CB 3.27Å; S125-A128 PolarHBondContact OG-N 3.32Å; A128-G131 PolarHBondContact O-N 2.84Å; A128-A132 WeakPolarHBondContact O-CB 3.23Å; A128-A132 PolarHBondContact O-N 3.39Å; A128-G210 VanDerWaalsContact CA-O 3.23Å; A128-G210 WeakPolarHBondContact CA-O 3.05Å; A128-G210 WeakPolarHBondContact CB-O 3.41Å; A128-I213 HydrophobicContact CB-CD1 4.49Å
129L90.3Very high89.7Confident64 Ų6444.2 Ų44.234%0.33522%0.215SC..Hα-helixtrans-65.4-43.6173.8-173.464.8000111.8S125 N126 Y127 A132 L133S125-L129 PolarHBondContact O-N 2.99Å; N126-L129 PolarHBondContact O-N 3.41Å; Y127-L129 VanDerWaalsContact C-N 3.33Å; Y127-L129 PolarHBondContact O-N 3.01Å; L129-A132 PolarHBondContact O-N 3.22Å; L129-L133 HydrophobicContact CG-CD1 4.26Å; L129-L133 WeakPolarHBondContact O-CG 3.08Å; L129-L133 PolarHBondContact O-N 3.36Å
130I89.8Confident89.6Confident77 Ų7748.5 Ų48.540%0.39524%0.237SC..Hα-helixtrans-62.3-43.8176-68164.6000110.8N126 Y127 L133 R134 L207N126-I130 WeakPolarHBondContact O-CD1 3.09Å; N126-I130 VanDerWaalsContact O-CG1 3.26Å; N126-I130 WeakPolarHBondContact O-CG1 3Å; N126-I130 PolarHBondContact O-N 3.41Å; Y127-I130 PolarHBondContact O-N 3.19Å; I130-L133 PolarHBondContact O-N 3.44Å; I130-R134 WeakPolarHBondContact O-CG 3.07Å; I130-R134 PolarHBondContact O-N 2.99Å; I130-L207 HydrophobicContact CB-CD2 4.48Å; I130-L207 HydrophobicContact CG2-CD2 4.1Å
131G88.9Confident89.6Confident0 Ų048.7 Ų48.70%024%0.238CC..Hα-helixtrans-60.9-45.6176.400000112.6Y127 A128 R134 A135Y127-G131 PolarHBondContact O-N 3.26Å; A128-G131 PolarHBondContact O-N 2.84Å; G131-R134 PolarHBondContact O-N 2.71Å; G131-A135 WeakPolarHBondContact O-CB 3.46Å; G131-A135 PolarHBondContact O-N 3.38Å
132A91.3Very high89.5Confident0 Ų041.6 Ų41.60%021%0.211CC..Hα-helixtrans-63.5-44.8177.100000112.3A128 L129 R134 A135 V136 F211A128-A132 WeakPolarHBondContact O-CB 3.23Å; A128-A132 PolarHBondContact O-N 3.39Å; L129-A132 PolarHBondContact O-N 3.22Å; A132-R134 VanDerWaalsContact C-N 3.32Å; A132-R134 PolarHBondContact O-N 2.93Å; A132-A135 PolarHBondContact O-N 3.06Å; A132-V136 WeakPolarHBondContact O-CG2 3.21Å; A132-V136 PolarHBondContact O-N 2.97Å; A132-F211 HydrophobicContact CB-CB 4.28Å
133L91Very high89.7Confident99 Ų9943.5 Ų43.552%0.51822%0.221SC..Hα-helixtrans-63-37.7178-71.8173000112.5L129 I130 A137L129-L133 HydrophobicContact CG-CD1 4.26Å; L129-L133 WeakPolarHBondContact O-CG 3.08Å; L129-L133 PolarHBondContact O-N 3.36Å; I130-L133 PolarHBondContact O-N 3.44Å; L133-A137 WeakPolarHBondContact O-CB 3.21Å; L133-A137 PolarHBondContact O-N 3.41Å
134R90.6Very high90.1Very high70 Ų7046.3 Ų46.326%0.26424%0.238SC..Hα-helixtrans-65.1-44.2173.7-74.6174.4172.6-164.2-3111.8I130 G131 A132 A137 Q138 E206 Y282I130-R134 WeakPolarHBondContact O-CG 3.07Å; I130-R134 PolarHBondContact O-N 2.99Å; G131-R134 PolarHBondContact O-N 2.71Å; A132-R134 VanDerWaalsContact C-N 3.32Å; A132-R134 PolarHBondContact O-N 2.93Å; R134-A137 PolarHBondContact O-N 3.14Å; R134-Q138 VanDerWaalsContact O-CB 3.3Å; R134-Q138 WeakPolarHBondContact O-CB 3.35Å; R134-Q138 PolarHBondContact O-N 3.39Å; R134-E206 IonicContact CZ-OE2 3.63Å; R134-E206 IonicContact NH1-OE2 2.69Å; R134-E206 PolarHBondContact NH1-OE2 3.39Å; R134-E206 IonicContact NH2-OE2 3.7Å; R134-Y282 HydrophobicContact CG-CD2 4.37Å
135A88.8Confident90.3Very high0 Ų041.2 Ų41.20%021%0.21CC..Hα-helixtrans-61.8-44.1176.800000111.6I116 G131 A132 Q138 T139 A201I116-A135 HydrophobicContact CG2-CB 3.7Å; G131-A135 WeakPolarHBondContact O-CB 3.46Å; G131-A135 PolarHBondContact O-N 3.38Å; A132-A135 PolarHBondContact O-N 3.06Å; A135-Q138 WeakPolarHBondContact O-CB 3.47Å; A135-Q138 PolarHBondContact O-N 2.99Å; A135-T139 WeakPolarHBondContact O-CG2 3.3Å; A135-T139 PolarHBondContact O-N 3.03Å; A135-T139 PolarHBondContact O-OG1 3.19Å; A135-A201 HydrophobicContact CB-CB 3.62Å
136V91Very high90.6Very high24 Ų2440.3 Ų40.315%0.14520%0.204CC..Hα-helixtrans-63.7-44.7176.7173.40000111.6V113 L117 A132 Q138 T139 I140V113-V136 HydrophobicContact CG1-CB 4.09Å; V113-V136 HydrophobicContact CG1-CG1 3.99Å; V113-V136 HydrophobicContact CG1-CG2 3.65Å; L117-V136 HydrophobicContact CB-CG2 3.92Å; L117-V136 HydrophobicContact CD1-CG2 3.96Å; L117-V136 HydrophobicContact CG-CG2 4.39Å; A132-V136 WeakPolarHBondContact O-CG2 3.21Å; A132-V136 PolarHBondContact O-N 2.97Å; V136-Q138 VanDerWaalsContact C-N 3.25Å; V136-Q138 PolarHBondContact O-N 3.45Å; V136-T139 PolarHBondContact O-N 3.31Å; V136-T139 PolarHBondContact O-OG1 3.31Å; V136-T139 VanDerWaalsContact O-OG1 3.05Å; V136-I140 HydrophobicContact CG1-CD1 3.63Å; V136-I140 HydrophobicContact CG1-CG1 4.35Å; V136-I140 WeakPolarHBondContact O-CD1 3.38Å; V136-I140 VanDerWaalsContact O-CG1 3.26Å; V136-I140 WeakPolarHBondContact O-CG1 3.32Å; V136-I140 PolarHBondContact O-N 3.19Å; V136-I140 VanDerWaalsContact O-N 3.1Å
137A90.4Very high90.9Very high27 Ų2736 Ų3622%0.22319%0.185CC..Hα-helixtrans-62.4-37.8177.100000111.7L133 R134 S141 Y282L133-A137 WeakPolarHBondContact O-CB 3.21Å; L133-A137 PolarHBondContact O-N 3.41Å; R134-A137 PolarHBondContact O-N 3.14Å; A137-S141 WeakPolarHBondContact O-CB 3.31Å; A137-S141 PolarHBondContact O-N 3.48Å; A137-S141 PolarHBondContact O-OG 3.38Å; A137-Y282 HydrophobicContact CB-CE2 4.07Å; A137-Y282 WeakPolarHBondContact CB-OH 3.39Å
138Q91Very high91.2Very high0 Ų030.3 Ų30.30%017%0.165CC..Hα-helixtrans-61.5-55.6173.9177.6170.2-1900111.5R134 A135 V136 I140 S141 Y142 A191 N194 F198 L285R134-Q138 VanDerWaalsContact O-CB 3.3Å; R134-Q138 WeakPolarHBondContact O-CB 3.35Å; R134-Q138 PolarHBondContact O-N 3.39Å; A135-Q138 WeakPolarHBondContact O-CB 3.47Å; A135-Q138 PolarHBondContact O-N 2.99Å; V136-Q138 VanDerWaalsContact C-N 3.25Å; V136-Q138 PolarHBondContact O-N 3.45Å; Q138-I140 PolarHBondContact O-N 3.09Å; Q138-S141 PolarHBondContact O-N 3.16Å; Q138-S141 VanDerWaalsContact O-N 3.14Å; Q138-S141 PolarHBondContact O-OG 3.31Å; Q138-Y142 HydrophobicContact CG-CD2 3.75Å; Q138-Y142 HydrophobicContact CG-CE2 3.63Å; Q138-Y142 WeakPolarHBondContact O-CD2 3.43Å; Q138-Y142 PolarHBondContact O-N 2.94Å; Q138-Y142 VanDerWaalsContact O-N 3.14Å; Q138-A191 PolarHBondContact NE2-O 2.89Å; Q138-N194 PolarHBondContact NE2-OD1 3.21Å; Q138-F198 PolarHBondContact NE2-O 2.68Å; Q138-F198 PolarHBondContact OE1-O 3.24Å; Q138-L285 HydrophobicContact CG-CD1 4.2Å; Q138-L285 HydrophobicContact CG-CD2 4.44Å
139T90.6Very high91.6Very high8 Ų830.3 Ų30.35%0.04917%0.165CC..Hα-helixtrans-60.5-45.2-175.955.20000112.1V113 A135 V136 S141 Y142 E143V113-T139 VanDerWaalsContact CG1-OG1 3.26Å; V113-T139 WeakPolarHBondContact CG1-OG1 3.41Å; V113-T139 HydrophobicContact CG2-CG2 4.02Å; V113-T139 WeakPolarHBondContact CG2-OG1 3.35Å; A135-T139 WeakPolarHBondContact O-CG2 3.3Å; A135-T139 PolarHBondContact O-N 3.03Å; A135-T139 PolarHBondContact O-OG1 3.19Å; V136-T139 PolarHBondContact O-N 3.31Å; V136-T139 PolarHBondContact O-OG1 3.31Å; V136-T139 VanDerWaalsContact O-OG1 3.05Å; T139-S141 VanDerWaalsContact C-N 3.27Å; T139-S141 PolarHBondContact O-N 2.94Å; T139-Y142 PolarHBondContact O-N 3.2Å; T139-E143 WeakPolarHBondContact O-CB 3.16Å; T139-E143 WeakPolarHBondContact O-CG 3.22Å; T139-E143 PolarHBondContact O-N 3.23Å
140I89.1Confident91.8Very high91 Ų9127.6 Ų27.647%0.46715%0.151SC..Hα-helixtrans-58.3-42.2177.5-65167.1000110.9V136 Q138 Y142 E143V136-I140 HydrophobicContact CG1-CD1 3.63Å; V136-I140 HydrophobicContact CG1-CG1 4.35Å; V136-I140 WeakPolarHBondContact O-CD1 3.38Å; V136-I140 VanDerWaalsContact O-CG1 3.26Å; V136-I140 WeakPolarHBondContact O-CG1 3.32Å; V136-I140 PolarHBondContact O-N 3.19Å; V136-I140 VanDerWaalsContact O-N 3.1Å; Q138-I140 PolarHBondContact O-N 3.09Å; I140-Y142 PolarHBondContact O-N 3.11Å; I140-E143 PolarHBondContact O-N 2.82Å
141S91.2Very high92Very high4 Ų427.7 Ų27.73%0.02815%0.151CC..Hα-helixtrans-66.1-37.8-178.367.10000112.9A137 Q138 T139 L289A137-S141 WeakPolarHBondContact O-CB 3.31Å; A137-S141 PolarHBondContact O-N 3.48Å; A137-S141 PolarHBondContact O-OG 3.38Å; Q138-S141 PolarHBondContact O-N 3.16Å; Q138-S141 VanDerWaalsContact O-N 3.14Å; Q138-S141 PolarHBondContact O-OG 3.31Å; T139-S141 VanDerWaalsContact C-N 3.27Å; T139-S141 PolarHBondContact O-N 2.94Å; S141-L289 VanDerWaalsContact CB-CD1 3.48Å; S141-L289 WeakPolarHBondContact OG-CD1 3.36Å
142Y89.5Confident92.3Very high2 Ų227.7 Ų27.71%0.00815%0.151CC..Hα-helixtrans-76.4-37.1177.1-74.3-73.7000112.7Q138 T139 I140 V144 T145 L146 A191 L285 L289Q138-Y142 HydrophobicContact CG-CD2 3.75Å; Q138-Y142 HydrophobicContact CG-CE2 3.63Å; Q138-Y142 WeakPolarHBondContact O-CD2 3.43Å; Q138-Y142 PolarHBondContact O-N 2.94Å; Q138-Y142 VanDerWaalsContact O-N 3.14Å; T139-Y142 PolarHBondContact O-N 3.2Å; I140-Y142 PolarHBondContact O-N 3.11Å; Y142-V144 PolarHBondContact O-N 2.91Å; Y142-T145 PolarHBondContact O-N 3.05Å; Y142-T145 PolarHBondContact O-OG1 3.24Å; Y142-L146 WeakPolarHBondContact O-CB 3.34Å; Y142-L146 PolarHBondContact O-N 2.88Å; Y142-A191 HydrophobicContact CD1-CB 3.73Å; Y142-A191 HydrophobicContact CD2-CB 3.54Å; Y142-A191 HydrophobicContact CE1-CB 3.3Å; Y142-A191 HydrophobicContact CE2-CB 3.1Å; Y142-A191 HydrophobicContact CG-CB 3.87Å; Y142-A191 WeakPolarHBondContact OH-CB 3.22Å; Y142-L285 HydrophobicContact CE2-CD1 3.84Å; Y142-L285 HydrophobicContact CE2-CD2 3.58Å; Y142-L285 HydrophobicContact CE2-CG 3.94Å; Y142-L285 WeakPolarHBondContact OH-CD1 3.39Å; Y142-L285 WeakPolarHBondContact OH-CG 3.37Å; Y142-L289 HydrophobicContact CD1-CD1 3.53Å; Y142-L289 HydrophobicContact CD1-CD2 3.14Å; Y142-L289 HydrophobicContact CD1-CG 3.73Å; Y142-L289 HydrophobicContact CD2-CD1 3.66Å; Y142-L289 HydrophobicContact CE1-CD1 3.42Å; Y142-L289 VanDerWaalsContact CE1-CD1 3.42Å; Y142-L289 HydrophobicContact CE1-CD2 3.12Å; Y142-L289 HydrophobicContact CE1-CG 3.37Å; Y142-L289 HydrophobicContact CE2-CD1 3.53Å; Y142-L289 HydrophobicContact CE2-CG 4.34Å; Y142-L289 HydrophobicContact CG-CD1 3.63Å; Y142-L289 HydrophobicContact CG-CD2 4.03Å; Y142-L289 HydrophobicContact CG-CG 4.34Å
143E92.9Very high92.3Very high41 Ų4127.7 Ų27.719%0.19215%0.152CC..Hα-helixtrans-55.1-39.3179.6-83.4176.2-156.900112.7S110 V113 T139 I140 T145 L146 A147S110-E143 WeakPolarHBondContact CA-OE1 3.15Å; V113-E143 WeakPolarHBondContact CG2-OE1 3.11Å; T139-E143 WeakPolarHBondContact O-CB 3.16Å; T139-E143 WeakPolarHBondContact O-CG 3.22Å; T139-E143 PolarHBondContact O-N 3.23Å; I140-E143 PolarHBondContact O-N 2.82Å; E143-T145 PolarHBondContact O-N 3.44Å; E143-L146 PolarHBondContact O-N 3.24Å; E143-A147 WeakPolarHBondContact O-CB 3.38Å; E143-A147 PolarHBondContact O-N 3.1Å
144V94.3Very high92.4Very high59 Ų5923.5 Ų23.536%0.35813%0.13SC..Hα-helixtrans-60.4-49.2176.9177.90000110.6Y142 I148 L294Y142-V144 PolarHBondContact O-N 2.91Å; V144-I148 HydrophobicContact CG1-CD1 4.11Å; V144-I148 WeakPolarHBondContact O-CD1 3.35Å; V144-I148 VanDerWaalsContact O-CG1 3.32Å; V144-I148 WeakPolarHBondContact O-CG1 3.06Å; V144-I148 PolarHBondContact O-N 3.05Å; V144-L294 HydrophobicContact CG1-CD1 3.84Å
145T93.4Very high92.5Very high2 Ų223 Ų231%0.01213%0.132CC..Hα-helixtrans-68.9-37.7178.756.80000112.2Y142 E143 A147 I148 I149 L289 F293 L294Y142-T145 PolarHBondContact O-N 3.05Å; Y142-T145 PolarHBondContact O-OG1 3.24Å; E143-T145 PolarHBondContact O-N 3.44Å; T145-A147 PolarHBondContact O-N 2.78Å; T145-I148 PolarHBondContact O-N 3.25Å; T145-I149 WeakPolarHBondContact O-CB 3.15Å; T145-I149 WeakPolarHBondContact O-CD1 3.06Å; T145-I149 WeakPolarHBondContact O-CG1 3.46Å; T145-I149 PolarHBondContact O-N 3.33Å; T145-L289 HydrophobicContact CG2-CD2 4.06Å; T145-F293 HydrophobicContact CG2-CB 4.07Å; T145-L294 HydrophobicContact CG2-CB 4.48Å; T145-L294 HydrophobicContact CG2-CD1 4.47Å
146L93.4Very high92.6Very high5 Ų525.1 Ų25.13%0.02614%0.142CC..Hα-helixtrans-58.5-48.3177.1-16994.3000110.5L106 Y142 E143 I148 I149 L150 W185 T189 E192L106-L146 HydrophobicContact CD1-CD2 4.24Å; Y142-L146 WeakPolarHBondContact O-CB 3.34Å; Y142-L146 PolarHBondContact O-N 2.88Å; E143-L146 PolarHBondContact O-N 3.24Å; L146-I148 PolarHBondContact O-N 2.69Å; L146-I149 PolarHBondContact O-N 2.87Å; L146-L150 HydrophobicContact CD2-CD1 4.12Å; L146-L150 HydrophobicContact CG-CD1 4Å; L146-L150 WeakPolarHBondContact O-CB 3.23Å; L146-L150 WeakPolarHBondContact O-CD1 3.27Å; L146-L150 VanDerWaalsContact O-CG 3.28Å; L146-L150 WeakPolarHBondContact O-CG 3.4Å; L146-L150 PolarHBondContact O-N 2.81Å; L146-W185 HydrophobicContact CD1-CE3 3.82Å; L146-W185 HydrophobicContact CD1-CH2 3.64Å; L146-W185 HydrophobicContact CD1-CZ3 3.22Å; L146-W185 HydrophobicContact CD2-CZ3 4.48Å; L146-W185 HydrophobicContact CG-CE3 4.38Å; L146-W185 HydrophobicContact CG-CH2 4.11Å; L146-W185 HydrophobicContact CG-CZ3 3.55Å; L146-T189 HydrophobicContact CD1-CG2 4.28Å; L146-E192 WeakPolarHBondContact CD1-OE2 3.42Å
147A95.2Very high92.6Very high37 Ų3724.2 Ų24.231%0.30614%0.137SC..Hα-helixtrans-61.4-44.3179.200000112.4L106 E143 T145 L150 L151L106-A147 HydrophobicContact CD1-CB 3.76Å; E143-A147 WeakPolarHBondContact O-CB 3.38Å; E143-A147 PolarHBondContact O-N 3.1Å; T145-A147 PolarHBondContact O-N 2.78Å; A147-L150 PolarHBondContact O-N 3.44Å; A147-L151 VanDerWaalsContact O-CB 3.32Å; A147-L151 WeakPolarHBondContact O-CB 3.35Å; A147-L151 PolarHBondContact O-N 3.33Å
148I95.3Very high92.6Very high27 Ų2724.3 Ų24.314%0.13814%0.141CC..Hα-helixtrans-68.5-42.3-179.8-62.5165.4000110.6V144 T145 L146 L151 S152 L294 L298 L301V144-I148 HydrophobicContact CG1-CD1 4.11Å; V144-I148 WeakPolarHBondContact O-CD1 3.35Å; V144-I148 VanDerWaalsContact O-CG1 3.32Å; V144-I148 WeakPolarHBondContact O-CG1 3.06Å; V144-I148 PolarHBondContact O-N 3.05Å; T145-I148 PolarHBondContact O-N 3.25Å; L146-I148 PolarHBondContact O-N 2.69Å; I148-L151 PolarHBondContact O-N 3.48Å; I148-S152 PolarHBondContact O-N 3.01Å; I148-S152 PolarHBondContact O-OG 3.29Å; I148-L294 HydrophobicContact CD1-CD1 3.82Å; I148-L298 HydrophobicContact CD1-CD2 4.17Å; I148-L301 HydrophobicContact CG2-CB 4.18Å; I148-L301 HydrophobicContact CG2-CD1 4.24Å
149I95.8Very high92.7Very high0 Ų025.4 Ų25.40%015%0.148CC..Hα-helixtrans-61.7-48.4176.6-67.5162.7000110T145 L146 L151 S152 T153 L181 M184 W185 T297T145-I149 WeakPolarHBondContact O-CB 3.15Å; T145-I149 WeakPolarHBondContact O-CD1 3.06Å; T145-I149 WeakPolarHBondContact O-CG1 3.46Å; T145-I149 PolarHBondContact O-N 3.33Å; L146-I149 PolarHBondContact O-N 2.87Å; I149-L151 PolarHBondContact O-N 3.3Å; I149-S152 WeakPolarHBondContact CA-OG 3.49Å; I149-S152 PolarHBondContact O-N 2.65Å; I149-S152 PolarHBondContact O-OG 3.32Å; I149-T153 PolarHBondContact O-N 3.4Å; I149-T153 PolarHBondContact O-OG1 3Å; I149-L181 HydrophobicContact CG1-CD2 4.21Å; I149-L181 HydrophobicContact CG2-CB 4.14Å; I149-L181 HydrophobicContact CG2-CD2 4.24Å; I149-M184 HydrophobicContact CD1-CB 3.83Å; I149-W185 HydrophobicContact CB-CE3 4.48Å; I149-W185 HydrophobicContact CG2-CB 4Å; I149-W185 HydrophobicContact CG2-CE3 4.01Å; I149-T297 HydrophobicContact CD1-CG2 3.86Å; I149-T297 HydrophobicContact CG1-CG2 3.53Å
150L94.5Very high92.8Very high7 Ų728.5 Ų28.54%0.03716%0.161CC..Hα-helixtrans-58-48.5176.9-76.6162.4000111.7L102 L106 L146 A147 S152 T153 L154 W185 I241L102-L150 HydrophobicContact CD1-CD2 3.69Å; L102-L150 HydrophobicContact CD2-CB 3.95Å; L102-L150 HydrophobicContact CD2-CD1 3.86Å; L102-L150 HydrophobicContact CD2-CD2 3.9Å; L102-L150 HydrophobicContact CD2-CG 4.09Å; L102-L150 HydrophobicContact CG-CD2 4.12Å; L106-L150 HydrophobicContact CD1-CD1 3.81Å; L146-L150 HydrophobicContact CD2-CD1 4.12Å; L146-L150 HydrophobicContact CG-CD1 4Å; L146-L150 WeakPolarHBondContact O-CB 3.23Å; L146-L150 WeakPolarHBondContact O-CD1 3.27Å; L146-L150 VanDerWaalsContact O-CG 3.28Å; L146-L150 WeakPolarHBondContact O-CG 3.4Å; L146-L150 PolarHBondContact O-N 2.81Å; A147-L150 PolarHBondContact O-N 3.44Å; L150-S152 VanDerWaalsContact C-N 3.28Å; L150-S152 PolarHBondContact O-N 3.09Å; L150-T153 WeakPolarHBondContact CA-OG1 3.34Å; L150-T153 PolarHBondContact O-N 3.1Å; L150-T153 VanDerWaalsContact O-N 3.14Å; L150-T153 PolarHBondContact O-OG1 3.4Å; L150-L154 WeakPolarHBondContact O-CB 3.29Å; L150-L154 VanDerWaalsContact O-CG 3.23Å; L150-L154 WeakPolarHBondContact O-CG 3.32Å; L150-L154 PolarHBondContact O-N 2.89Å; L150-W185 HydrophobicContact CD1-CH2 3.89Å; L150-W185 HydrophobicContact CD1-CZ3 3.62Å; L150-W185 HydrophobicContact CD2-CE3 4.34Å; L150-W185 HydrophobicContact CD2-CH2 3.6Å; L150-W185 HydrophobicContact CD2-CZ2 4.45Å; L150-W185 HydrophobicContact CD2-CZ3 3.52Å; L150-W185 HydrophobicContact CG-CE3 4.23Å; L150-W185 HydrophobicContact CG-CH2 3.89Å; L150-W185 HydrophobicContact CG-CZ3 3.37Å; L150-I241 HydrophobicContact CD2-CD1 3.45Å; L150-I241 VanDerWaalsContact CD2-CD1 3.45Å
151L94.6Very high93.1Very high78 Ų7825 Ų2541%0.40814%0.144SC..Hα-helixtrans-55.9-45.5177.4-176.963.7000111.3A147 I148 I149 T153 L154 L155 L301A147-L151 VanDerWaalsContact O-CB 3.32Å; A147-L151 WeakPolarHBondContact O-CB 3.35Å; A147-L151 PolarHBondContact O-N 3.33Å; I148-L151 PolarHBondContact O-N 3.48Å; I149-L151 PolarHBondContact O-N 3.3Å; L151-T153 PolarHBondContact O-N 3.44Å; L151-L154 PolarHBondContact O-N 3.19Å; L151-L155 WeakPolarHBondContact O-CG 3.32Å; L151-L155 PolarHBondContact O-N 3.29Å; L151-L155 VanDerWaalsContact O-N 3.17Å; L151-L301 HydrophobicContact CB-CD1 4.28Å; L151-L301 HydrophobicContact CD2-CD1 3.78Å; L151-L301 HydrophobicContact CG-CD1 3.97Å
152S94.2Very high93.1Very high0 Ų025 Ų250%014%0.143CC..Hα-helixtrans-64.1-36.8178.764.20000113.5I148 I149 L150 L181I148-S152 PolarHBondContact O-N 3.01Å; I148-S152 PolarHBondContact O-OG 3.29Å; I149-S152 WeakPolarHBondContact CA-OG 3.49Å; I149-S152 PolarHBondContact O-N 2.65Å; I149-S152 PolarHBondContact O-OG 3.32Å; L150-S152 VanDerWaalsContact C-N 3.28Å; L150-S152 PolarHBondContact O-N 3.09Å; S152-L181 WeakPolarHBondContact OG-CD1 3.44Å; S152-L181 WeakPolarHBondContact OG-CD2 3.33Å
153T92.4Very high93.3Very high1 Ų126.4 Ų26.41%0.00615%0.153CC..Hα-helixtrans-70.1-34.7174.157.70000112.7I149 L150 L151 L155 M156 L174 L181 I241 F242I149-T153 PolarHBondContact O-N 3.4Å; I149-T153 PolarHBondContact O-OG1 3Å; L150-T153 WeakPolarHBondContact CA-OG1 3.34Å; L150-T153 PolarHBondContact O-N 3.1Å; L150-T153 VanDerWaalsContact O-N 3.14Å; L150-T153 PolarHBondContact O-OG1 3.4Å; L151-T153 PolarHBondContact O-N 3.44Å; T153-L155 VanDerWaalsContact C-N 3.31Å; T153-L155 PolarHBondContact O-N 2.81Å; T153-M156 WeakPolarHBondContact O-CB 3.16Å; T153-M156 PolarHBondContact O-N 3.49Å; T153-M156 VanDerWaalsContact O-N 3.15Å; T153-L174 HydrophobicContact CG2-CD2 4.32Å; T153-L181 HydrophobicContact CG2-CD1 4.08Å; T153-I241 HydrophobicContact CG2-CG2 4.23Å; T153-F242 HydrophobicContact CG2-CE1 3.69Å; T153-F242 HydrophobicContact CG2-CZ 3.66Å
154L92.3Very high93.3Very high11 Ų1125.7 Ų25.76%0.05815%0.152CC..Hα-helixtrans-71.2-24.7-180-72.4172.1000113.3L102 L150 L151 M156 S157 G158 S159 F160L102-L154 HydrophobicContact CD1-CD1 3.94Å; L102-L154 HydrophobicContact CD1-CD2 3.71Å; L102-L154 HydrophobicContact CD1-CG 4Å; L102-L154 HydrophobicContact CD2-CD1 3.95Å; L102-L154 HydrophobicContact CG-CD1 4.38Å; L150-L154 WeakPolarHBondContact O-CB 3.29Å; L150-L154 VanDerWaalsContact O-CG 3.23Å; L150-L154 WeakPolarHBondContact O-CG 3.32Å; L150-L154 PolarHBondContact O-N 2.89Å; L151-L154 PolarHBondContact O-N 3.19Å; L154-M156 PolarHBondContact O-N 3.19Å; L154-S157 WeakPolarHBondContact CA-OG 3.25Å; L154-S157 PolarHBondContact O-N 3.33Å; L154-S157 PolarHBondContact O-OG 3.3Å; L154-G158 PolarHBondContact O-N 3.41Å; L154-S159 VanDerWaalsContact CD2-O 3.32Å; L154-S159 WeakPolarHBondContact CD2-O 3.31Å; L154-F160 HydrophobicContact CD1-CD1 3.37Å; L154-F160 HydrophobicContact CD1-CE1 3.45Å; L154-F160 VanDerWaalsContact CD1-CE1 3.45Å; L154-F160 HydrophobicContact CD1-CG 4.37Å; L154-F160 HydrophobicContact CD1-CZ 4.49Å
155L93Very high93.2Very high58 Ų5822.9 Ų22.930%0.30414%0.135SC..Hα-helixtrans-61.6-21.2171.7-68.9170.9000112.5L151 T153 V305 P315L151-L155 WeakPolarHBondContact O-CG 3.32Å; L151-L155 PolarHBondContact O-N 3.29Å; L151-L155 VanDerWaalsContact O-N 3.17Å; T153-L155 VanDerWaalsContact C-N 3.31Å; T153-L155 PolarHBondContact O-N 2.81Å; L155-V305 HydrophobicContact CD1-CB 4.37Å; L155-V305 HydrophobicContact CD1-CG2 3.46Å; L155-V305 VanDerWaalsContact CD1-CG2 3.46Å; L155-P315 WeakPolarHBondContact O-CD 3.45Å; L155-P315 VanDerWaalsContact O-CG 3.25Å; L155-P315 WeakPolarHBondContact O-CG 3.32Å
156M90.8Very high93.2Very high46 Ų4623.3 Ų23.323%0.22714%0.137CC..Hα-helixtrans-86.8-22.7173.1-59.3-171.16300113.2T153 L154 L174 P177 Y304 P315T153-M156 WeakPolarHBondContact O-CB 3.16Å; T153-M156 PolarHBondContact O-N 3.49Å; T153-M156 VanDerWaalsContact O-N 3.15Å; L154-M156 PolarHBondContact O-N 3.19Å; M156-L174 HydrophobicContact CB-CD1 3.9Å; M156-L174 HydrophobicContact CE-CD1 3.77Å; M156-L174 HydrophobicContact CG-CD1 4.42Å; M156-L174 HydrophobicContact SD-CD1 3.73Å; M156-P177 HydrophobicContact CE-CB 3.83Å; M156-P177 HydrophobicContact CE-CG 3.62Å; M156-P177 HydrophobicContact SD-CB 4.43Å; M156-P177 HydrophobicContact SD-CG 4.31Å; M156-Y304 HydrophobicContact CG-CD1 4.15Å; M156-Y304 HydrophobicContact SD-CD1 3.93Å; M156-Y304 HydrophobicContact SD-CE1 3.74Å; M156-P315 WeakPolarHBondContact O-CB 3.36Å
157S91.7Very high93.1Very high5 Ų527 Ų274%0.03516%0.159CC..Hα-helixtrans-91.4-30.3177.765.30000113.9L154 S159L154-S157 WeakPolarHBondContact CA-OG 3.25Å; L154-S157 PolarHBondContact O-N 3.33Å; L154-S157 PolarHBondContact O-OG 3.3Å; S157-S159 VanDerWaalsContact C-N 3.26Å; S157-S159 PolarHBondContact O-N 3.47Å; S157-S159 PolarHBondContact OG-O 3.42Å
158G90.6Very high93Very high29 Ų2927.6 Ų27.630%0.29916%0.16SC..SBendtrans83.2-12.4-179.300000115.2L154L154-G158 PolarHBondContact O-N 3.41Å
159S92.8Very high92.9Very high22 Ų2226.5 Ų26.515%0.15415%0.154CC..SBendtrans-141.5155-179.2109.80000112.4L154 S157 N161 T164L154-S159 VanDerWaalsContact CD2-O 3.32Å; L154-S159 WeakPolarHBondContact CD2-O 3.31Å; S157-S159 VanDerWaalsContact C-N 3.26Å; S157-S159 PolarHBondContact O-N 3.47Å; S157-S159 PolarHBondContact OG-O 3.42Å; S159-N161 VanDerWaalsContact C-N 3.31Å; S159-N161 PolarHBondContact OG-N 2.62Å; S159-N161 VanDerWaalsContact OG-N 3.14Å; S159-T164 WeakPolarHBondContact OG-CG2 3.5Å; S159-T164 PolarHBondContact OG-OG1 3.48Å
160F92.9Very high92.7Very high73 Ų7330.8 Ų30.832%0.3217%0.174SC..SBendtrans-84.2-0.1175.9-68.2-85000114N99 L100 G101 L102 L103 L154N99-F160 CarbonylContact O-C 3.4Å; L100-F160 HydrophobicContact CD2-CB 3.97Å; L100-F160 HydrophobicContact CD2-CD2 3.95Å; L100-F160 HydrophobicContact CD2-CG 4.16Å; G101-F160 PolarHBondContact N-O 3.09Å; L102-F160 PolarHBondContact N-O 2.92Å; L102-F160 VanDerWaalsContact N-O 3.16Å; L103-F160 HydrophobicContact CD1-CD1 4.15Å; L103-F160 HydrophobicContact CD1-CE1 4.23Å; L103-F160 HydrophobicContact CD1-CG 4.38Å; L103-F160 HydrophobicContact CD2-CD1 4.42Å; L103-F160 HydrophobicContact CD2-CE1 4.18Å; L103-F160 HydrophobicContact CG-CD1 3.84Å; L103-F160 HydrophobicContact CG-CE1 4.04Å; L103-F160 HydrophobicContact CG-CG 4.43Å; L154-F160 HydrophobicContact CD1-CD1 3.37Å; L154-F160 HydrophobicContact CD1-CE1 3.45Å; L154-F160 VanDerWaalsContact CD1-CE1 3.45Å; L154-F160 HydrophobicContact CD1-CG 4.37Å; L154-F160 HydrophobicContact CD1-CZ 4.49Å
161N94.3Very high92.4Very high19 Ų1938.9 Ų38.910%0.10221%0.211CC..  trans-81.3124-179.3-172.2-18.2000110N97 N99 S159 S163 T164N97-N161 PolarHBondContact OD1-ND2 2.9Å; N97-N161 PolarHBondContact OD1-OD1 3.39Å; N99-N161 PolarHBondContact O-N 3.41Å; S159-N161 VanDerWaalsContact C-N 3.31Å; S159-N161 PolarHBondContact OG-N 2.62Å; S159-N161 VanDerWaalsContact OG-N 3.14Å; N161-S163 PolarHBondContact ND2-OG 2.92Å; N161-S163 PolarHBondContact O-N 3.38Å; N161-S163 PolarHBondContact OD1-N 3.45Å; N161-S163 PolarHBondContact OD1-OG 3.33Å; N161-T164 HydrophobicContact CB-CG2 4.06Å; N161-T164 PolarHBondContact O-N 3.05Å; N161-T164 VanDerWaalsContact O-N 3.09Å; N161-T164 PolarHBondContact O-OG1 3.06Å
162L92.3Very high92.4Very high2 Ų240.8 Ų40.81%0.0122%0.221CC..THydrogen-bonded Turntrans-62.8-27.2-179.3-68165.4000113.1P88 L89 P90 L102 I105 T164 L165 L237P88-L162 HydrophobicContact CB-CD1 4.09Å; P88-L162 HydrophobicContact CG-CD1 4.27Å; P88-L162 WeakPolarHBondContact O-CD1 3.16Å; L89-L162 HydrophobicContact CD2-CD1 4.41Å; P90-L162 HydrophobicContact CG-CB 3.91Å; L102-L162 HydrophobicContact CB-CD2 4.43Å; L102-L162 HydrophobicContact CD1-CD2 4.36Å; I105-L162 HydrophobicContact CD1-CD1 3.66Å; L162-T164 VanDerWaalsContact C-N 3.32Å; L162-T164 PolarHBondContact O-N 3.49Å; L162-L165 HydrophobicContact CD2-CD1 3.98Å; L162-L165 WeakPolarHBondContact O-CB 3.05Å; L162-L165 PolarHBondContact O-N 3.34Å; L162-L237 HydrophobicContact CD2-CD1 4.25Å
163S92.4Very high92.4Very high32 Ų3246.7 Ų46.722%0.22424%0.243CC..THydrogen-bonded Turntrans-66.8-33175.258.70000112.6N161 L165 I166N161-S163 PolarHBondContact ND2-OG 2.92Å; N161-S163 PolarHBondContact O-N 3.38Å; N161-S163 PolarHBondContact OD1-N 3.45Å; N161-S163 PolarHBondContact OD1-OG 3.33Å; S163-L165 PolarHBondContact O-N 3.27Å; S163-I166 WeakPolarHBondContact O-CB 3.23Å; S163-I166 PolarHBondContact O-N 3.28Å; S163-I166 VanDerWaalsContact O-N 3.12Å
164T92.4Very high92.5Very high26 Ų2647 Ų4716%0.1625%0.245CC..Hα-helixtrans-69.7-21.9175.667.50000112.7S159 N161 L162 I166 T167 T168S159-T164 WeakPolarHBondContact OG-CG2 3.5Å; S159-T164 PolarHBondContact OG-OG1 3.48Å; N161-T164 HydrophobicContact CB-CG2 4.06Å; N161-T164 PolarHBondContact O-N 3.05Å; N161-T164 VanDerWaalsContact O-N 3.09Å; N161-T164 PolarHBondContact O-OG1 3.06Å; L162-T164 VanDerWaalsContact C-N 3.32Å; L162-T164 PolarHBondContact O-N 3.49Å; T164-I166 PolarHBondContact O-N 3.1Å; T164-T167 PolarHBondContact O-N 3.13Å; T164-T167 PolarHBondContact O-OG1 3.28Å; T164-T168 WeakPolarHBondContact O-CG2 3.34Å; T164-T168 PolarHBondContact O-N 3.39Å; T164-T168 PolarHBondContact O-OG1 3.04Å
165L93.3Very high92.6Very high0 Ų049.4 Ų49.40%026%0.258CS..Hα-helixtrans-68.1-20.4172.7-79.8164.6000112.8L162 S163 T168 Q169 I241L162-L165 HydrophobicContact CD2-CD1 3.98Å; L162-L165 WeakPolarHBondContact O-CB 3.05Å; L162-L165 PolarHBondContact O-N 3.34Å; S163-L165 PolarHBondContact O-N 3.27Å; L165-T168 WeakPolarHBondContact CA-OG1 3.06Å; L165-T168 PolarHBondContact O-OG1 3.08Å; L165-T168 VanDerWaalsContact O-OG1 3.11Å; L165-Q169 WeakPolarHBondContact O-CG 3.39Å; L165-Q169 PolarHBondContact O-NE2 3.07Å; L165-I241 HydrophobicContact CD1-CG1 4.26Å
166I93.3Very high92.6Very high12 Ų1251.6 Ų51.66%0.06227%0.269CS..Hα-helixtrans-72.2-47.8173.5-61173.9000109.4P90 S163 T164 T168 Q169 Y255P90-I166 HydrophobicContact CB-CD1 3.82Å; P90-I166 HydrophobicContact CG-CD1 4.09Å; S163-I166 WeakPolarHBondContact O-CB 3.23Å; S163-I166 PolarHBondContact O-N 3.28Å; S163-I166 VanDerWaalsContact O-N 3.12Å; T164-I166 PolarHBondContact O-N 3.1Å; I166-T168 VanDerWaalsContact C-N 3.34Å; I166-T168 PolarHBondContact O-N 3.41Å; I166-Q169 PolarHBondContact O-N 3.13Å; I166-Y255 HydrophobicContact CD1-CE1 4.43Å; I166-Y255 HydrophobicContact CD1-CE2 3.91Å; I166-Y255 VanDerWaalsContact CD1-OH 3.25Å; I166-Y255 WeakPolarHBondContact CD1-OH 3.49Å; I166-Y255 HydrophobicContact CG1-CE2 4.11Å; I166-Y255 WeakPolarHBondContact CG1-OH 3.35Å; I166-Y255 HydrophobicContact CG2-CD2 4.48Å; I166-Y255 HydrophobicContact CG2-CE2 3.74Å
167T91.7Very high92.7Very high81 Ų8152.1 Ų52.150%0.49728%0.276SS..Hα-helixtrans-67.6-35.5-178.958.20000111.7T164 Q169 E170T164-T167 PolarHBondContact O-N 3.13Å; T164-T167 PolarHBondContact O-OG1 3.28Å; T167-Q169 PolarHBondContact O-N 2.64Å; T167-E170 WeakPolarHBondContact O-CG 3.11Å; T167-E170 PolarHBondContact O-N 2.83Å
168T92.8Very high92.8Very high51 Ų5151.9 Ų51.931%0.31328%0.275SS..Hα-helixtrans-66.9-23.1177.963.40000113.2T164 L165 I166T164-T168 WeakPolarHBondContact O-CG2 3.34Å; T164-T168 PolarHBondContact O-N 3.39Å; T164-T168 PolarHBondContact O-OG1 3.04Å; L165-T168 WeakPolarHBondContact CA-OG1 3.06Å; L165-T168 PolarHBondContact O-OG1 3.08Å; L165-T168 VanDerWaalsContact O-OG1 3.11Å; I166-T168 VanDerWaalsContact C-N 3.34Å; I166-T168 PolarHBondContact O-N 3.41Å
169Q93Very high93.1Very high3 Ų358.2 Ų58.21%0.01429%0.29CS..THydrogen-bonded Turntrans-102.313.6-177-68.217765.800113.5L165 I166 T167 H171 L172 L174 T240 I241 F242L165-Q169 WeakPolarHBondContact O-CG 3.39Å; L165-Q169 PolarHBondContact O-NE2 3.07Å; I166-Q169 PolarHBondContact O-N 3.13Å; T167-Q169 PolarHBondContact O-N 2.64Å; Q169-H171 PolarHBondContact O-N 3.26Å; Q169-L172 WeakPolarHBondContact CA-O 3.46Å; Q169-L174 HydrophobicContact CG-CB 4.02Å; Q169-T240 PolarHBondContact NE2-O 3.36Å; Q169-I241 PolarHBondContact NE2-O 3.27Å; Q169-F242 VanDerWaalsContact OE1-C 3.31Å; Q169-F242 PolarHBondContact OE1-O 3.39Å
170E90.6Very high93.2Very high91 Ų9158.5 Ų58.543%0.42529%0.291SS..SBendtrans-62.1-42.1179.6-78.2179.6-170.300112.8T167T167-E170 WeakPolarHBondContact O-CG 3.11Å; T167-E170 PolarHBondContact O-N 2.83Å
171H89.8Confident93.3Very high176 Ų17655 Ų5582%0.81528%0.276SS*.SBendtrans-90.2-43-176.8-63-46.3000113.4Q169Q169-H171 PolarHBondContact O-N 3.26Å
172L93.1Very high93.4Very high119 Ų11954.7 Ų54.762%0.62328%0.275SS*.SBendtrans-140.9139.3-176.7-70.9172.3000109.3Q169 L176Q169-L172 WeakPolarHBondContact CA-O 3.46Å; L172-L176 HydrophobicContact CD2-CD1 4.27Å
173W94.8Very high93.5Very high123 Ų12360.1 Ų60.147%0.46630%0.302SS..  trans-65137.1171.9-62-23.3000110.6L175 L176 P177 L243 G244W173-L175 PolarHBondContact O-N 3.06Å; W173-L175 VanDerWaalsContact O-N 3.12Å; W173-L176 PolarHBondContact O-N 3.45Å; W173-L176 VanDerWaalsContact O-N 3.1Å; W173-P177 VanDerWaalsContact O-CD 3.26Å; W173-P177 WeakPolarHBondContact O-CD 3.2Å; W173-L243 HydrophobicContact CD2-CD2 4.34Å; W173-L243 HydrophobicContact CE3-CD2 4.05Å; W173-G244 PolarHBondContact NE1-O 3.12Å
174L94.6Very high93.7Very high9 Ų959 Ų595%0.04729%0.293CS..THydrogen-bonded Turntrans-63.4-21.6179.4-159.272.1000111.7T153 M156 Q169 L176 P177 S178 I241 F242T153-L174 HydrophobicContact CG2-CD2 4.32Å; M156-L174 HydrophobicContact CB-CD1 3.9Å; M156-L174 HydrophobicContact CE-CD1 3.77Å; M156-L174 HydrophobicContact CG-CD1 4.42Å; M156-L174 HydrophobicContact SD-CD1 3.73Å; Q169-L174 HydrophobicContact CG-CB 4.02Å; L174-L176 PolarHBondContact O-N 2.88Å; L174-P177 HydrophobicContact CD1-CG 4.45Å; L174-P177 VanDerWaalsContact O-CD 3.25Å; L174-P177 WeakPolarHBondContact O-CD 3.27Å; L174-P177 WeakPolarHBondContact O-CG 3.39Å; L174-S178 WeakPolarHBondContact O-CB 3.34Å; L174-S178 PolarHBondContact O-N 3.03Å; L174-S178 VanDerWaalsContact O-N 3.1Å; L174-S178 PolarHBondContact O-OG 3.42Å; L174-I241 WeakPolarHBondContact CB-O 3.29Å; L174-I241 HydrophobicContact CD2-CG2 4.33Å; L174-I241 VanDerWaalsContact CD2-O 3.24Å; L174-I241 WeakPolarHBondContact CD2-O 3.34Å; L174-F242 PolarHBondContact N-O 3.49Å
175L94.5Very high93.8Very high60 Ų6057.8 Ų57.831%0.31429%0.286SS..THydrogen-bonded Turntrans-55.1-35.4173-172.3134.8000113.4W173 S178 W179 A182 F242 L243W173-L175 PolarHBondContact O-N 3.06Å; W173-L175 VanDerWaalsContact O-N 3.12Å; L175-S178 CarbonylContact O-C 3.37Å; L175-W179 WeakPolarHBondContact O-CA 3.5Å; L175-W179 VanDerWaalsContact O-CB 3.27Å; L175-W179 WeakPolarHBondContact O-CB 3.48Å; L175-W179 PolarHBondContact O-N 3.23Å; L175-A182 HydrophobicContact CD1-CB 4.25Å; L175-A182 HydrophobicContact CG-CB 4.26Å; L175-F242 HydrophobicContact CB-CB 4.13Å; L175-F242 WeakPolarHBondContact CB-O 3.39Å; L175-F242 HydrophobicContact CD1-CB 4.44Å; L175-F242 PolarHBondContact N-O 3.38Å; L175-L243 HydrophobicContact CB-CD2 4.18Å; L175-L243 HydrophobicContact CD1-CD2 3.93Å; L175-L243 HydrophobicContact CD1-CG 4.29Å
176L93.5Very high93.9Very high104 Ų10459.4 Ų59.455%0.54529%0.293SS..THydrogen-bonded Turntrans-68.8-55.8-176.3-69.6171.4000113L172 W173 L174 S178L172-L176 HydrophobicContact CD2-CD1 4.27Å; W173-L176 PolarHBondContact O-N 3.45Å; W173-L176 VanDerWaalsContact O-N 3.1Å; L174-L176 PolarHBondContact O-N 2.88Å; L176-S178 VanDerWaalsContact C-N 3.26Å; L176-S178 PolarHBondContact O-N 3.13Å
177P92.5Very high93.9Very high58 Ų5860.7 Ų60.738%0.37730%0.299SS..THydrogen-bonded Turntrans-67.9-29.6176.827-34.8000112.1M156 W173 L174 Y304M156-P177 HydrophobicContact CE-CB 3.83Å; M156-P177 HydrophobicContact CE-CG 3.62Å; M156-P177 HydrophobicContact SD-CB 4.43Å; M156-P177 HydrophobicContact SD-CG 4.31Å; W173-P177 VanDerWaalsContact O-CD 3.26Å; W173-P177 WeakPolarHBondContact O-CD 3.2Å; L174-P177 HydrophobicContact CD1-CG 4.45Å; L174-P177 VanDerWaalsContact O-CD 3.25Å; L174-P177 WeakPolarHBondContact O-CD 3.27Å; L174-P177 WeakPolarHBondContact O-CG 3.39Å; P177-Y304 PolarHBondContact O-OH 3.4Å; P177-Y304 VanDerWaalsContact O-OH 3.06Å
178S94.8Very high94Very high0 Ų056.8 Ų56.80%028%0.276CS..THydrogen-bonded Turntrans-11228.5-173.2740000115.6L174 L175 L176 P180 L181 A182 F242 Y304L174-S178 WeakPolarHBondContact O-CB 3.34Å; L174-S178 PolarHBondContact O-N 3.03Å; L174-S178 VanDerWaalsContact O-N 3.1Å; L174-S178 PolarHBondContact O-OG 3.42Å; L175-S178 CarbonylContact O-C 3.37Å; L176-S178 VanDerWaalsContact C-N 3.26Å; L176-S178 PolarHBondContact O-N 3.13Å; S178-P180 VanDerWaalsContact C-N 3.34Å; S178-P180 VanDerWaalsContact O-N 3.15Å; S178-L181 WeakPolarHBondContact O-CA 3.44Å; S178-L181 WeakPolarHBondContact O-CB 3.26Å; S178-L181 PolarHBondContact O-N 3.41Å; S178-A182 PolarHBondContact O-N 3.1Å; S178-F242 VanDerWaalsContact OG-CE1 3.31Å; S178-F242 WeakPolarHBondContact OG-CE1 3.18Å; S178-Y304 VanDerWaalsContact CA-OH 3.25Å; S178-Y304 WeakPolarHBondContact CA-OH 3.42Å
179W94.9Very high94.1Very high162 Ų16254.4 Ų54.461%0.61426%0.261SS*.Hα-helixtrans-54.1-36.5-175.978.1-95.2000115.1L175 L181 A182 M183L175-W179 WeakPolarHBondContact O-CA 3.5Å; L175-W179 VanDerWaalsContact O-CB 3.27Å; L175-W179 WeakPolarHBondContact O-CB 3.48Å; L175-W179 PolarHBondContact O-N 3.23Å; W179-L181 VanDerWaalsContact C-N 3.34Å; W179-A182 PolarHBondContact O-N 3.04Å; W179-M183 PolarHBondContact O-N 2.78Å
180P95.4Very high94Very high28 Ų2854.5 Ų54.518%0.18226%0.262CS..Hα-helixtrans-68.6-36.8177.3-16.832.1000111.6S178 M184 L300S178-P180 VanDerWaalsContact C-N 3.34Å; S178-P180 VanDerWaalsContact O-N 3.15Å; P180-M184 WeakPolarHBondContact O-CG 3.45Å; P180-M184 PolarHBondContact O-N 2.85Å; P180-M184 VanDerWaalsContact O-N 3.12Å; P180-L300 HydrophobicContact CB-CD1 3.98Å
181L95.5Very high94Very high0 Ų050.2 Ų50.20%024%0.241CC..Hα-helixtrans-67-43.7174.2-68.5176000110.6I149 S152 T153 S178 W179 M183 M184 W185 L300 Y304I149-L181 HydrophobicContact CG1-CD2 4.21Å; I149-L181 HydrophobicContact CG2-CB 4.14Å; I149-L181 HydrophobicContact CG2-CD2 4.24Å; S152-L181 WeakPolarHBondContact OG-CD1 3.44Å; S152-L181 WeakPolarHBondContact OG-CD2 3.33Å; T153-L181 HydrophobicContact CG2-CD1 4.08Å; S178-L181 WeakPolarHBondContact O-CA 3.44Å; S178-L181 WeakPolarHBondContact O-CB 3.26Å; S178-L181 PolarHBondContact O-N 3.41Å; W179-L181 VanDerWaalsContact C-N 3.34Å; L181-M183 VanDerWaalsContact C-N 3.31Å; L181-M183 PolarHBondContact O-N 2.95Å; L181-M184 HydrophobicContact CD2-CE 3.96Å; L181-M184 PolarHBondContact O-N 2.91Å; L181-W185 WeakPolarHBondContact O-CB 3.47Å; L181-W185 PolarHBondContact O-N 3.2Å; L181-L300 HydrophobicContact CD2-CB 3.96Å; L181-L300 HydrophobicContact CD2-CD1 3.75Å; L181-L300 HydrophobicContact CD2-CG 4.49Å; L181-L300 HydrophobicContact CG-CD1 4.17Å; L181-Y304 HydrophobicContact CD1-CD2 3.57Å; L181-Y304 HydrophobicContact CD1-CE1 4.45Å; L181-Y304 HydrophobicContact CD1-CE2 3.15Å; L181-Y304 HydrophobicContact CD1-CG 4.43Å; L181-Y304 HydrophobicContact CG-CD2 4.47Å; L181-Y304 HydrophobicContact CG-CE2 3.78Å
182A95.7Very high94.1Very high11 Ų1143.1 Ų43.19%0.09121%0.208CC..Hα-helixtrans-59.6-41177.700000112L175 S178 W179 W185 F186 F242L175-A182 HydrophobicContact CD1-CB 4.25Å; L175-A182 HydrophobicContact CG-CB 4.26Å; S178-A182 PolarHBondContact O-N 3.1Å; W179-A182 PolarHBondContact O-N 3.04Å; A182-W185 WeakPolarHBondContact O-CB 3.47Å; A182-F186 VanDerWaalsContact O-CB 3.31Å; A182-F186 WeakPolarHBondContact O-CB 3.48Å; A182-F186 PolarHBondContact O-N 3.28Å; A182-F242 HydrophobicContact CB-CD1 3.55Å; A182-F242 HydrophobicContact CB-CD2 4.34Å; A182-F242 HydrophobicContact CB-CE1 3.62Å; A182-F242 HydrophobicContact CB-CE2 4.43Å; A182-F242 HydrophobicContact CB-CG 3.92Å; A182-F242 HydrophobicContact CB-CZ 4.07Å
183M94.9Very high93.9Very high116 Ų11637.7 Ų37.757%0.57118%0.181SC*.Hα-helixtrans-66.8-46.6177.1-173.1178.2-175.900112W179 L181 W185 F186 I187W179-M183 PolarHBondContact O-N 2.78Å; L181-M183 VanDerWaalsContact C-N 3.31Å; L181-M183 PolarHBondContact O-N 2.95Å; M183-W185 VanDerWaalsContact C-N 3.34Å; M183-F186 PolarHBondContact O-N 3.01Å; M183-I187 HydrophobicContact CG-CD1 4.44Å; M183-I187 WeakPolarHBondContact O-CG1 3.26Å; M183-I187 PolarHBondContact O-N 3Å; M183-I187 VanDerWaalsContact O-N 3.15Å
184M95.9Very high93.5Very high8 Ų832.6 Ų32.64%0.03916%0.162CC..Hα-helixtrans-65-39.7177.1-69.9-171.8-67.400111.9I149 P180 L181 F186 I187 S188 F293 L296 T297 L300I149-M184 HydrophobicContact CD1-CB 3.83Å; P180-M184 WeakPolarHBondContact O-CG 3.45Å; P180-M184 PolarHBondContact O-N 2.85Å; P180-M184 VanDerWaalsContact O-N 3.12Å; L181-M184 HydrophobicContact CD2-CE 3.96Å; L181-M184 PolarHBondContact O-N 2.91Å; M184-F186 VanDerWaalsContact C-N 3.34Å; M184-F186 PolarHBondContact O-N 3.3Å; M184-I187 PolarHBondContact O-N 3Å; M184-S188 PolarHBondContact O-N 3.05Å; M184-S188 PolarHBondContact O-OG 2.99Å; M184-F293 HydrophobicContact CG-CD1 4.16Å; M184-F293 HydrophobicContact CG-CE1 4.15Å; M184-F293 HydrophobicContact CG-CG 4.48Å; M184-F293 HydrophobicContact CG-CZ 4.46Å; M184-F293 HydrophobicContact SD-CB 4.47Å; M184-F293 HydrophobicContact SD-CD1 4.15Å; M184-F293 HydrophobicContact SD-CG 4.34Å; M184-L296 HydrophobicContact CE-CD2 4.18Å; M184-L296 HydrophobicContact CE-CG 4.15Å; M184-L296 HydrophobicContact SD-CB 4.2Å; M184-L296 HydrophobicContact SD-CD2 3.65Å; M184-L296 HydrophobicContact SD-CG 4Å; M184-T297 HydrophobicContact CE-CG2 3.59Å; M184-T297 HydrophobicContact SD-CG2 3.72Å; M184-L300 HydrophobicContact CE-CD1 3.38Å
185W95.9Very high92.9Very high2 Ų232.9 Ų32.91%0.00816%0.163CC..Hα-helixtrans-58.1-45.3174.2171.3-97.9000112.1L146 I149 L150 L181 A182 M183 I187 S188 T189 L237 T238 I241 F242L146-W185 HydrophobicContact CD1-CE3 3.82Å; L146-W185 HydrophobicContact CD1-CH2 3.64Å; L146-W185 HydrophobicContact CD1-CZ3 3.22Å; L146-W185 HydrophobicContact CD2-CZ3 4.48Å; L146-W185 HydrophobicContact CG-CE3 4.38Å; L146-W185 HydrophobicContact CG-CH2 4.11Å; L146-W185 HydrophobicContact CG-CZ3 3.55Å; I149-W185 HydrophobicContact CB-CE3 4.48Å; I149-W185 HydrophobicContact CG2-CB 4Å; I149-W185 HydrophobicContact CG2-CE3 4.01Å; L150-W185 HydrophobicContact CD1-CH2 3.89Å; L150-W185 HydrophobicContact CD1-CZ3 3.62Å; L150-W185 HydrophobicContact CD2-CE3 4.34Å; L150-W185 HydrophobicContact CD2-CH2 3.6Å; L150-W185 HydrophobicContact CD2-CZ2 4.45Å; L150-W185 HydrophobicContact CD2-CZ3 3.52Å; L150-W185 HydrophobicContact CG-CE3 4.23Å; L150-W185 HydrophobicContact CG-CH2 3.89Å; L150-W185 HydrophobicContact CG-CZ3 3.37Å; L181-W185 WeakPolarHBondContact O-CB 3.47Å; L181-W185 PolarHBondContact O-N 3.2Å; A182-W185 WeakPolarHBondContact O-CB 3.47Å; M183-W185 VanDerWaalsContact C-N 3.34Å; W185-I187 VanDerWaalsContact C-N 3.3Å; W185-I187 PolarHBondContact O-N 2.65Å; W185-S188 WeakPolarHBondContact CA-OG 3.42Å; W185-S188 PolarHBondContact O-N 2.93Å; W185-S188 PolarHBondContact O-OG 2.84Å; W185-T189 HydrophobicContact CD2-CG2 4.09Å; W185-T189 HydrophobicContact CH2-CG2 4.24Å; W185-T189 HydrophobicContact CZ2-CG2 3.68Å; W185-T189 WeakPolarHBondContact O-CB 3.27Å; W185-T189 WeakPolarHBondContact O-CG2 3.42Å; W185-T189 PolarHBondContact O-N 2.98Å; W185-T189 PolarHBondContact O-OG1 2.89Å; W185-L237 HydrophobicContact CH2-CD2 3.67Å; W185-L237 HydrophobicContact CH2-CG 4.4Å; W185-L237 HydrophobicContact CZ2-CD2 3.57Å; W185-L237 HydrophobicContact CZ2-CG 3.94Å; W185-T238 HydrophobicContact CZ2-CG2 4.49Å; W185-I241 HydrophobicContact CH2-CD1 3.98Å; W185-I241 HydrophobicContact CZ2-CD1 3.64Å; W185-F242 HydrophobicContact CB-CE2 3.78Å; W185-F242 HydrophobicContact CB-CZ 4.04Å; W185-F242 AromaticContact CD1-CD2 3.82Å; W185-F242 AromaticContact CD1-CE2 3.34Å; W185-F242 AromaticContact CD2-CE2 3.99Å; W185-F242 HydrophobicContact CD2-CE2 3.99Å; W185-F242 HydrophobicContact CG-CD2 4.31Å; W185-F242 AromaticContact CG-CE2 3.41Å; W185-F242 HydrophobicContact CG-CE2 3.41Å; W185-F242 VanDerWaalsContact CG-CE2 3.41Å; W185-F242 HydrophobicContact CG-CZ 4.11Å; W185-F242 AromaticContact NE1-CE2 3.83Å
186F95.1Very high92.2Very high33 Ų3330.6 Ų30.615%0.14515%0.152CC..Hα-helixtrans-64.5-38.1179.5-174.5-92.8000111.5A182 M183 M184 T189 L190 L266 L269 F270 I273A182-F186 VanDerWaalsContact O-CB 3.31Å; A182-F186 WeakPolarHBondContact O-CB 3.48Å; A182-F186 PolarHBondContact O-N 3.28Å; M183-F186 PolarHBondContact O-N 3.01Å; M184-F186 VanDerWaalsContact C-N 3.34Å; M184-F186 PolarHBondContact O-N 3.3Å; F186-T189 WeakPolarHBondContact CA-OG1 3.44Å; F186-T189 PolarHBondContact O-OG1 3.15Å; F186-L190 HydrophobicContact CD1-CD1 3.98Å; F186-L190 HydrophobicContact CE1-CD1 3.57Å; F186-L190 HydrophobicContact CE1-CG 4.23Å; F186-L190 HydrophobicContact CZ-CD1 4.31Å; F186-L190 WeakPolarHBondContact O-CG 3.23Å; F186-L190 PolarHBondContact O-N 3.17Å; F186-L190 VanDerWaalsContact O-N 3.15Å; F186-L266 HydrophobicContact CE2-CD2 4.29Å; F186-L269 HydrophobicContact CE1-CD2 3.52Å; F186-L269 HydrophobicContact CE2-CD2 4.08Å; F186-L269 HydrophobicContact CZ-CD2 3.18Å; F186-L269 HydrophobicContact CZ-CG 4.45Å; F186-F270 HydrophobicContact CD2-CE1 4.03Å; F186-F270 HydrophobicContact CE1-CD1 4.44Å; F186-F270 HydrophobicContact CE1-CE1 4.29Å; F186-F270 AromaticContact CE2-CD1 3.61Å; F186-F270 HydrophobicContact CE2-CD1 3.61Å; F186-F270 AromaticContact CE2-CE1 3.29Å; F186-F270 HydrophobicContact CE2-CE1 3.29Å; F186-F270 AromaticContact CZ-CD1 3.4Å; F186-F270 HydrophobicContact CZ-CD1 3.4Å; F186-F270 VanDerWaalsContact CZ-CD1 3.4Å; F186-F270 AromaticContact CZ-CE1 3.41Å; F186-F270 HydrophobicContact CZ-CE1 3.41Å; F186-F270 VanDerWaalsContact CZ-CE1 3.41Å; F186-I273 HydrophobicContact CE1-CD1 3.46Å; F186-I273 VanDerWaalsContact CE1-CD1 3.46Å; F186-I273 HydrophobicContact CZ-CD1 4.03Å
187I94Very high91.6Very high39 Ų3926 Ų2620%0.213%0.127CC..Hα-helixtrans-70.7-39.4174.7-62.2168.6000111.4M183 M184 W185 L190 A191 F198 L288 F293M183-I187 HydrophobicContact CG-CD1 4.44Å; M183-I187 WeakPolarHBondContact O-CG1 3.26Å; M183-I187 PolarHBondContact O-N 3Å; M183-I187 VanDerWaalsContact O-N 3.15Å; M184-I187 PolarHBondContact O-N 3Å; W185-I187 VanDerWaalsContact C-N 3.3Å; W185-I187 PolarHBondContact O-N 2.65Å; I187-L190 WeakPolarHBondContact O-CB 3.47Å; I187-L190 PolarHBondContact O-N 3.22Å; I187-A191 PolarHBondContact O-N 3.18Å; I187-F198 HydrophobicContact CG2-CE2 3.72Å; I187-F198 HydrophobicContact CG2-CZ 3.71Å; I187-L288 HydrophobicContact CG2-CD2 4.27Å; I187-F293 HydrophobicContact CB-CE2 3.92Å; I187-F293 HydrophobicContact CB-CZ 3.88Å; I187-F293 HydrophobicContact CD1-CZ 3.8Å; I187-F293 HydrophobicContact CG1-CZ 4.45Å; I187-F293 HydrophobicContact CG2-CE2 3.66Å; I187-F293 HydrophobicContact CG2-CZ 3.67Å
188S93.6Very high91.3Very high0 Ų023.5 Ų23.50%011%0.111CC..Hα-helixtrans-66.7-38.4177.862.80000112.2M184 W185 A191 E192M184-S188 PolarHBondContact O-N 3.05Å; M184-S188 PolarHBondContact O-OG 2.99Å; W185-S188 WeakPolarHBondContact CA-OG 3.42Å; W185-S188 PolarHBondContact O-N 2.93Å; W185-S188 PolarHBondContact O-OG 2.84Å; S188-A191 PolarHBondContact O-N 3.12Å; S188-E192 PolarHBondContact O-N 2.87Å
189T94.1Very high90.8Very high0 Ų023.8 Ų23.80%011%0.112CC..Hα-helixtrans-69.7-34.9176.750.10000112.9L146 W185 F186 A191 T193 M234 T238L146-T189 HydrophobicContact CD1-CG2 4.28Å; W185-T189 HydrophobicContact CD2-CG2 4.09Å; W185-T189 HydrophobicContact CH2-CG2 4.24Å; W185-T189 HydrophobicContact CZ2-CG2 3.68Å; W185-T189 WeakPolarHBondContact O-CB 3.27Å; W185-T189 WeakPolarHBondContact O-CG2 3.42Å; W185-T189 PolarHBondContact O-N 2.98Å; W185-T189 PolarHBondContact O-OG1 2.89Å; F186-T189 WeakPolarHBondContact CA-OG1 3.44Å; F186-T189 PolarHBondContact O-OG1 3.15Å; T189-A191 PolarHBondContact O-N 3.44Å; T189-T193 WeakPolarHBondContact O-CG2 3.37Å; T189-T193 PolarHBondContact O-N 3.42Å; T189-T193 VanDerWaalsContact O-N 3.15Å; T189-T193 PolarHBondContact O-OG1 2.95Å; T189-M234 HydrophobicContact CG2-CB 4.48Å; T189-M234 HydrophobicContact CG2-SD 4.48Å; T189-T238 HydrophobicContact CG2-CG2 4.14Å
190L92Very high89.9Confident6 Ų616.5 Ų16.53%0.0319%0.085CC..Hα-helixtrans-57.6-39.2168.8-85.1166000111.8F186 I187 T193 R195 F198 F270 I273F186-L190 HydrophobicContact CD1-CD1 3.98Å; F186-L190 HydrophobicContact CE1-CD1 3.57Å; F186-L190 HydrophobicContact CE1-CG 4.23Å; F186-L190 HydrophobicContact CZ-CD1 4.31Å; F186-L190 WeakPolarHBondContact O-CG 3.23Å; F186-L190 PolarHBondContact O-N 3.17Å; F186-L190 VanDerWaalsContact O-N 3.15Å; I187-L190 WeakPolarHBondContact O-CB 3.47Å; I187-L190 PolarHBondContact O-N 3.22Å; L190-T193 PolarHBondContact O-OG1 3.37Å; L190-T193 VanDerWaalsContact O-OG1 3.12Å; L190-R195 PolarHBondContact O-N 3.31Å; L190-F198 HydrophobicContact CB-CD2 4.2Å; L190-F198 HydrophobicContact CB-CE2 4.38Å; L190-F270 HydrophobicContact CD2-CB 4.47Å; L190-F270 HydrophobicContact CD2-CD1 3.88Å; L190-F270 HydrophobicContact CD2-CD2 3.66Å; L190-F270 HydrophobicContact CD2-CE1 3.92Å; L190-F270 HydrophobicContact CD2-CE2 3.74Å; L190-F270 HydrophobicContact CD2-CG 3.73Å; L190-F270 HydrophobicContact CD2-CZ 3.85Å; L190-F270 HydrophobicContact CG-CD1 4.3Å; L190-F270 HydrophobicContact CG-CE1 3.89Å; L190-F270 HydrophobicContact CG-CE2 4.17Å; L190-F270 HydrophobicContact CG-CZ 3.82Å; L190-I273 HydrophobicContact CD1-CD1 3.83Å; L190-I273 HydrophobicContact CD1-CG2 4.21Å
191A90.6Very high88.7Confident0 Ų015.2 Ų15.20%08%0.077CC..Hα-helixtrans-84-30.1-176.700000114Q138 Y142 I187 S188 T189 T193 N194 F198Q138-A191 PolarHBondContact NE2-O 2.89Å; Y142-A191 HydrophobicContact CD1-CB 3.73Å; Y142-A191 HydrophobicContact CD2-CB 3.54Å; Y142-A191 HydrophobicContact CE1-CB 3.3Å; Y142-A191 HydrophobicContact CE2-CB 3.1Å; Y142-A191 HydrophobicContact CG-CB 3.87Å; Y142-A191 WeakPolarHBondContact OH-CB 3.22Å; I187-A191 PolarHBondContact O-N 3.18Å; S188-A191 PolarHBondContact O-N 3.12Å; T189-A191 PolarHBondContact O-N 3.44Å; A191-T193 VanDerWaalsContact C-N 3.28Å; A191-N194 PolarHBondContact O-N 3.09Å; A191-F198 HydrophobicContact CB-CB 3.81Å; A191-F198 HydrophobicContact CB-CD2 3.62Å; A191-F198 HydrophobicContact CB-CE2 4.33Å; A191-F198 HydrophobicContact CB-CG 3.74Å
192E90.8Very high87.6Confident27 Ų2716.4 Ų16.413%0.1268%0.083CC..Hα-helixtrans-64.4-35.3170.8-173.4174.4-177.400111.6S109 L146 S188 N194 M234S109-E192 VanDerWaalsContact CB-OE1 3.28Å; S109-E192 WeakPolarHBondContact CB-OE1 3.38Å; S109-E192 PolarHBondContact OG-OE1 3.4Å; L146-E192 WeakPolarHBondContact CD1-OE2 3.42Å; S188-E192 PolarHBondContact O-N 2.87Å; 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 3.29Å; E192-M234 WeakPolarHBondContact OE2-CE 3.27Å
193T88.9Confident86.4Confident6 Ų616.1 Ų16.14%0.0378%0.081CC..THydrogen-bonded Turntrans-80.87.9175.654.20000113.8T189 L190 A191 R195 I231 M234T189-T193 WeakPolarHBondContact O-CG2 3.37Å; T189-T193 PolarHBondContact O-N 3.42Å; T189-T193 VanDerWaalsContact O-N 3.15Å; T189-T193 PolarHBondContact O-OG1 2.95Å; L190-T193 PolarHBondContact O-OG1 3.37Å; L190-T193 VanDerWaalsContact O-OG1 3.12Å; A191-T193 VanDerWaalsContact C-N 3.28Å; T193-R195 PolarHBondContact O-N 3Å; T193-R195 VanDerWaalsContact O-N 3.1Å; T193-I231 HydrophobicContact CG2-CG1 4.15Å; T193-M234 HydrophobicContact CG2-CB 4.17Å; T193-M234 HydrophobicContact CG2-CG 3.74Å
194N85.6Confident84.8Confident15 Ų1516.1 Ų16.18%0.088%0.079CC..THydrogen-bonded Turntrans51.130.6-179.6-61.4-43.7000114Q138 A191 E192 D199 A201Q138-N194 PolarHBondContact NE2-OD1 3.21Å; A191-N194 PolarHBondContact O-N 3.09Å; E192-N194 PolarHBondContact O-N 3.48Å; N194-D199 VanDerWaalsContact O-CA 3.32Å; N194-D199 WeakPolarHBondContact O-CA 3.47Å; N194-D199 WeakPolarHBondContact O-CB 3.45Å; N194-A201 HydrophobicContact CB-CB 4.41Å
195R82.8Confident83Confident15 Ų1520.3 Ų20.36%0.05711%0.109CC..  trans-91.4148.7-179.7-75.4-55.2-164-145.6-16.8112.1L190 T193 F198 D199 E227 I231L190-R195 PolarHBondContact O-N 3.31Å; T193-R195 PolarHBondContact O-N 3Å; T193-R195 VanDerWaalsContact O-N 3.1Å; R195-F198 CarbonylContact O-C 3.41Å; R195-F198 WeakPolarHBondContact O-CA 3.03Å; R195-F198 PolarHBondContact O-N 2.99Å; R195-D199 PolarHBondContact O-N 2.83Å; R195-E227 IonicContact CZ-OE1 3.12Å; R195-E227 IonicContact CZ-OE2 4Å; R195-E227 IonicContact NE-OE1 3.8Å; R195-E227 IonicContact NH1-OE1 2.78Å; R195-E227 PolarHBondContact NH1-OE1 2.88Å; R195-E227 IonicContact NH1-OE2 2.99Å; R195-E227 PolarHBondContact NH1-OE2 3.35Å; R195-E227 IonicContact NH2-OE1 3.75Å; R195-E227 PolarHBondContact NH2-OE1 3.43Å; R195-E227 IonicContact NH2-OE2 3.95Å; R195-E227 PolarHBondContact NH2-OE2 3.46Å; R195-I231 HydrophobicContact CG-CD1 3.85Å; R195-I231 HydrophobicContact CG-CG1 4.27Å
196T80.1Confident81.2Confident13 Ų1325 Ų258%0.0813%0.131CC..THydrogen-bonded Turntrans-53.1128.9172.948.50000109.8D199 R274 R279T196-D199 HydrophobicContact CG2-CB 3.68Å; T196-R274 WeakPolarHBondContact OG1-CA 3.36Å; T196-R274 WeakPolarHBondContact OG1-CB 3.38Å; T196-R274 WeakPolarHBondContact OG1-CG 3.43Å; T196-R279 HydrophobicContact CG2-CG 4.23Å
197P80.4Confident79.7Confident6 Ų623.7 Ų23.74%0.03913%0.126CC..THydrogen-bonded Turncis-890.920.836.6-39.7000116P278 R279 F280P197-P278 WeakPolarHBondContact CB-O 3.23Å; P197-R279 WeakPolarHBondContact O-CA 3.46Å; P197-F280 HydrophobicContact CB-CD2 3.67Å; P197-F280 HydrophobicContact CB-CE2 3.95Å; P197-F280 HydrophobicContact CG-CD2 3.85Å; P197-F280 HydrophobicContact CG-CE2 3.8Å; P197-F280 PolarHBondContact O-N 2.84Å
198F87Confident78.7Confident7 Ų727.3 Ų27.33%0.03115%0.149CC..SBendtrans-102.527.2-177.9-51.8-64.7000113.7Q138 I187 L190 A191 R195 L200 F280 L285 L288Q138-F198 PolarHBondContact NE2-O 2.68Å; Q138-F198 PolarHBondContact OE1-O 3.24Å; I187-F198 HydrophobicContact CG2-CE2 3.72Å; I187-F198 HydrophobicContact CG2-CZ 3.71Å; L190-F198 HydrophobicContact CB-CD2 4.2Å; L190-F198 HydrophobicContact CB-CE2 4.38Å; A191-F198 HydrophobicContact CB-CB 3.81Å; A191-F198 HydrophobicContact CB-CD2 3.62Å; A191-F198 HydrophobicContact CB-CE2 4.33Å; A191-F198 HydrophobicContact CB-CG 3.74Å; R195-F198 CarbonylContact O-C 3.41Å; R195-F198 WeakPolarHBondContact O-CA 3.03Å; R195-F198 PolarHBondContact O-N 2.99Å; F198-L200 VanDerWaalsContact C-N 3.31Å; F198-L200 PolarHBondContact O-N 2.86Å; F198-F280 HydrophobicContact CD1-CB 4.37Å; F198-F280 AromaticContact CD1-CD2 3.76Å; F198-F280 HydrophobicContact CD1-CD2 3.76Å; F198-F280 HydrophobicContact CD1-CE2 4.5Å; F198-F280 HydrophobicContact CD1-CG 4.32Å; F198-F280 AromaticContact CE1-CD2 3.35Å; F198-F280 HydrophobicContact CE1-CD2 3.35Å; F198-F280 AromaticContact CE1-CE2 3.7Å; F198-F280 HydrophobicContact CE1-CE2 3.7Å; F198-F280 HydrophobicContact CE1-CG 4.03Å; F198-F280 HydrophobicContact CZ-CD2 4.06Å; F198-F280 AromaticContact CZ-CE2 3.98Å; F198-F280 HydrophobicContact CZ-CE2 3.98Å; F198-L285 HydrophobicContact CB-CD1 3.96Å; F198-L285 HydrophobicContact CD1-CD1 3.61Å; F198-L285 HydrophobicContact CD1-CG 4.16Å; F198-L285 HydrophobicContact CG-CD1 4.15Å; F198-L288 HydrophobicContact CE1-CD2 4.07Å; F198-L288 HydrophobicContact CZ-CD2 4.05Å
199D83.2Confident77.6Confident6 Ų628.6 Ų28.63%0.03216%0.158CC..  trans-8275.2176.2174.720.3000110.7N194 R195 T196 E202 R279N194-D199 VanDerWaalsContact O-CA 3.32Å; N194-D199 WeakPolarHBondContact O-CA 3.47Å; N194-D199 WeakPolarHBondContact O-CB 3.45Å; R195-D199 PolarHBondContact O-N 2.83Å; T196-D199 HydrophobicContact CG2-CB 3.68Å; D199-E202 VanDerWaalsContact OD1-CB 3.25Å; D199-E202 WeakPolarHBondContact OD1-CB 3.48Å; D199-E202 PolarHBondContact OD1-N 3.15Å; D199-R279 IonicContact OD2-CZ 2.63Å; D199-R279 IonicContact OD2-NE 3.37Å; D199-R279 IonicContact OD2-NH2 3.6Å; D199-R279 PolarHBondContact OD2-NH2 2.92Å
200L75.8Confident77.1Confident8 Ų828.6 Ų28.64%0.04216%0.158CC..  trans-94-20.9177.6-59.7177.7000112.8F198 F280 Y282 L285F198-L200 VanDerWaalsContact C-N 3.31Å; F198-L200 PolarHBondContact O-N 2.86Å; L200-F280 VanDerWaalsContact CD2-O 3.27Å; L200-F280 WeakPolarHBondContact CD2-O 3.44Å; L200-Y282 HydrophobicContact CD1-CD2 3.87Å; L200-Y282 HydrophobicContact CD1-CG 4.42Å; L200-L285 HydrophobicContact CD1-CB 4.26Å; L200-L285 HydrophobicContact CD1-CD1 3.51Å; L200-L285 HydrophobicContact CD1-CG 4.36Å; L200-L285 HydrophobicContact CG-CD1 4.3Å
201A70.4Confident76.6Confident1 Ų129.4 Ų29.41%0.00816%0.162CC..SBendtrans-76.2-36.4-177.300000111.9A135 N194 G210 F211A135-A201 HydrophobicContact CB-CB 3.62Å; N194-A201 HydrophobicContact CB-CB 4.41Å; A201-G210 VanDerWaalsContact O-CA 3.3Å; A201-G210 WeakPolarHBondContact O-CA 3.44Å; A201-F211 HydrophobicContact CB-CD1 4.05Å; A201-F211 HydrophobicContact CB-CE1 4.08Å
202E72.3Confident76.3Confident26 Ų2629.6 Ų29.612%0.12116%0.163CC..SBendtrans-103.2-24.3-179.7-167.8168.2-153.600112.4D199 E204 S209 F224D199-E202 VanDerWaalsContact OD1-CB 3.25Å; D199-E202 WeakPolarHBondContact OD1-CB 3.48Å; D199-E202 PolarHBondContact OD1-N 3.15Å; E202-E204 PolarHBondContact O-N 3.4Å; E202-S209 CarbonylContact O-C 2.85Å; E202-S209 VanDerWaalsContact O-CA 3.32Å; E202-S209 WeakPolarHBondContact O-CA 3.31Å; E202-F224 WeakPolarHBondContact OE1-CZ 3.26Å
203G70.6Confident75.9Confident5 Ų530.9 Ų30.95%0.05217%0.17CC..  trans13.768.3167.600000116.4S205 E206 L207G203-S205 PolarHBondContact O-N 2.96Å; G203-E206 PolarHBondContact O-N 2.92Å; G203-L207 PolarHBondContact O-N 3.04Å
204E61.6Low75.8Confident115 Ų11534 Ų3454%0.53718%0.184SC..Hα-helixtrans-55.4-31.9-169.8-62.5164.8139.900113.4E202 V208 R279E202-E204 PolarHBondContact O-N 3.4Å; E204-V208 WeakPolarHBondContact O-CA 3.48Å; E204-V208 PolarHBondContact O-N 2.84Å; E204-R279 IonicContact OE2-CZ 3.42Å; E204-R279 IonicContact OE2-NH1 2.77Å; E204-R279 IonicContact OE2-NH2 3.55Å; E204-R279 PolarHBondContact OE2-NH2 3.21Å; E204-R279 VanDerWaalsContact OE2-NH2 3.12Å
205S57.3Low75.9Confident96 Ų9633.7 Ų33.767%0.67118%0.182SC*.Hα-helixtrans-74.4-23.9179.3510000113.8G203G203-S205 PolarHBondContact O-N 2.96Å
206E58.5Low76Confident101 Ų10133.6 Ų33.647%0.47219%0.185SC..Hα-helixtrans-110-36.1-174.6-62.7-174.6-166.400112.5R134 G203R134-E206 IonicContact CZ-OE2 3.63Å; R134-E206 IonicContact NH1-OE2 2.69Å; R134-E206 PolarHBondContact NH1-OE2 3.39Å; R134-E206 IonicContact NH2-OE2 3.7Å; G203-E206 PolarHBondContact O-N 2.92Å
207L64.9Low76.4Confident6 Ų633.2 Ų33.23%0.03118%0.182CC..Hα-helixtrans-127.510.1-169-61.4177000113.4Y127 I130 G203 S209 G210 I213Y127-L207 HydrophobicContact CD1-CD2 3.96Å; I130-L207 HydrophobicContact CB-CD2 4.48Å; I130-L207 HydrophobicContact CG2-CD2 4.1Å; G203-L207 PolarHBondContact O-N 3.04Å; L207-S209 PolarHBondContact O-N 3.44Å; L207-G210 PolarHBondContact O-N 3.31Å; L207-I213 WeakPolarHBondContact O-CD1 3.33Å
208V72.3Confident76.8Confident114 Ų11433.6 Ų33.669%0.69119%0.188SC*.THydrogen-bonded Turntrans64-53-175.1-174.30000113.2E204E204-V208 WeakPolarHBondContact O-CA 3.48Å; E204-V208 PolarHBondContact O-N 2.84Å
209S70.2Confident77Confident27 Ų2734.9 Ų34.919%0.18920%0.197CC..THydrogen-bonded Turntrans-156.65.1169.147.40000113.7E202 L207 F211 N212 I213E202-S209 CarbonylContact O-C 2.85Å; E202-S209 VanDerWaalsContact O-CA 3.32Å; E202-S209 WeakPolarHBondContact O-CA 3.31Å; L207-S209 PolarHBondContact O-N 3.44Å; S209-F211 PolarHBondContact O-N 3.34Å; S209-N212 VanDerWaalsContact CB-OD1 3.3Å; S209-N212 WeakPolarHBondContact CB-OD1 3.34Å; S209-N212 PolarHBondContact O-OD1 3.05Å; S209-I213 VanDerWaalsContact OG-CA 3.28Å; S209-I213 WeakPolarHBondContact OG-CA 3.18Å; S209-I213 WeakPolarHBondContact OG-CG1 2.88Å
210G84.2Confident77.3Confident0 Ų037.2 Ų37.20%021%0.207CC..G310 helixtrans69.1-125.1172.200000115.3A128 A201 L207 N212 I213A128-G210 VanDerWaalsContact CA-O 3.23Å; A128-G210 WeakPolarHBondContact CA-O 3.05Å; A128-G210 WeakPolarHBondContact CB-O 3.41Å; A201-G210 VanDerWaalsContact O-CA 3.3Å; A201-G210 WeakPolarHBondContact O-CA 3.44Å; L207-G210 PolarHBondContact O-N 3.31Å; G210-N212 VanDerWaalsContact C-N 3.25Å; G210-N212 PolarHBondContact O-N 2.87Å; G210-I213 WeakPolarHBondContact O-CD1 3.44Å; G210-I213 WeakPolarHBondContact O-CG1 3.45Å
211F80.2Confident78.1Confident23 Ų2337.1 Ų37.110%0.10121%0.207CC..G310 helixtrans-70.2-18.8-171.170.2-92.4000114.4I116 S119 A132 A201 S209 F223I116-F211 HydrophobicContact CG1-CZ 4.49Å; I116-F211 HydrophobicContact CG2-CB 4.06Å; I116-F211 HydrophobicContact CG2-CD1 3.82Å; I116-F211 HydrophobicContact CG2-CD2 4.11Å; I116-F211 HydrophobicContact CG2-CE1 4.27Å; I116-F211 HydrophobicContact CG2-CG 3.73Å; S119-F211 VanDerWaalsContact OG-CD2 3.27Å; S119-F211 WeakPolarHBondContact OG-CD2 2.98Å; A132-F211 HydrophobicContact CB-CB 4.28Å; A201-F211 HydrophobicContact CB-CD1 4.05Å; A201-F211 HydrophobicContact CB-CE1 4.08Å; S209-F211 PolarHBondContact O-N 3.34Å; F211-F223 AromaticContact CE2-CD1 4Å; F211-F223 HydrophobicContact CE2-CD1 4Å; F211-F223 HydrophobicContact CE2-CE1 4.22Å; F211-F223 HydrophobicContact CE2-CG 4.21Å
212N84.8Confident79.1Confident5 Ų538.9 Ų38.93%0.02722%0.216CC..G310 helixtrans-1049.2-175.368.37.7000113.5S209 G210 E214 Y215S209-N212 VanDerWaalsContact CB-OD1 3.3Å; S209-N212 WeakPolarHBondContact CB-OD1 3.34Å; S209-N212 PolarHBondContact O-OD1 3.05Å; G210-N212 VanDerWaalsContact C-N 3.25Å; G210-N212 PolarHBondContact O-N 2.87Å; N212-E214 VanDerWaalsContact C-N 3.27Å; N212-E214 PolarHBondContact O-N 2.99Å; N212-E214 VanDerWaalsContact O-N 3.16Å; N212-Y215 HydrophobicContact CB-CD2 4.48Å; N212-Y215 WeakPolarHBondContact O-CB 3.38Å; N212-Y215 PolarHBondContact O-N 3.4Å
213I83.4Confident80.1Confident53 Ų5338.1 Ų38.127%0.27221%0.212SC..THydrogen-bonded Turntrans-50.7-44.1-175.3-65.8157.4000113.1A128 L207 S209 G210 Y215A128-I213 HydrophobicContact CB-CD1 4.49Å; L207-I213 WeakPolarHBondContact O-CD1 3.33Å; S209-I213 VanDerWaalsContact OG-CA 3.28Å; S209-I213 WeakPolarHBondContact OG-CA 3.18Å; S209-I213 WeakPolarHBondContact OG-CG1 2.88Å; G210-I213 WeakPolarHBondContact O-CD1 3.44Å; G210-I213 WeakPolarHBondContact O-CG1 3.45Å; I213-Y215 VanDerWaalsContact C-N 3.31Å
214E86.1Confident81Confident72 Ų7239.6 Ų39.634%0.33622%0.217SC..THydrogen-bonded Turntrans-87.2-0.9-175.8-65-64.1162.400113P63 Y71 N212P63-E214 HydrophobicContact CG-CB 3.83Å; P63-E214 HydrophobicContact CG-CG 4.31Å; Y71-E214 HydrophobicContact CE2-CB 4.5Å; Y71-E214 PolarHBondContact OH-O 2.95Å; N212-E214 VanDerWaalsContact C-N 3.27Å; N212-E214 PolarHBondContact O-N 2.99Å; N212-E214 VanDerWaalsContact O-N 3.16Å
215Y87.1Confident82.5Confident9 Ų935.7 Ų35.74%0.03520%0.2CC..  trans-90.1122.9179.5-71.3-93.4000110.8Y71 P75 S119 N212 I213 P219 F220 F223Y71-Y215 HydrophobicContact CD1-CE1 4.06Å; Y71-Y215 HydrophobicContact CD2-CD1 4.36Å; Y71-Y215 AromaticContact CD2-CE1 3.62Å; Y71-Y215 HydrophobicContact CD2-CE1 3.62Å; Y71-Y215 HydrophobicContact CD2-CE2 4.05Å; Y71-Y215 AromaticContact CD2-CZ 3.44Å; Y71-Y215 VanDerWaalsContact CD2-CZ 3.44Å; Y71-Y215 WeakPolarHBondContact CD2-OH 3.3Å; Y71-Y215 HydrophobicContact CE1-CD1 4.06Å; Y71-Y215 AromaticContact CE1-CE1 3.91Å; Y71-Y215 HydrophobicContact CE1-CE1 3.91Å; Y71-Y215 AromaticContact CE2-CD1 3.74Å; Y71-Y215 HydrophobicContact CE2-CD1 3.74Å; Y71-Y215 HydrophobicContact CE2-CD2 4.04Å; Y71-Y215 AromaticContact CE2-CE1 3.47Å; Y71-Y215 HydrophobicContact CE2-CE1 3.47Å; Y71-Y215 VanDerWaalsContact CE2-CE1 3.47Å; Y71-Y215 AromaticContact CE2-CE2 3.79Å; Y71-Y215 HydrophobicContact CE2-CE2 3.79Å; Y71-Y215 HydrophobicContact CE2-CG 4.03Å; Y71-Y215 AromaticContact CE2-CZ 3.5Å; Y71-Y215 VanDerWaalsContact CE2-CZ 3.5Å; Y71-Y215 AromaticContact CG-CE1 3.93Å; Y71-Y215 HydrophobicContact CG-CE1 3.93Å; Y71-Y215 AromaticContact CZ-CD1 3.57Å; Y71-Y215 AromaticContact CZ-CE1 3.62Å; Y71-Y215 WeakPolarHBondContact O-CE1 3.29Å; Y71-Y215 WeakPolarHBondContact OH-CA 3.47Å; P75-Y215 HydrophobicContact CG-CD1 4.05Å; P75-Y215 HydrophobicContact CG-CE1 3.61Å; S119-Y215 VanDerWaalsContact CA-OH 3.3Å; S119-Y215 WeakPolarHBondContact CA-OH 3.36Å; S119-Y215 WeakPolarHBondContact CB-OH 3.36Å; N212-Y215 HydrophobicContact CB-CD2 4.48Å; N212-Y215 WeakPolarHBondContact O-CB 3.38Å; N212-Y215 PolarHBondContact O-N 3.4Å; I213-Y215 VanDerWaalsContact C-N 3.31Å; Y215-P219 HydrophobicContact CD1-CB 3.72Å; Y215-P219 HydrophobicContact CE1-CB 4.4Å; Y215-F220 WeakPolarHBondContact O-CD2 3.48Å; Y215-F223 HydrophobicContact CD1-CD2 4.45Å; Y215-F223 AromaticContact CD1-CE2 3.94Å; Y215-F223 HydrophobicContact CD1-CE2 3.94Å; Y215-F223 HydrophobicContact CD2-CE2 4.27Å; Y215-F223 AromaticContact CE1-CE2 3.87Å; Y215-F223 HydrophobicContact CE1-CE2 3.87Å; Y215-F223 HydrophobicContact CE2-CE2 4.2Å; Y215-F223 HydrophobicContact CG-CD2 4.45Å; Y215-F223 HydrophobicContact CG-CE2 4.13Å
216A85.8Confident84.2Confident13 Ų1331.3 Ų31.311%0.10717%0.169CC..  trans-115.9159176.300000111.9L61 G218 P219L61-A216 HydrophobicContact CB-CB 3.77Å; L61-A216 HydrophobicContact CD1-CB 3.89Å; L61-A216 HydrophobicContact CG-CB 4.03Å; A216-G218 PolarHBondContact O-N 2.71Å; A216-P219 VanDerWaalsContact O-CD 3.31Å; A216-P219 WeakPolarHBondContact O-CD 3.39Å
217A88.6Confident85.8Confident4 Ų428.1 Ų28.13%0.03315%0.154CC..Hα-helixtrans55-120.7165.900000113.8L55 K58 F220 A221L55-A217 CarbonylContact O-C 3.31Å; L55-A217 VanDerWaalsContact O-C 3.31Å; L55-A217 WeakPolarHBondContact O-CA 3.2Å; L55-A217 WeakPolarHBondContact O-CB 3.41Å; K58-A217 HydrophobicContact CB-CB 3.83Å; K58-A217 HydrophobicContact CG-CB 4.21Å; K58-A217 VanDerWaalsContact O-CB 3.3Å; K58-A217 WeakPolarHBondContact O-CB 3.43Å; A217-F220 WeakPolarHBondContact O-CB 3.42Å; A217-A221 PolarHBondContact O-N 3.12Å
218G89.4Confident87.2Confident15 Ų1528.9 Ų28.916%0.15516%0.157CC..Hα-helixtrans-62.1-54.7-176.200000114.6L55 A216 F220 A221 L222L55-G218 PolarHBondContact O-N 3.28Å; A216-G218 PolarHBondContact O-N 2.71Å; G218-F220 VanDerWaalsContact C-N 3.26Å; G218-F220 PolarHBondContact O-N 2.95Å; G218-A221 WeakPolarHBondContact O-CA 3.09Å; G218-A221 VanDerWaalsContact O-CB 3.28Å; G218-A221 WeakPolarHBondContact O-CB 3.28Å; G218-A221 PolarHBondContact O-N 3.21Å; G218-L222 PolarHBondContact O-N 2.85Å; G218-L222 VanDerWaalsContact O-N 3.07Å
219P90.4Very high88.3Confident33 Ų3323.4 Ų23.421%0.21412%0.124CC..Hα-helixtrans-54.1-39.2175.8-3237000114.2P75 Y215 A216 L222P75-P219 WeakPolarHBondContact CB-O 3.25Å; P75-P219 HydrophobicContact CG-CB 4.08Å; Y215-P219 HydrophobicContact CD1-CB 3.72Å; Y215-P219 HydrophobicContact CE1-CB 4.4Å; A216-P219 VanDerWaalsContact O-CD 3.31Å; A216-P219 WeakPolarHBondContact O-CD 3.39Å; P219-L222 PolarHBondContact O-N 3.14Å
220F89.6Confident89.4Confident56 Ų5623.6 Ų23.625%0.24612%0.123CC..Hα-helixtrans-61.8-47.9171.9176.1-94.3000111.2L55 Y215 A217 G218 L222 F223 F224L55-F220 HydrophobicContact CD2-CD1 4.18Å; Y215-F220 WeakPolarHBondContact O-CD2 3.48Å; A217-F220 WeakPolarHBondContact O-CB 3.42Å; G218-F220 VanDerWaalsContact C-N 3.26Å; G218-F220 PolarHBondContact O-N 2.95Å; F220-L222 PolarHBondContact O-N 3.41Å; F220-F223 PolarHBondContact O-N 3.49Å; F220-F224 AromaticContact CD1-CD2 3.6Å; F220-F224 HydrophobicContact CD1-CD2 3.6Å; F220-F224 AromaticContact CD1-CE2 3.77Å; F220-F224 HydrophobicContact CD1-CE2 3.77Å; F220-F224 HydrophobicContact CD2-CD2 4.12Å; F220-F224 AromaticContact CD2-CE2 3.62Å; F220-F224 HydrophobicContact CD2-CE2 3.62Å; F220-F224 AromaticContact CE1-CD2 3.35Å; F220-F224 HydrophobicContact CE1-CD2 3.35Å; F220-F224 AromaticContact CE1-CE2 3.23Å; F220-F224 HydrophobicContact CE1-CE2 3.23Å; F220-F224 HydrophobicContact CE1-CG 4.28Å; F220-F224 AromaticContact CE1-CZ 3.94Å; F220-F224 HydrophobicContact CE1-CZ 3.94Å; F220-F224 AromaticContact CE2-CD2 3.94Å; F220-F224 HydrophobicContact CE2-CD2 3.94Å; F220-F224 AromaticContact CE2-CE2 3.08Å; F220-F224 HydrophobicContact CE2-CE2 3.08Å; F220-F224 AromaticContact CE2-CZ 3.77Å; F220-F224 HydrophobicContact CE2-CZ 3.77Å; F220-F224 AromaticContact CG-CD2 3.99Å; F220-F224 HydrophobicContact CG-CD2 3.99Å; F220-F224 AromaticContact CG-CE2 3.96Å; F220-F224 HydrophobicContact CG-CE2 3.96Å; F220-F224 AromaticContact CZ-CD2 3.56Å; F220-F224 HydrophobicContact CZ-CD2 3.56Å; F220-F224 HydrophobicContact CZ-CE1 4.41Å; F220-F224 AromaticContact CZ-CE2 2.86Å; F220-F224 HydrophobicContact CZ-CE2 2.86Å; F220-F224 AromaticContact CZ-CZ 3.34Å; F220-F224 HydrophobicContact CZ-CZ 3.34Å; F220-F224 WeakPolarHBondContact O-CD2 3.21Å; F220-F224 PolarHBondContact O-N 3.2Å
221A91.7Very high89.9Confident5 Ų523.9 Ų23.94%0.04112%0.124CC..Hα-helixtrans-55.1-38.4178.200000112.4L55 A217 G218 F223 F224 M225L55-A221 HydrophobicContact CB-CB 4.11Å; L55-A221 HydrophobicContact CD1-CB 3.86Å; A217-A221 PolarHBondContact O-N 3.12Å; G218-A221 WeakPolarHBondContact O-CA 3.09Å; G218-A221 VanDerWaalsContact O-CB 3.28Å; G218-A221 WeakPolarHBondContact O-CB 3.28Å; G218-A221 PolarHBondContact O-N 3.21Å; A221-F223 PolarHBondContact O-N 3.24Å; A221-F224 PolarHBondContact O-N 3.3Å; A221-M225 HydrophobicContact CB-CE 4.37Å; A221-M225 WeakPolarHBondContact O-CB 3.43Å; A221-M225 WeakPolarHBondContact O-CG 3.4Å; A221-M225 PolarHBondContact O-N 3.12Å
222L92.9Very high90.7Very high38 Ų3823.7 Ų23.720%0.19912%0.124CC..Hα-helixtrans-60.5-40.9177.6-68170.5000112.7P75 T76 L79 G218 P219 F220 M225 A226P75-L222 HydrophobicContact CB-CB 3.72Å; P75-L222 HydrophobicContact CB-CD1 3.86Å; P75-L222 HydrophobicContact CB-CG 4.45Å; T76-L222 HydrophobicContact CG2-CD1 4.27Å; L79-L222 HydrophobicContact CB-CD2 4.47Å; L79-L222 HydrophobicContact CD2-CD2 3.61Å; G218-L222 PolarHBondContact O-N 2.85Å; G218-L222 VanDerWaalsContact O-N 3.07Å; P219-L222 PolarHBondContact O-N 3.14Å; F220-L222 PolarHBondContact O-N 3.41Å; L222-M225 HydrophobicContact CD2-CE 3.72Å; L222-M225 HydrophobicContact CG-CE 4.33Å; L222-A226 WeakPolarHBondContact O-CB 3.32Å; L222-A226 PolarHBondContact O-N 3.15Å
223F91.8Very high91.2Very high11 Ų1123.5 Ų23.55%0.04812%0.123CC..Hα-helixtrans-65.9-44.1174.9-77.8-62.3000112.4A74 P75 A78 F211 Y215 F220 A221 M225 A226 E227A74-F223 HydrophobicContact CB-CZ 4.21Å; P75-F223 HydrophobicContact CB-CD2 4.07Å; P75-F223 HydrophobicContact CB-CE2 3.77Å; P75-F223 HydrophobicContact CB-CZ 4.01Å; P75-F223 HydrophobicContact CG-CD2 4.22Å; P75-F223 HydrophobicContact CG-CE2 3.54Å; P75-F223 HydrophobicContact CG-CZ 3.89Å; A78-F223 HydrophobicContact CB-CD1 3.8Å; A78-F223 HydrophobicContact CB-CE1 3.79Å; F211-F223 AromaticContact CE2-CD1 4Å; F211-F223 HydrophobicContact CE2-CD1 4Å; F211-F223 HydrophobicContact CE2-CE1 4.22Å; F211-F223 HydrophobicContact CE2-CG 4.21Å; Y215-F223 HydrophobicContact CD1-CD2 4.45Å; Y215-F223 AromaticContact CD1-CE2 3.94Å; Y215-F223 HydrophobicContact CD1-CE2 3.94Å; Y215-F223 HydrophobicContact CD2-CE2 4.27Å; Y215-F223 AromaticContact CE1-CE2 3.87Å; Y215-F223 HydrophobicContact CE1-CE2 3.87Å; Y215-F223 HydrophobicContact CE2-CE2 4.2Å; Y215-F223 HydrophobicContact CG-CD2 4.45Å; Y215-F223 HydrophobicContact CG-CE2 4.13Å; F220-F223 PolarHBondContact O-N 3.49Å; A221-F223 PolarHBondContact O-N 3.24Å; F223-M225 VanDerWaalsContact C-N 3.35Å; F223-M225 PolarHBondContact O-N 3.31Å; F223-A226 PolarHBondContact O-N 3.35Å; F223-E227 WeakPolarHBondContact O-CB 3.38Å; F223-E227 PolarHBondContact O-N 3.35Å
224F90.3Very high91.8Very high36 Ų3621.2 Ų21.216%0.15811%0.111CC..Hα-helixtrans-62.1-44.9176.9-83.2-85.4000111.6E202 F220 A221 A226 E227 Y228E202-F224 WeakPolarHBondContact OE1-CZ 3.26Å; F220-F224 AromaticContact CD1-CD2 3.6Å; F220-F224 HydrophobicContact CD1-CD2 3.6Å; F220-F224 AromaticContact CD1-CE2 3.77Å; F220-F224 HydrophobicContact CD1-CE2 3.77Å; F220-F224 HydrophobicContact CD2-CD2 4.12Å; F220-F224 AromaticContact CD2-CE2 3.62Å; F220-F224 HydrophobicContact CD2-CE2 3.62Å; F220-F224 AromaticContact CE1-CD2 3.35Å; F220-F224 HydrophobicContact CE1-CD2 3.35Å; F220-F224 AromaticContact CE1-CE2 3.23Å; F220-F224 HydrophobicContact CE1-CE2 3.23Å; F220-F224 HydrophobicContact CE1-CG 4.28Å; F220-F224 AromaticContact CE1-CZ 3.94Å; F220-F224 HydrophobicContact CE1-CZ 3.94Å; F220-F224 AromaticContact CE2-CD2 3.94Å; F220-F224 HydrophobicContact CE2-CD2 3.94Å; F220-F224 AromaticContact CE2-CE2 3.08Å; F220-F224 HydrophobicContact CE2-CE2 3.08Å; F220-F224 AromaticContact CE2-CZ 3.77Å; F220-F224 HydrophobicContact CE2-CZ 3.77Å; F220-F224 AromaticContact CG-CD2 3.99Å; F220-F224 HydrophobicContact CG-CD2 3.99Å; F220-F224 AromaticContact CG-CE2 3.96Å; F220-F224 HydrophobicContact CG-CE2 3.96Å; F220-F224 AromaticContact CZ-CD2 3.56Å; F220-F224 HydrophobicContact CZ-CD2 3.56Å; F220-F224 HydrophobicContact CZ-CE1 4.41Å; F220-F224 AromaticContact CZ-CE2 2.86Å; F220-F224 HydrophobicContact CZ-CE2 2.86Å; F220-F224 AromaticContact CZ-CZ 3.34Å; F220-F224 HydrophobicContact CZ-CZ 3.34Å; F220-F224 WeakPolarHBondContact O-CD2 3.21Å; F220-F224 PolarHBondContact O-N 3.2Å; A221-F224 PolarHBondContact O-N 3.3Å; F224-A226 VanDerWaalsContact C-N 3.32Å; F224-A226 PolarHBondContact O-N 3.24Å; F224-E227 PolarHBondContact O-N 2.98Å; F224-Y228 AromaticContact CD1-CE2 3.97Å; F224-Y228 HydrophobicContact CD1-CE2 3.97Å; F224-Y228 WeakPolarHBondContact O-CD2 3.46Å; F224-Y228 PolarHBondContact O-N 3.39Å
225M92.8Very high92.2Very high33 Ų3317.8 Ų17.816%0.16310%0.095CC..Hα-helixtrans-58.9-46.5176.2-69.7-169.6-70.800110.6M17 F56 L79 A221 L222 F223 Y228 T229M17-M225 HydrophobicContact CE-CB 3.77Å; M17-M225 HydrophobicContact CE-CG 3.33Å; M17-M225 HydrophobicContact CE-SD 3.7Å; M17-M225 HydrophobicContact SD-CB 4.32Å; M17-M225 HydrophobicContact SD-CG 3.91Å; F56-M225 HydrophobicContact CZ-CE 4.18Å; L79-M225 HydrophobicContact CD1-CB 4.04Å; A221-M225 HydrophobicContact CB-CE 4.37Å; A221-M225 WeakPolarHBondContact O-CB 3.43Å; A221-M225 WeakPolarHBondContact O-CG 3.4Å; A221-M225 PolarHBondContact O-N 3.12Å; L222-M225 HydrophobicContact CD2-CE 3.72Å; L222-M225 HydrophobicContact CG-CE 4.33Å; F223-M225 VanDerWaalsContact C-N 3.35Å; F223-M225 PolarHBondContact O-N 3.31Å; M225-Y228 PolarHBondContact O-N 2.92Å; M225-T229 WeakPolarHBondContact O-CB 3.07Å; M225-T229 VanDerWaalsContact O-CG2 3.29Å; M225-T229 WeakPolarHBondContact O-CG2 3.2Å; M225-T229 PolarHBondContact O-N 3.48Å; M225-T229 PolarHBondContact O-OG1 3.12Å
226A93.9Very high92.6Very high4 Ų417.6 Ų17.63%0.03310%0.095CC..Hα-helixtrans-60-48.5177.800000112.5A78 A82 L222 F223 F224 Y228 T229 N230A78-A226 HydrophobicContact CB-CB 3.87Å; A82-A226 HydrophobicContact CB-CB 4.07Å; L222-A226 WeakPolarHBondContact O-CB 3.32Å; L222-A226 PolarHBondContact O-N 3.15Å; F223-A226 PolarHBondContact O-N 3.35Å; F224-A226 VanDerWaalsContact C-N 3.32Å; F224-A226 PolarHBondContact O-N 3.24Å; A226-Y228 PolarHBondContact O-N 3.45Å; A226-T229 VanDerWaalsContact CA-OG1 3.31Å; A226-T229 WeakPolarHBondContact CA-OG1 3.49Å; A226-T229 PolarHBondContact O-N 3.44Å; A226-T229 PolarHBondContact O-OG1 2.95Å; A226-N230 WeakPolarHBondContact O-CB 3.35Å; A226-N230 VanDerWaalsContact O-CG 3.3Å; A226-N230 PolarHBondContact O-N 3.43Å; A226-N230 PolarHBondContact O-ND2 3.26Å
227E92.3Very high93.1Very high34 Ų3417.1 Ų17.116%0.1599%0.09CC..Hα-helixtrans-59.4-49179.4-168.1-162.1-171.100111.4R195 F223 F224 T229 N230 I231R195-E227 IonicContact CZ-OE1 3.12Å; R195-E227 IonicContact CZ-OE2 4Å; R195-E227 IonicContact NE-OE1 3.8Å; R195-E227 IonicContact NH1-OE1 2.78Å; R195-E227 PolarHBondContact NH1-OE1 2.88Å; R195-E227 IonicContact NH1-OE2 2.99Å; R195-E227 PolarHBondContact NH1-OE2 3.35Å; R195-E227 IonicContact NH2-OE1 3.75Å; R195-E227 PolarHBondContact NH2-OE1 3.43Å; R195-E227 IonicContact NH2-OE2 3.95Å; R195-E227 PolarHBondContact NH2-OE2 3.46Å; F223-E227 WeakPolarHBondContact O-CB 3.38Å; F223-E227 PolarHBondContact O-N 3.35Å; F224-E227 PolarHBondContact O-N 2.98Å; E227-T229 PolarHBondContact O-N 3.06Å; E227-N230 WeakPolarHBondContact O-CB 3.36Å; E227-N230 PolarHBondContact O-N 3.26Å; E227-N230 VanDerWaalsContact O-N 3.16Å; E227-I231 WeakPolarHBondContact O-CG1 3.4Å; E227-I231 PolarHBondContact O-N 2.89Å
228Y93.3Very high93.5Very high21 Ų2117.1 Ų17.18%0.0829%0.09CC..Hα-helixtrans-67.5-36178.6-75.7-65.1000113.2L20 M21 E24 F224 M225 A226 N230 I231 I232L20-Y228 HydrophobicContact CD2-CD1 3.19Å; L20-Y228 HydrophobicContact CD2-CE1 3.67Å; L20-Y228 HydrophobicContact CD2-CG 4.11Å; M21-Y228 HydrophobicContact CG-CD2 3.76Å; M21-Y228 HydrophobicContact CG-CE1 4.45Å; M21-Y228 HydrophobicContact CG-CE2 3.63Å; M21-Y228 HydrophobicContact CG-CG 4.28Å; M21-Y228 HydrophobicContact SD-CD2 4.11Å; M21-Y228 HydrophobicContact SD-CE2 3.95Å; E24-Y228 WeakPolarHBondContact OE2-CE1 3.27Å; E24-Y228 VanDerWaalsContact OE2-CZ 3.32Å; E24-Y228 PolarHBondContact OE2-OH 3.42Å; F224-Y228 AromaticContact CD1-CE2 3.97Å; F224-Y228 HydrophobicContact CD1-CE2 3.97Å; F224-Y228 WeakPolarHBondContact O-CD2 3.46Å; F224-Y228 PolarHBondContact O-N 3.39Å; M225-Y228 PolarHBondContact O-N 2.92Å; A226-Y228 PolarHBondContact O-N 3.45Å; Y228-N230 VanDerWaalsContact C-N 3.29Å; Y228-N230 PolarHBondContact O-N 2.73Å; Y228-I231 HydrophobicContact CD1-CD1 3.88Å; Y228-I231 HydrophobicContact CE1-CD1 4.37Å; Y228-I231 PolarHBondContact O-N 2.84Å; Y228-I232 PolarHBondContact O-N 2.79Å
229T95.1Very high93.8Very high0 Ų016.4 Ų16.40%08%0.083CC..Hα-helixtrans-63.7-37.4172.150.70000111.7I13 M17 A82 M225 A226 E227 I231 I232 M233I13-T229 HydrophobicContact CG2-CG2 3.97Å; M17-T229 HydrophobicContact CB-CG2 3.97Å; M17-T229 HydrophobicContact CG-CG2 4.09Å; A82-T229 VanDerWaalsContact CB-OG1 3.23Å; A82-T229 WeakPolarHBondContact CB-OG1 3.42Å; M225-T229 WeakPolarHBondContact O-CB 3.07Å; M225-T229 VanDerWaalsContact O-CG2 3.29Å; M225-T229 WeakPolarHBondContact O-CG2 3.2Å; M225-T229 PolarHBondContact O-N 3.48Å; M225-T229 PolarHBondContact O-OG1 3.12Å; A226-T229 VanDerWaalsContact CA-OG1 3.31Å; A226-T229 WeakPolarHBondContact CA-OG1 3.49Å; A226-T229 PolarHBondContact O-N 3.44Å; A226-T229 PolarHBondContact O-OG1 2.95Å; E227-T229 PolarHBondContact O-N 3.06Å; T229-I231 VanDerWaalsContact C-N 3.34Å; T229-I231 PolarHBondContact O-N 3.29Å; T229-I232 PolarHBondContact O-N 3.32Å; T229-M233 WeakPolarHBondContact O-CB 3.42Å; T229-M233 PolarHBondContact O-N 3.46Å
230N94.6Very high94.1Very high31 Ų3115 Ų1517%0.1667%0.073CC..Hα-helixtrans-66.5-34.1175.6-74.1-17.8000112.2A82 A226 E227 Y228 M233 M234A82-N230 WeakPolarHBondContact CA-OD1 3.39Å; A82-N230 VanDerWaalsContact CB-OD1 3.27Å; A82-N230 WeakPolarHBondContact CB-OD1 3.45Å; A226-N230 WeakPolarHBondContact O-CB 3.35Å; A226-N230 VanDerWaalsContact O-CG 3.3Å; A226-N230 PolarHBondContact O-N 3.43Å; A226-N230 PolarHBondContact O-ND2 3.26Å; E227-N230 WeakPolarHBondContact O-CB 3.36Å; E227-N230 PolarHBondContact O-N 3.26Å; E227-N230 VanDerWaalsContact O-N 3.16Å; Y228-N230 VanDerWaalsContact C-N 3.29Å; Y228-N230 PolarHBondContact O-N 2.73Å; N230-M233 PolarHBondContact O-N 3.48Å; N230-M234 WeakPolarHBondContact O-CB 3.38Å; N230-M234 VanDerWaalsContact O-CG 3.29Å; N230-M234 WeakPolarHBondContact O-CG 3.43Å; N230-M234 PolarHBondContact O-N 3.11Å
231I94.8Very high94.3Very high6 Ų612.3 Ų12.33%0.0316%0.062CC..Hα-helixtrans-63.1-48175-67.4163.6000111.3T193 R195 E227 Y228 T229 M233 N235 F270T193-I231 HydrophobicContact CG2-CG1 4.15Å; R195-I231 HydrophobicContact CG-CD1 3.85Å; R195-I231 HydrophobicContact CG-CG1 4.27Å; E227-I231 WeakPolarHBondContact O-CG1 3.4Å; E227-I231 PolarHBondContact O-N 2.89Å; Y228-I231 HydrophobicContact CD1-CD1 3.88Å; Y228-I231 HydrophobicContact CE1-CD1 4.37Å; Y228-I231 PolarHBondContact O-N 2.84Å; T229-I231 VanDerWaalsContact C-N 3.34Å; T229-I231 PolarHBondContact O-N 3.29Å; I231-M233 VanDerWaalsContact C-N 3.32Å; I231-N235 WeakPolarHBondContact O-CB 3.49Å; I231-N235 PolarHBondContact O-N 3.37Å; I231-N235 VanDerWaalsContact O-N 3.1Å; I231-N235 PolarHBondContact O-ND2 3.48Å; I231-F270 HydrophobicContact CG2-CD2 3.87Å; I231-F270 HydrophobicContact CG2-CE2 4.39Å
232I95.9Very high94.6Very high19 Ų1912.4 Ų12.410%0.0976%0.061CC..Hα-helixtrans-66.5-42.6178.9-51.9169.5000109A16 M17 L20 W86 Y228 T229 N235 T236A16-I232 HydrophobicContact CB-CD1 4.29Å; M17-I232 HydrophobicContact CB-CD1 4.4Å; L20-I232 HydrophobicContact CB-CD1 4.3Å; L20-I232 HydrophobicContact CD1-CD1 3.94Å; L20-I232 HydrophobicContact CD1-CG1 3.54Å; W86-I232 HydrophobicContact CH2-CB 3.95Å; W86-I232 HydrophobicContact CH2-CG2 3.56Å; W86-I232 HydrophobicContact CZ2-CB 3.93Å; W86-I232 HydrophobicContact CZ2-CG2 4.08Å; Y228-I232 PolarHBondContact O-N 2.79Å; T229-I232 PolarHBondContact O-N 3.32Å; I232-N235 PolarHBondContact O-N 3.02Å; I232-T236 HydrophobicContact CG2-CG2 4.18Å; I232-T236 WeakPolarHBondContact O-CG2 3.33Å; I232-T236 PolarHBondContact O-N 2.94Å; I232-T236 PolarHBondContact O-OG1 2.84Å
233M95.7Very high94.6Very high0 Ų012 Ų120%06%0.059CC..Hα-helixtrans-60-49.2179.3-173.5-81.6-61.700112L85 W86 L89 T229 N230 I231 N235 T236 L237L85-M233 HydrophobicContact CB-CE 3.8Å; L85-M233 HydrophobicContact CB-CG 3.87Å; L85-M233 HydrophobicContact CB-SD 3.91Å; L85-M233 HydrophobicContact CD1-CE 3.5Å; L85-M233 VanDerWaalsContact CD1-CE 3.5Å; L85-M233 HydrophobicContact CD2-CE 4.12Å; L85-M233 HydrophobicContact CD2-SD 4.44Å; L85-M233 HydrophobicContact CG-CE 4Å; W86-M233 HydrophobicContact CD2-CB 4.44Å; W86-M233 HydrophobicContact CD2-CG 4.4Å; W86-M233 HydrophobicContact CZ2-CB 3.77Å; L89-M233 HydrophobicContact CD1-CG 4.12Å; T229-M233 WeakPolarHBondContact O-CB 3.42Å; T229-M233 PolarHBondContact O-N 3.46Å; N230-M233 PolarHBondContact O-N 3.48Å; I231-M233 VanDerWaalsContact C-N 3.32Å; M233-N235 VanDerWaalsContact C-N 3.34Å; M233-N235 PolarHBondContact O-N 3.37Å; M233-T236 WeakPolarHBondContact CA-OG1 3.1Å; M233-T236 CarbonylContact O-C 3.55Å; M233-T236 PolarHBondContact O-N 2.99Å; M233-T236 VanDerWaalsContact O-N 3.09Å; M233-T236 PolarHBondContact O-OG1 3.5Å; M233-L237 PolarHBondContact O-N 2.92Å
234M95.1Very high94.5Very high6 Ų611.6 Ų11.63%0.036%0.058CC..Hα-helixtrans-62.5-41.3177.4-71.3-55.4-179.100111.8T189 E192 T193 N230 T236 L237 T238T189-M234 HydrophobicContact CG2-CB 4.48Å; T189-M234 HydrophobicContact CG2-SD 4.48Å; E192-M234 HydrophobicContact CG-CE 3.98Å; E192-M234 WeakPolarHBondContact OE1-CE 3.31Å; E192-M234 VanDerWaalsContact OE2-CE 3.29Å; E192-M234 WeakPolarHBondContact OE2-CE 3.27Å; T193-M234 HydrophobicContact CG2-CB 4.17Å; T193-M234 HydrophobicContact CG2-CG 3.74Å; N230-M234 WeakPolarHBondContact O-CB 3.38Å; N230-M234 VanDerWaalsContact O-CG 3.29Å; N230-M234 WeakPolarHBondContact O-CG 3.43Å; N230-M234 PolarHBondContact O-N 3.11Å; M234-T236 VanDerWaalsContact C-N 3.32Å; M234-T236 PolarHBondContact O-N 2.87Å; M234-L237 WeakPolarHBondContact O-CB 3.44Å; M234-L237 PolarHBondContact O-N 2.81Å; M234-L237 HydrophobicContact SD-CD2 4.19Å; M234-T238 WeakPolarHBondContact O-CG2 3.43Å; M234-T238 PolarHBondContact O-N 3.24Å
235N96Very high94.4Very high0 Ų010.2 Ų10.20%05%0.053CC..Hα-helixtrans-63.9-37.9174.3-76.9-61000111.8I231 I232 M233 T238 T239 L266 T267 F270I231-N235 WeakPolarHBondContact O-CB 3.49Å; I231-N235 PolarHBondContact O-N 3.37Å; I231-N235 VanDerWaalsContact O-N 3.1Å; I231-N235 PolarHBondContact O-ND2 3.48Å; I232-N235 PolarHBondContact O-N 3.02Å; M233-N235 VanDerWaalsContact C-N 3.34Å; M233-N235 PolarHBondContact O-N 3.37Å; N235-T238 WeakPolarHBondContact CA-OG1 3.37Å; N235-T238 PolarHBondContact O-N 3.26Å; N235-T238 PolarHBondContact O-OG1 3.2Å; N235-T239 PolarHBondContact O-N 3.25Å; N235-T239 PolarHBondContact O-OG1 3.29Å; N235-L266 HydrophobicContact CB-CB 4.32Å; N235-T267 HydrophobicContact CB-CG2 3.74Å; N235-F270 WeakPolarHBondContact OD1-CD1 3.35Å; N235-F270 WeakPolarHBondContact OD1-CE1 3.48Å
236T95.6Very high94.1Very high4 Ų413.1 Ų13.13%0.0257%0.072CC..Hα-helixtrans-65-41.7173.765.80000111.9W86 L89 I232 M233 M234 T238 T239 T240 F259 T263W86-T236 HydrophobicContact CH2-CG2 3.98Å; W86-T236 HydrophobicContact CZ3-CG2 3.96Å; L89-T236 WeakPolarHBondContact CD1-OG1 2.99Å; I232-T236 HydrophobicContact CG2-CG2 4.18Å; I232-T236 WeakPolarHBondContact O-CG2 3.33Å; I232-T236 PolarHBondContact O-N 2.94Å; I232-T236 PolarHBondContact O-OG1 2.84Å; M233-T236 WeakPolarHBondContact CA-OG1 3.1Å; M233-T236 CarbonylContact O-C 3.55Å; M233-T236 PolarHBondContact O-N 2.99Å; M233-T236 VanDerWaalsContact O-N 3.09Å; M233-T236 PolarHBondContact O-OG1 3.5Å; M234-T236 VanDerWaalsContact C-N 3.32Å; M234-T236 PolarHBondContact O-N 2.87Å; T236-T238 PolarHBondContact O-N 3.11Å; T236-T239 WeakPolarHBondContact CA-OG1 3.24Å; T236-T239 PolarHBondContact O-N 2.65Å; T236-T239 PolarHBondContact O-OG1 3.21Å; T236-T240 WeakPolarHBondContact O-CG2 3.11Å; T236-T240 PolarHBondContact O-N 3.38Å; T236-F259 HydrophobicContact CG2-CE1 4.39Å; T236-T263 HydrophobicContact CG2-CG2 3.82Å
237L96.3Very high93.9Very high3 Ų317.3 Ų17.32%0.0169%0.088CC..Hα-helixtrans-59.9-46.4173.7-17569.6000110.9L89 I105 L162 W185 M233 M234 T239 T240 I241L89-L237 HydrophobicContact CD2-CD1 4.16Å; I105-L237 HydrophobicContact CD1-CD1 3.6Å; I105-L237 HydrophobicContact CG2-CD2 4Å; L162-L237 HydrophobicContact CD2-CD1 4.25Å; W185-L237 HydrophobicContact CH2-CD2 3.67Å; W185-L237 HydrophobicContact CH2-CG 4.4Å; W185-L237 HydrophobicContact CZ2-CD2 3.57Å; W185-L237 HydrophobicContact CZ2-CG 3.94Å; M233-L237 PolarHBondContact O-N 2.92Å; M234-L237 WeakPolarHBondContact O-CB 3.44Å; M234-L237 PolarHBondContact O-N 2.81Å; M234-L237 HydrophobicContact SD-CD2 4.19Å; L237-T239 VanDerWaalsContact C-N 3.28Å; L237-T239 PolarHBondContact O-N 3.2Å; L237-T240 WeakPolarHBondContact CA-OG1 3.43Å; L237-T240 PolarHBondContact O-N 2.89Å; L237-T240 VanDerWaalsContact O-N 3.09Å; L237-T240 PolarHBondContact O-OG1 2.81Å; L237-I241 HydrophobicContact CD1-CD1 4.04Å; L237-I241 HydrophobicContact CD2-CD1 4.4Å; L237-I241 HydrophobicContact CG-CD1 3.75Å; L237-I241 WeakPolarHBondContact O-CG1 3.4Å; L237-I241 PolarHBondContact O-N 3.06Å
238T96.8Very high93.6Very high5 Ų519.8 Ų19.83%0.03110%0.102CC..Hα-helixtrans-58.5-40.5177.2720000111.7W185 T189 M234 N235 T236 I241 F242 L266W185-T238 HydrophobicContact CZ2-CG2 4.49Å; T189-T238 HydrophobicContact CG2-CG2 4.14Å; M234-T238 WeakPolarHBondContact O-CG2 3.43Å; M234-T238 PolarHBondContact O-N 3.24Å; N235-T238 WeakPolarHBondContact CA-OG1 3.37Å; N235-T238 PolarHBondContact O-N 3.26Å; N235-T238 PolarHBondContact O-OG1 3.2Å; T236-T238 PolarHBondContact O-N 3.11Å; T238-I241 PolarHBondContact O-N 3.14Å; T238-F242 PolarHBondContact O-N 3.48Å; T238-L266 WeakPolarHBondContact OG1-CD1 3.36Å
239T96.3Very high93.2Very high0 Ų022.2 Ų22.20%013%0.126CC..Hα-helixtrans-67.9-37.9175.651.30000112.7N235 T236 L237 I241 L243 G244 F259 K262 T263 L266N235-T239 PolarHBondContact O-N 3.25Å; N235-T239 PolarHBondContact O-OG1 3.29Å; T236-T239 WeakPolarHBondContact CA-OG1 3.24Å; T236-T239 PolarHBondContact O-N 2.65Å; T236-T239 PolarHBondContact O-OG1 3.21Å; L237-T239 VanDerWaalsContact C-N 3.28Å; L237-T239 PolarHBondContact O-N 3.2Å; T239-I241 VanDerWaalsContact C-N 3.34Å; T239-I241 PolarHBondContact O-N 3.14Å; T239-L243 CarbonylContact O-C 3.6Å; T239-L243 WeakPolarHBondContact O-CA 3.39Å; T239-L243 PolarHBondContact O-N 3.26Å; T239-G244 PolarHBondContact O-N 3.29Å; T239-F259 WeakPolarHBondContact OG1-CE2 3.34Å; T239-F259 WeakPolarHBondContact OG1-CZ 3.26Å; T239-K262 HydrophobicContact CG2-CB 3.98Å; T239-T263 HydrophobicContact CG2-CG2 3.84Å; T239-T263 VanDerWaalsContact OG1-CG2 3.23Å; T239-T263 WeakPolarHBondContact OG1-CG2 3.46Å; T239-L266 HydrophobicContact CG2-CD1 3.5Å; T239-L266 HydrophobicContact CG2-CG 4.34Å
240T95Very high92.9Very high3 Ų329.9 Ų29.92%0.01817%0.166CC..Hα-helixtrans-64.8-38.1176.359.30000112.2P90 Q169 T236 L237 F259P90-T240 HydrophobicContact CG-CG2 4.08Å; Q169-T240 PolarHBondContact NE2-O 3.36Å; T236-T240 WeakPolarHBondContact O-CG2 3.11Å; T236-T240 PolarHBondContact O-N 3.38Å; L237-T240 WeakPolarHBondContact CA-OG1 3.43Å; L237-T240 PolarHBondContact O-N 2.89Å; L237-T240 VanDerWaalsContact O-N 3.09Å; L237-T240 PolarHBondContact O-OG1 2.81Å; T240-F259 HydrophobicContact CG2-CE2 3.47Å; T240-F259 VanDerWaalsContact CG2-CE2 3.47Å; T240-F259 HydrophobicContact CG2-CZ 3.6Å
241I95.5Very high92.6Very high0 Ų029.6 Ų29.60%017%0.167CC..Hα-helixtrans-79.6-43.1-175.5-62.7163.2000111.6L150 T153 L165 Q169 L174 W185 L237 T238 T239L150-I241 HydrophobicContact CD2-CD1 3.45Å; L150-I241 VanDerWaalsContact CD2-CD1 3.45Å; T153-I241 HydrophobicContact CG2-CG2 4.23Å; L165-I241 HydrophobicContact CD1-CG1 4.26Å; Q169-I241 PolarHBondContact NE2-O 3.27Å; L174-I241 WeakPolarHBondContact CB-O 3.29Å; L174-I241 HydrophobicContact CD2-CG2 4.33Å; L174-I241 VanDerWaalsContact CD2-O 3.24Å; L174-I241 WeakPolarHBondContact CD2-O 3.34Å; W185-I241 HydrophobicContact CH2-CD1 3.98Å; W185-I241 HydrophobicContact CZ2-CD1 3.64Å; L237-I241 HydrophobicContact CD1-CD1 4.04Å; L237-I241 HydrophobicContact CD2-CD1 4.4Å; L237-I241 HydrophobicContact CG-CD1 3.75Å; L237-I241 WeakPolarHBondContact O-CG1 3.4Å; L237-I241 PolarHBondContact O-N 3.06Å; T238-I241 PolarHBondContact O-N 3.14Å; T239-I241 VanDerWaalsContact C-N 3.34Å; T239-I241 PolarHBondContact O-N 3.14Å
242F96Very high92.3Very high6 Ų631.3 Ų31.33%0.02618%0.178CC..Hα-helixtrans-112.3-28.1-168.8-66.7-73.7000114.9T153 Q169 L174 L175 S178 A182 W185 T238T153-F242 HydrophobicContact CG2-CE1 3.69Å; T153-F242 HydrophobicContact CG2-CZ 3.66Å; Q169-F242 VanDerWaalsContact OE1-C 3.31Å; Q169-F242 PolarHBondContact OE1-O 3.39Å; L174-F242 PolarHBondContact N-O 3.49Å; L175-F242 HydrophobicContact CB-CB 4.13Å; L175-F242 WeakPolarHBondContact CB-O 3.39Å; L175-F242 HydrophobicContact CD1-CB 4.44Å; L175-F242 PolarHBondContact N-O 3.38Å; S178-F242 VanDerWaalsContact OG-CE1 3.31Å; S178-F242 WeakPolarHBondContact OG-CE1 3.18Å; A182-F242 HydrophobicContact CB-CD1 3.55Å; A182-F242 HydrophobicContact CB-CD2 4.34Å; A182-F242 HydrophobicContact CB-CE1 3.62Å; A182-F242 HydrophobicContact CB-CE2 4.43Å; A182-F242 HydrophobicContact CB-CG 3.92Å; A182-F242 HydrophobicContact CB-CZ 4.07Å; W185-F242 HydrophobicContact CB-CE2 3.78Å; W185-F242 HydrophobicContact CB-CZ 4.04Å; W185-F242 AromaticContact CD1-CD2 3.82Å; W185-F242 AromaticContact CD1-CE2 3.34Å; W185-F242 AromaticContact CD2-CE2 3.99Å; W185-F242 HydrophobicContact CD2-CE2 3.99Å; W185-F242 HydrophobicContact CG-CD2 4.31Å; W185-F242 AromaticContact CG-CE2 3.41Å; W185-F242 HydrophobicContact CG-CE2 3.41Å; W185-F242 VanDerWaalsContact CG-CE2 3.41Å; W185-F242 HydrophobicContact CG-CZ 4.11Å; W185-F242 AromaticContact NE1-CE2 3.83Å; T238-F242 PolarHBondContact O-N 3.48Å
243L94.4Very high92.1Very high30 Ų3036.3 Ų36.316%0.15720%0.201CC..SBendtrans-125.542.8-170.5-65.8176.1000111.9W173 L175 T239 K262 L266W173-L243 HydrophobicContact CD2-CD2 4.34Å; W173-L243 HydrophobicContact CE3-CD2 4.05Å; L175-L243 HydrophobicContact CB-CD2 4.18Å; L175-L243 HydrophobicContact CD1-CD2 3.93Å; L175-L243 HydrophobicContact CD1-CG 4.29Å; T239-L243 CarbonylContact O-C 3.6Å; T239-L243 WeakPolarHBondContact O-CA 3.39Å; T239-L243 PolarHBondContact O-N 3.26Å; L243-K262 HydrophobicContact CB-CD 4.15Å; L243-K262 VanDerWaalsContact O-CD 3.29Å; L243-K262 WeakPolarHBondContact O-CD 3.35Å; L243-K262 PolarHBondContact O-NZ 3.15Å; L243-L266 HydrophobicContact CD1-CD1 4.18Å
244G89.5Confident91.9Very high2 Ų240.5 Ų40.52%0.02122%0.223CC..  trans-50.7153.3176.900000112.7W173 T239 K262W173-G244 PolarHBondContact NE1-O 3.12Å; T239-G244 PolarHBondContact O-N 3.29Å; G244-K262 PolarHBondContact O-NZ 3.25Å
245T88.7Confident91.8Very high8 Ų840.3 Ų40.35%0.04922%0.222CC..  trans-114.4145.3177.7420000109.1Y247 Y255 K262T245-Y247 PolarHBondContact O-N 3.32Å; T245-Y255 WeakPolarHBondContact O-CD2 3.43Å; T245-Y255 WeakPolarHBondContact O-CE2 3.48Å; T245-Y255 WeakPolarHBondContact OG1-CD2 3.36Å; T245-Y255 WeakPolarHBondContact OG1-CE2 3.48Å; T245-K262 HydrophobicContact CG2-CD 3.99Å
246T85.4Confident91.7Very high94 Ų9442.4 Ų42.458%0.57724%0.235SC*.  trans-64.2132.3176.650.20000109.7
247Y88.8Confident91.6Very high92 Ų9245.7 Ų45.736%0.36126%0.255SS..  trans-95120.2176.8175.3-106.7000109.9P92 T245 A249 P252 Y255P92-Y247 HydrophobicContact CB-CD2 3.56Å; P92-Y247 HydrophobicContact CB-CE2 3.63Å; P92-Y247 HydrophobicContact CG-CD2 3.98Å; P92-Y247 HydrophobicContact CG-CE2 3.63Å; T245-Y247 PolarHBondContact O-N 3.32Å; Y247-A249 HydrophobicContact CE1-CB 4.11Å; Y247-P252 HydrophobicContact CE2-CB 4.34Å; Y247-Y255 HydrophobicContact CD2-CD2 4.5Å
248D86.6Confident91.5Very high85 Ų8551.9 Ų51.946%0.45528%0.28SS..  trans-107.6123.4167.4-171.5-6.2000108.7L250 S251D248-L250 PolarHBondContact O-N 3.36Å; D248-L250 PolarHBondContact OD1-N 3.24Å; D248-S251 CarbonylContact O-C 3.01Å; D248-S251 PolarHBondContact O-N 3.48Å
249A85.2Confident91.4Very high72 Ų7251.8 Ų51.860%0.59528%0.279SS*.THydrogen-bonded Turntrans-66.8-24.7-176.900000112.9Y247Y247-A249 HydrophobicContact CE1-CB 4.11Å
250L87.9Confident91.3Very high161 Ų16154.8 Ų54.884%0.84330%0.297SS*.THydrogen-bonded Turntrans-76-25.3179.3-68.1170.9000112.7D248D248-L250 PolarHBondContact O-N 3.36Å; D248-L250 PolarHBondContact OD1-N 3.24Å
251S89.4Confident91.3Very high26 Ų2658.5 Ų58.518%0.18232%0.32CS..  trans-141.674.1-176.158.70000111.2D248 E253 L254D248-S251 CarbonylContact O-C 3.01Å; D248-S251 PolarHBondContact O-N 3.48Å; S251-E253 PolarHBondContact O-N 3.09Å; S251-L254 PolarHBondContact O-N 3.1Å; S251-L254 VanDerWaalsContact O-N 3.14Å; S251-L254 VanDerWaalsContact OG-CD1 3.31Å; S251-L254 WeakPolarHBondContact OG-CD1 3.42Å
252P88.8Confident91.4Very high41 Ų4160.5 Ų60.527%0.26633%0.328SS..Hα-helixtrans-63-21.2179.827.1-35000112.7P92 Y247 L254 Y255 T256P92-P252 HydrophobicContact CG-CB 3.98Å; Y247-P252 HydrophobicContact CE2-CB 4.34Å; P252-L254 VanDerWaalsContact C-N 3.28Å; P252-L254 PolarHBondContact O-N 2.8Å; P252-Y255 WeakPolarHBondContact O-CB 3.19Å; P252-Y255 PolarHBondContact O-N 3.18Å; P252-T256 PolarHBondContact O-N 3.24Å
253E91.4Very high91.4Very high124 Ų12460.5 Ų60.558%0.57933%0.329SS*.Hα-helixtrans-67.6-27.6177.1-54.184-176.900112.7S251 Y255 T256 T257S251-E253 PolarHBondContact O-N 3.09Å; E253-Y255 VanDerWaalsContact C-N 3.34Å; E253-T256 PolarHBondContact O-N 3.11Å; E253-T256 PolarHBondContact O-OG1 3.41Å; E253-T257 VanDerWaalsContact O-CG2 3.31Å; E253-T257 WeakPolarHBondContact O-CG2 3.26Å; E253-T257 PolarHBondContact O-N 3.44Å; E253-T257 PolarHBondContact O-OG1 3.12Å; E253-T257 VanDerWaalsContact O-OG1 3.05Å
254L91.6Very high91.4Very high88 Ų8864 Ų6446%0.46135%0.347SS..Hα-helixtrans-66.6-40.3175.2-67.2-176.5000110.8S251 P252 T256 T257 Y258S251-L254 PolarHBondContact O-N 3.1Å; S251-L254 VanDerWaalsContact O-N 3.14Å; S251-L254 VanDerWaalsContact OG-CD1 3.31Å; S251-L254 WeakPolarHBondContact OG-CD1 3.42Å; P252-L254 VanDerWaalsContact C-N 3.28Å; P252-L254 PolarHBondContact O-N 2.8Å; L254-T256 PolarHBondContact O-N 3.32Å; L254-T257 WeakPolarHBondContact CA-OG1 3.42Å; L254-T257 PolarHBondContact O-N 3.16Å; L254-T257 PolarHBondContact O-OG1 3.41Å; L254-Y258 HydrophobicContact CB-CE2 4.37Å; L254-Y258 WeakPolarHBondContact O-CD2 3.39Å; L254-Y258 PolarHBondContact O-N 3.35Å; L254-Y258 VanDerWaalsContact O-N 3.09Å
255Y92.6Very high91.7Very high2 Ų269 Ų691%0.00837%0.373CS..Hα-helixtrans-59-49.7174.3179-81.3000110.7P92 I166 T245 Y247 P252 E253 T257 Y258 F259P92-Y255 HydrophobicContact CB-CD1 3.54Å; P92-Y255 HydrophobicContact CB-CD2 4.41Å; P92-Y255 HydrophobicContact CB-CE1 3.92Å; P92-Y255 HydrophobicContact CB-CG 3.84Å; P92-Y255 HydrophobicContact CG-CD1 4.14Å; P92-Y255 HydrophobicContact CG-CG 4.44Å; I166-Y255 HydrophobicContact CD1-CE1 4.43Å; I166-Y255 HydrophobicContact CD1-CE2 3.91Å; I166-Y255 VanDerWaalsContact CD1-OH 3.25Å; I166-Y255 WeakPolarHBondContact CD1-OH 3.49Å; I166-Y255 HydrophobicContact CG1-CE2 4.11Å; I166-Y255 WeakPolarHBondContact CG1-OH 3.35Å; I166-Y255 HydrophobicContact CG2-CD2 4.48Å; I166-Y255 HydrophobicContact CG2-CE2 3.74Å; T245-Y255 WeakPolarHBondContact O-CD2 3.43Å; T245-Y255 WeakPolarHBondContact O-CE2 3.48Å; T245-Y255 WeakPolarHBondContact OG1-CD2 3.36Å; T245-Y255 WeakPolarHBondContact OG1-CE2 3.48Å; Y247-Y255 HydrophobicContact CD2-CD2 4.5Å; P252-Y255 WeakPolarHBondContact O-CB 3.19Å; P252-Y255 PolarHBondContact O-N 3.18Å; E253-Y255 VanDerWaalsContact C-N 3.34Å; Y255-T257 VanDerWaalsContact C-N 3.35Å; Y255-T257 PolarHBondContact O-N 3.18Å; Y255-Y258 PolarHBondContact O-N 3.02Å; Y255-F259 HydrophobicContact CD1-CB 4.35Å; Y255-F259 HydrophobicContact CE1-CB 4.07Å; Y255-F259 HydrophobicContact CE1-CD2 4.39Å; Y255-F259 HydrophobicContact CE1-CG 4.23Å; Y255-F259 WeakPolarHBondContact O-CB 3.34Å; Y255-F259 PolarHBondContact O-N 3.01Å
256T93.4Very high92Very high44 Ų4469.6 Ų69.627%0.2738%0.376SS..Hα-helixtrans-63.9-39.5-176.960.40000112.1P92 P252 E253 L254 F259 V260P92-T256 VanDerWaalsContact CD-CG2 3.42Å; P252-T256 PolarHBondContact O-N 3.24Å; E253-T256 PolarHBondContact O-N 3.11Å; E253-T256 PolarHBondContact O-OG1 3.41Å; L254-T256 PolarHBondContact O-N 3.32Å; T256-F259 PolarHBondContact O-N 3Å; T256-V260 VanDerWaalsContact O-CB 3.31Å; T256-V260 WeakPolarHBondContact O-CB 3.27Å; T256-V260 WeakPolarHBondContact O-CG2 3.14Å; T256-V260 PolarHBondContact O-N 3.05Å
257T93.3Very high92.5Very high73 Ų7365.7 Ų65.745%0.44835%0.352SS..Hα-helixtrans-66.2-46178.3530000112.6E253 L254 Y255 T261E253-T257 VanDerWaalsContact O-CG2 3.31Å; E253-T257 WeakPolarHBondContact O-CG2 3.26Å; E253-T257 PolarHBondContact O-N 3.44Å; E253-T257 PolarHBondContact O-OG1 3.12Å; E253-T257 VanDerWaalsContact O-OG1 3.05Å; L254-T257 WeakPolarHBondContact CA-OG1 3.42Å; L254-T257 PolarHBondContact O-N 3.16Å; L254-T257 PolarHBondContact O-OG1 3.41Å; Y255-T257 VanDerWaalsContact C-N 3.35Å; Y255-T257 PolarHBondContact O-N 3.18Å; T257-T261 VanDerWaalsContact O-CG2 3.29Å; T257-T261 WeakPolarHBondContact O-CG2 3.41Å; T257-T261 PolarHBondContact O-N 2.93Å; T257-T261 PolarHBondContact O-OG1 2.89Å
258Y94.3Very high92.7Very high134 Ų13463.7 Ų63.753%0.52535%0.351SS..Hα-helixtrans-66.2-39.5175.4-70.1-57.2000112.2L254 Y255 T261 K262L254-Y258 HydrophobicContact CB-CE2 4.37Å; L254-Y258 WeakPolarHBondContact O-CD2 3.39Å; L254-Y258 PolarHBondContact O-N 3.35Å; L254-Y258 VanDerWaalsContact O-N 3.09Å; Y255-Y258 PolarHBondContact O-N 3.02Å; Y258-T261 WeakPolarHBondContact CA-OG1 3.22Å; Y258-T261 PolarHBondContact O-N 3.48Å; Y258-T261 PolarHBondContact O-OG1 3.36Å; Y258-K262 WeakPolarHBondContact O-CG 3.42Å; Y258-K262 PolarHBondContact O-N 3.28Å; Y258-K262 VanDerWaalsContact O-N 3.11Å
259F95.3Very high93Very high2 Ų262.2 Ų62.21%0.00934%0.343CS..Hα-helixtrans-60.8-51.6176.3-179-102.7000110.9M91 T236 T239 T240 Y255 T256 T261 K262 T263M91-F259 HydrophobicContact CG-CD1 4.21Å; M91-F259 HydrophobicContact CG-CE1 3.91Å; M91-F259 HydrophobicContact SD-CE1 4.35Å; T236-F259 HydrophobicContact CG2-CE1 4.39Å; T239-F259 WeakPolarHBondContact OG1-CE2 3.34Å; T239-F259 WeakPolarHBondContact OG1-CZ 3.26Å; T240-F259 HydrophobicContact CG2-CE2 3.47Å; T240-F259 VanDerWaalsContact CG2-CE2 3.47Å; T240-F259 HydrophobicContact CG2-CZ 3.6Å; Y255-F259 HydrophobicContact CD1-CB 4.35Å; Y255-F259 HydrophobicContact CE1-CB 4.07Å; Y255-F259 HydrophobicContact CE1-CD2 4.39Å; Y255-F259 HydrophobicContact CE1-CG 4.23Å; Y255-F259 WeakPolarHBondContact O-CB 3.34Å; Y255-F259 PolarHBondContact O-N 3.01Å; T256-F259 PolarHBondContact O-N 3Å; F259-T261 PolarHBondContact O-N 3.45Å; F259-K262 PolarHBondContact O-N 2.7Å; F259-T263 HydrophobicContact CD1-CG2 3.95Å; F259-T263 HydrophobicContact CE1-CG2 3.71Å; F259-T263 HydrophobicContact CE2-CG2 4.3Å; F259-T263 HydrophobicContact CG-CG2 4.34Å; F259-T263 HydrophobicContact CZ-CG2 3.9Å; F259-T263 WeakPolarHBondContact O-CG2 3.41Å; F259-T263 PolarHBondContact O-N 2.9Å
260V94.9Very high93.4Very high63 Ų6359.2 Ų59.238%0.38232%0.317SS..Hα-helixtrans-63.5-38.8180170.90000112.2T256 K262 T263 L264T256-V260 VanDerWaalsContact O-CB 3.31Å; T256-V260 WeakPolarHBondContact O-CB 3.27Å; T256-V260 WeakPolarHBondContact O-CG2 3.14Å; T256-V260 PolarHBondContact O-N 3.05Å; V260-K262 PolarHBondContact O-N 3.31Å; V260-T263 WeakPolarHBondContact CA-OG1 3.25Å; V260-T263 PolarHBondContact O-N 3.16Å; V260-T263 PolarHBondContact O-OG1 3.35Å; V260-L264 HydrophobicContact CG1-CD1 3.88Å; V260-L264 HydrophobicContact CG1-CG 4.24Å; V260-L264 WeakPolarHBondContact O-CB 3.25Å; V260-L264 VanDerWaalsContact O-CG 3.24Å; V260-L264 WeakPolarHBondContact O-CG 3.33Å; V260-L264 PolarHBondContact O-N 3.42Å
261T95.2Very high93.6Very high82 Ų8252 Ų5250%0.50328%0.279SS..Hα-helixtrans-65-40.1176.850.40000112T257 Y258 F259 L265T257-T261 VanDerWaalsContact O-CG2 3.29Å; T257-T261 WeakPolarHBondContact O-CG2 3.41Å; T257-T261 PolarHBondContact O-N 2.93Å; T257-T261 PolarHBondContact O-OG1 2.89Å; Y258-T261 WeakPolarHBondContact CA-OG1 3.22Å; Y258-T261 PolarHBondContact O-N 3.48Å; Y258-T261 PolarHBondContact O-OG1 3.36Å; F259-T261 PolarHBondContact O-N 3.45Å; T261-L265 PolarHBondContact O-N 3.1Å
262K96Very high93.7Very high41 Ų4157.3 Ų57.318%0.17830%0.295CS..Hα-helixtrans-65.4-42173.2-68.9179.7-175.6-170.40112T239 L243 G244 T245 Y258 F259 V260 L264 L265 L266T239-K262 HydrophobicContact CG2-CB 3.98Å; L243-K262 HydrophobicContact CB-CD 4.15Å; L243-K262 VanDerWaalsContact O-CD 3.29Å; L243-K262 WeakPolarHBondContact O-CD 3.35Å; L243-K262 PolarHBondContact O-NZ 3.15Å; G244-K262 PolarHBondContact O-NZ 3.25Å; T245-K262 HydrophobicContact CG2-CD 3.99Å; Y258-K262 WeakPolarHBondContact O-CG 3.42Å; Y258-K262 PolarHBondContact O-N 3.28Å; Y258-K262 VanDerWaalsContact O-N 3.11Å; F259-K262 PolarHBondContact O-N 2.7Å; V260-K262 PolarHBondContact O-N 3.31Å; K262-L264 VanDerWaalsContact C-N 3.35Å; K262-L264 PolarHBondContact O-N 3.1Å; K262-L265 PolarHBondContact O-N 2.97Å; K262-L266 PolarHBondContact O-N 3.45Å
263T95.9Very high93.9Very high7 Ų756.3 Ų56.34%0.04329%0.287CS..Hα-helixtrans-63.5-43.5178.572.20000110.7T236 T239 F259 V260 L265 L266 T267T236-T263 HydrophobicContact CG2-CG2 3.82Å; T239-T263 HydrophobicContact CG2-CG2 3.84Å; T239-T263 VanDerWaalsContact OG1-CG2 3.23Å; T239-T263 WeakPolarHBondContact OG1-CG2 3.46Å; F259-T263 HydrophobicContact CD1-CG2 3.95Å; F259-T263 HydrophobicContact CE1-CG2 3.71Å; F259-T263 HydrophobicContact CE2-CG2 4.3Å; F259-T263 HydrophobicContact CG-CG2 4.34Å; F259-T263 HydrophobicContact CZ-CG2 3.9Å; F259-T263 WeakPolarHBondContact O-CG2 3.41Å; F259-T263 PolarHBondContact O-N 2.9Å; V260-T263 WeakPolarHBondContact CA-OG1 3.25Å; V260-T263 PolarHBondContact O-N 3.16Å; V260-T263 PolarHBondContact O-OG1 3.35Å; T263-L265 VanDerWaalsContact C-N 3.33Å; T263-L265 PolarHBondContact O-N 3.34Å; T263-L266 PolarHBondContact O-N 3.13Å; T263-T267 WeakPolarHBondContact O-CG2 3.36Å; T263-T267 PolarHBondContact O-N 3.18Å; T263-T267 PolarHBondContact O-OG1 3.5Å
264L95.4Very high93.8Very high103 Ų10353.5 Ų53.554%0.53927%0.271SS..Hα-helixtrans-61.7-40.6176.5-73.2172.5000111.7V260 K262 T267 S268V260-L264 HydrophobicContact CG1-CD1 3.88Å; V260-L264 HydrophobicContact CG1-CG 4.24Å; V260-L264 WeakPolarHBondContact O-CB 3.25Å; V260-L264 VanDerWaalsContact O-CG 3.24Å; V260-L264 WeakPolarHBondContact O-CG 3.33Å; V260-L264 PolarHBondContact O-N 3.42Å; K262-L264 VanDerWaalsContact C-N 3.35Å; K262-L264 PolarHBondContact O-N 3.1Å; L264-T267 WeakPolarHBondContact CA-OG1 3.45Å; L264-T267 PolarHBondContact O-N 3.26Å; L264-T267 PolarHBondContact O-OG1 3Å; L264-S268 PolarHBondContact O-N 3.46Å
265L95.9Very high93.6Very high107 Ų10751.5 Ų51.556%0.5626%0.263SS*.Hα-helixtrans-60.5-47.4175.1-169.8157000111.1T261 K262 T263 T267 S268 L269T261-L265 PolarHBondContact O-N 3.1Å; K262-L265 PolarHBondContact O-N 2.97Å; T263-L265 VanDerWaalsContact C-N 3.33Å; T263-L265 PolarHBondContact O-N 3.34Å; L265-T267 PolarHBondContact O-N 3.39Å; L265-S268 PolarHBondContact O-N 2.92Å; L265-S268 VanDerWaalsContact O-N 3.16Å; L265-S268 PolarHBondContact O-OG 2.88Å; L265-L269 PolarHBondContact O-N 2.98Å
266L95.6Very high93.5Very high21 Ų2154 Ų5411%0.1128%0.284CS..Hα-helixtrans-64-39.9176.7-70.1-176.6000112.7F186 N235 T238 T239 L243 K262 T263 S268 L269 F270F186-L266 HydrophobicContact CE2-CD2 4.29Å; N235-L266 HydrophobicContact CB-CB 4.32Å; T238-L266 WeakPolarHBondContact OG1-CD1 3.36Å; T239-L266 HydrophobicContact CG2-CD1 3.5Å; T239-L266 HydrophobicContact CG2-CG 4.34Å; L243-L266 HydrophobicContact CD1-CD1 4.18Å; K262-L266 PolarHBondContact O-N 3.45Å; T263-L266 PolarHBondContact O-N 3.13Å; L266-S268 VanDerWaalsContact C-N 3.29Å; L266-S268 PolarHBondContact O-N 2.59Å; L266-L269 WeakPolarHBondContact O-CA 3.46Å; L266-L269 WeakPolarHBondContact O-CB 3.23Å; L266-L269 PolarHBondContact O-N 2.84Å; L266-L269 VanDerWaalsContact O-N 3.08Å; L266-F270 PolarHBondContact O-N 3.01Å
267T94.5Very high93.3Very high11 Ų1158.6 Ų58.67%0.06730%0.297CS..Hα-helixtrans-62.3-37173.361.30000111.9L20 N235 T263 L264 L265 L269 F270 L271L20-T267 HydrophobicContact CD1-CG2 4.39Å; N235-T267 HydrophobicContact CB-CG2 3.74Å; T263-T267 WeakPolarHBondContact O-CG2 3.36Å; T263-T267 PolarHBondContact O-N 3.18Å; T263-T267 PolarHBondContact O-OG1 3.5Å; L264-T267 WeakPolarHBondContact CA-OG1 3.45Å; L264-T267 PolarHBondContact O-N 3.26Å; L264-T267 PolarHBondContact O-OG1 3Å; L265-T267 PolarHBondContact O-N 3.39Å; T267-L269 VanDerWaalsContact C-N 3.27Å; T267-L269 PolarHBondContact O-N 3.48Å; T267-F270 WeakPolarHBondContact O-CB 3.05Å; T267-F270 PolarHBondContact O-N 3.45Å; T267-L271 WeakPolarHBondContact O-CG 3.4Å; T267-L271 PolarHBondContact O-N 3.22Å; T267-L271 VanDerWaalsContact O-N 3.1Å
268S92.8Very high93.1Very high51 Ų5160.1 Ų60.136%0.35731%0.309SS..Hα-helixtrans-67.1-31.9175.2780000111.9L264 L265 L266 L271 W272L264-S268 PolarHBondContact O-N 3.46Å; L265-S268 PolarHBondContact O-N 2.92Å; L265-S268 VanDerWaalsContact O-N 3.16Å; L265-S268 PolarHBondContact O-OG 2.88Å; L266-S268 VanDerWaalsContact C-N 3.29Å; L266-S268 PolarHBondContact O-N 2.59Å; S268-L271 PolarHBondContact O-N 2.92Å; S268-W272 WeakPolarHBondContact O-CB 3.18Å; S268-W272 PolarHBondContact O-N 3.43Å
269L94.1Very high92.7Very high53 Ų5357.9 Ų57.928%0.27730%0.299SS..Hα-helixtrans-70-39.5174.8-162.7149000111.4F186 L265 L266 T267 L271 W272 I273F186-L269 HydrophobicContact CE1-CD2 3.52Å; F186-L269 HydrophobicContact CE2-CD2 4.08Å; F186-L269 HydrophobicContact CZ-CD2 3.18Å; F186-L269 HydrophobicContact CZ-CG 4.45Å; L265-L269 PolarHBondContact O-N 2.98Å; L266-L269 WeakPolarHBondContact O-CA 3.46Å; L266-L269 WeakPolarHBondContact O-CB 3.23Å; L266-L269 PolarHBondContact O-N 2.84Å; L266-L269 VanDerWaalsContact O-N 3.08Å; T267-L269 VanDerWaalsContact C-N 3.27Å; T267-L269 PolarHBondContact O-N 3.48Å; L269-L271 VanDerWaalsContact C-N 3.33Å; L269-L271 PolarHBondContact O-N 3.15Å; L269-W272 HydrophobicContact CG-CE3 4.42Å; L269-W272 PolarHBondContact O-N 2.73Å; L269-I273 HydrophobicContact CD2-CD1 3.47Å; L269-I273 VanDerWaalsContact CD2-CD1 3.47Å; L269-I273 HydrophobicContact CD2-CG1 4.13Å; L269-I273 WeakPolarHBondContact O-CG1 3.43Å; L269-I273 PolarHBondContact O-N 3.44Å
270F92.6Very high92.3Very high9 Ų961.3 Ų61.34%0.03931%0.314CS..Hα-helixtrans-54.7-48.5168.9-95.749.1000111.4F186 L190 I231 N235 L266 T267 W272 I273 R274F186-F270 HydrophobicContact CD2-CE1 4.03Å; F186-F270 HydrophobicContact CE1-CD1 4.44Å; F186-F270 HydrophobicContact CE1-CE1 4.29Å; F186-F270 AromaticContact CE2-CD1 3.61Å; F186-F270 HydrophobicContact CE2-CD1 3.61Å; F186-F270 AromaticContact CE2-CE1 3.29Å; F186-F270 HydrophobicContact CE2-CE1 3.29Å; F186-F270 AromaticContact CZ-CD1 3.4Å; F186-F270 HydrophobicContact CZ-CD1 3.4Å; F186-F270 VanDerWaalsContact CZ-CD1 3.4Å; F186-F270 AromaticContact CZ-CE1 3.41Å; F186-F270 HydrophobicContact CZ-CE1 3.41Å; F186-F270 VanDerWaalsContact CZ-CE1 3.41Å; L190-F270 HydrophobicContact CD2-CB 4.47Å; L190-F270 HydrophobicContact CD2-CD1 3.88Å; L190-F270 HydrophobicContact CD2-CD2 3.66Å; L190-F270 HydrophobicContact CD2-CE1 3.92Å; L190-F270 HydrophobicContact CD2-CE2 3.74Å; L190-F270 HydrophobicContact CD2-CG 3.73Å; L190-F270 HydrophobicContact CD2-CZ 3.85Å; L190-F270 HydrophobicContact CG-CD1 4.3Å; L190-F270 HydrophobicContact CG-CE1 3.89Å; L190-F270 HydrophobicContact CG-CE2 4.17Å; L190-F270 HydrophobicContact CG-CZ 3.82Å; I231-F270 HydrophobicContact CG2-CD2 3.87Å; I231-F270 HydrophobicContact CG2-CE2 4.39Å; N235-F270 WeakPolarHBondContact OD1-CD1 3.35Å; N235-F270 WeakPolarHBondContact OD1-CE1 3.48Å; L266-F270 PolarHBondContact O-N 3.01Å; T267-F270 WeakPolarHBondContact O-CB 3.05Å; T267-F270 PolarHBondContact O-N 3.45Å; F270-W272 VanDerWaalsContact C-N 3.32Å; F270-W272 PolarHBondContact O-N 3.46Å; F270-I273 PolarHBondContact O-N 3.32Å; F270-R274 PolarHBondContact O-N 2.66Å
271L92.1Very high91.8Very high11 Ų1165.1 Ų65.16%0.05832%0.322CS..Hα-helixtrans-66.2-35.3179.8-64175.2000112.2E24 I27 T267 S268 L269E24-L271 HydrophobicContact CB-CD1 4.2Å; E24-L271 HydrophobicContact CB-CD2 3.68Å; E24-L271 HydrophobicContact CG-CD2 3.67Å; I27-L271 HydrophobicContact CD1-CD1 3.83Å; I27-L271 HydrophobicContact CG2-CB 4.34Å; T267-L271 WeakPolarHBondContact O-CG 3.4Å; T267-L271 PolarHBondContact O-N 3.22Å; T267-L271 VanDerWaalsContact O-N 3.1Å; S268-L271 PolarHBondContact O-N 2.92Å; L269-L271 VanDerWaalsContact C-N 3.33Å; L269-L271 PolarHBondContact O-N 3.15Å
272W92.6Very high91.3Very high137 Ų13764.3 Ų64.352%0.51931%0.31SS..Hα-helixtrans-66.8-45.9175.1179.343.9000112.2M31 S268 L269 F270 R274 T275 A276M31-W272 HydrophobicContact CE-CB 3.77Å; M31-W272 HydrophobicContact CE-CG 3.8Å; M31-W272 HydrophobicContact SD-CB 4.49Å; S268-W272 WeakPolarHBondContact O-CB 3.18Å; S268-W272 PolarHBondContact O-N 3.43Å; L269-W272 HydrophobicContact CG-CE3 4.42Å; L269-W272 PolarHBondContact O-N 2.73Å; F270-W272 VanDerWaalsContact C-N 3.32Å; F270-W272 PolarHBondContact O-N 3.46Å; W272-R274 PolarHBondContact O-N 3.14Å; W272-T275 PolarHBondContact O-N 3Å; W272-T275 PolarHBondContact O-OG1 3.42Å; W272-A276 PolarHBondContact O-N 2.91Å; W272-A276 VanDerWaalsContact O-N 3.16Å
273I92.4Very high90.9Very high19 Ų1966.3 Ų66.310%0.09732%0.323CS..Hα-helixtrans-56.5-40.8178-74.9174.8000111.2F186 L190 L269 F270 T275 A276 Y277F186-I273 HydrophobicContact CE1-CD1 3.46Å; F186-I273 VanDerWaalsContact CE1-CD1 3.46Å; F186-I273 HydrophobicContact CZ-CD1 4.03Å; L190-I273 HydrophobicContact CD1-CD1 3.83Å; L190-I273 HydrophobicContact CD1-CG2 4.21Å; L269-I273 HydrophobicContact CD2-CD1 3.47Å; L269-I273 VanDerWaalsContact CD2-CD1 3.47Å; L269-I273 HydrophobicContact CD2-CG1 4.13Å; L269-I273 WeakPolarHBondContact O-CG1 3.43Å; L269-I273 PolarHBondContact O-N 3.44Å; F270-I273 PolarHBondContact O-N 3.32Å; I273-T275 PolarHBondContact O-N 3.18Å; I273-A276 PolarHBondContact O-N 3.5Å; I273-A276 VanDerWaalsContact O-N 3.12Å; I273-Y277 HydrophobicContact CB-CD2 4.39Å; I273-Y277 HydrophobicContact CG1-CE2 4.34Å; I273-Y277 HydrophobicContact CG2-CD2 3.86Å; I273-Y277 HydrophobicContact CG2-CE2 4.39Å; I273-Y277 PolarHBondContact O-N 3.41Å
274R88.8Confident90.6Very high66 Ų6670.7 Ų70.725%0.24934%0.343CS..Hα-helixtrans-55.6-35.2174165.8165.4-167.2163.712.6113.3E24 L28 T196 F270 W272E24-R274 WeakPolarHBondContact OE1-CD 3.5Å; E24-R274 IonicContact OE1-CZ 3.22Å; E24-R274 IonicContact OE1-NE 2.85Å; E24-R274 IonicContact OE1-NH1 3.02Å; E24-R274 PolarHBondContact OE1-NH1 2.88Å; L28-R274 HydrophobicContact CD2-CG 4.02Å; T196-R274 WeakPolarHBondContact OG1-CA 3.36Å; T196-R274 WeakPolarHBondContact OG1-CB 3.38Å; T196-R274 WeakPolarHBondContact OG1-CG 3.43Å; F270-R274 PolarHBondContact O-N 2.66Å; W272-R274 PolarHBondContact O-N 3.14Å
275T88.3Confident90.3Very high45 Ų4565.8 Ų65.828%0.27632%0.317SS..Hα-helixtrans-80.9-26.6177.862.70000114.3L28 M31 W272 I273L28-T275 HydrophobicContact CD2-CG2 3.25Å; L28-T275 HydrophobicContact CG-CG2 4.39Å; M31-T275 HydrophobicContact CB-CG2 3.93Å; M31-T275 HydrophobicContact CG-CG2 4.35Å; M31-T275 HydrophobicContact SD-CG2 3.49Å; M31-T275 WeakPolarHBondContact SD-CG2 3.43Å; M31-T275 PolarHBondContact SD-OG1 2.95Å; W272-T275 PolarHBondContact O-N 3Å; W272-T275 PolarHBondContact O-OG1 3.42Å; I273-T275 PolarHBondContact O-N 3.18Å
276A89.5Confident90.1Very high55 Ų5562.7 Ų62.746%0.45530%0.3SS..Hα-helixtrans-90.5-33.9-167.600000112.9W272 I273W272-A276 PolarHBondContact O-N 2.91Å; W272-A276 VanDerWaalsContact O-N 3.16Å; I273-A276 PolarHBondContact O-N 3.5Å; I273-A276 VanDerWaalsContact O-N 3.12Å
277Y90.1Very high89.9Confident141 Ų14165.7 Ų65.755%0.55331%0.313SS*.SBendtrans-109.9142.9-168.9-66.6-74.3000113.8I273I273-Y277 HydrophobicContact CB-CD2 4.39Å; I273-Y277 HydrophobicContact CG1-CE2 4.34Å; I273-Y277 HydrophobicContact CG2-CD2 3.86Å; I273-Y277 HydrophobicContact CG2-CE2 4.39Å; I273-Y277 PolarHBondContact O-N 3.41Å
278P87.8Confident89.9Confident105 Ų10566.8 Ų66.868%0.68232%0.318SS*.PPolyproline II helixtrans-71.9159.7169.632.1-34.6000111.2P197P197-P278 WeakPolarHBondContact CB-O 3.23Å
279R87Confident89.8Confident86 Ų8664.4 Ų64.433%0.32530%0.302SS..PPolyproline II helixtrans-65141175.1-69.1-177.8173148.6-0.7111.1T196 P197 D199 E204T196-R279 HydrophobicContact CG2-CG 4.23Å; P197-R279 WeakPolarHBondContact O-CA 3.46Å; D199-R279 IonicContact OD2-CZ 2.63Å; D199-R279 IonicContact OD2-NE 3.37Å; D199-R279 IonicContact OD2-NH2 3.6Å; D199-R279 PolarHBondContact OD2-NH2 2.92Å; E204-R279 IonicContact OE2-CZ 3.42Å; E204-R279 IonicContact OE2-NH1 2.77Å; E204-R279 IonicContact OE2-NH2 3.55Å; E204-R279 PolarHBondContact OE2-NH2 3.21Å; E204-R279 VanDerWaalsContact OE2-NH2 3.12Å
280F85.8Confident89.8Confident75 Ų7567.7 Ų67.733%0.32931%0.31SS..PPolyproline II helixtrans-77.9151.1169.9-82.4-80.8000111P197 F198 L200 Q284P197-F280 HydrophobicContact CB-CD2 3.67Å; P197-F280 HydrophobicContact CB-CE2 3.95Å; P197-F280 HydrophobicContact CG-CD2 3.85Å; P197-F280 HydrophobicContact CG-CE2 3.8Å; P197-F280 PolarHBondContact O-N 2.84Å; F198-F280 HydrophobicContact CD1-CB 4.37Å; F198-F280 AromaticContact CD1-CD2 3.76Å; F198-F280 HydrophobicContact CD1-CD2 3.76Å; F198-F280 HydrophobicContact CD1-CE2 4.5Å; F198-F280 HydrophobicContact CD1-CG 4.32Å; F198-F280 AromaticContact CE1-CD2 3.35Å; F198-F280 HydrophobicContact CE1-CD2 3.35Å; F198-F280 AromaticContact CE1-CE2 3.7Å; F198-F280 HydrophobicContact CE1-CE2 3.7Å; F198-F280 HydrophobicContact CE1-CG 4.03Å; F198-F280 HydrophobicContact CZ-CD2 4.06Å; F198-F280 AromaticContact CZ-CE2 3.98Å; F198-F280 HydrophobicContact CZ-CE2 3.98Å; L200-F280 VanDerWaalsContact CD2-O 3.27Å; L200-F280 WeakPolarHBondContact CD2-O 3.44Å; F280-Q284 HydrophobicContact CD1-CB 4.01Å
281R86.1Confident89.9Confident142 Ų14273.7 Ų73.754%0.53634%0.337SS..PPolyproline II helixtrans-76.6147.6163.8-164.6174.183.9-156.24.4109.9D283 Q284 L285R281-D283 VanDerWaalsContact C-N 3.29Å; R281-D283 IonicContact CZ-OD2 3.16Å; R281-D283 IonicContact NE-OD2 2.84Å; R281-D283 PolarHBondContact NE-OD2 3.5Å; R281-D283 IonicContact NH2-OD2 2.73Å; R281-D283 PolarHBondContact NH2-OD2 2.88Å; R281-D283 PolarHBondContact O-N 3.48Å; R281-Q284 HydrophobicContact CB-CG 4.19Å; R281-Q284 WeakPolarHBondContact O-CB 3.47Å; R281-Q284 PolarHBondContact O-N 3.34Å; R281-L285 PolarHBondContact O-N 3.28Å
282Y84.6Confident90Very high65 Ų6577 Ų7726%0.25536%0.355SS..Hα-helixtrans-47.2-46.9175.4176.5-93.8000113.5R134 A137 L200 Q284 L285 M286R134-Y282 HydrophobicContact CG-CD2 4.37Å; A137-Y282 HydrophobicContact CB-CE2 4.07Å; A137-Y282 WeakPolarHBondContact CB-OH 3.39Å; L200-Y282 HydrophobicContact CD1-CD2 3.87Å; L200-Y282 HydrophobicContact CD1-CG 4.42Å; Y282-Q284 VanDerWaalsContact C-N 3.32Å; Y282-Q284 PolarHBondContact O-N 2.7Å; Y282-L285 WeakPolarHBondContact O-CB 3.28Å; Y282-L285 PolarHBondContact O-N 3.03Å; Y282-M286 HydrophobicContact CD1-CG 4.36Å; Y282-M286 HydrophobicContact CE1-CG 3.9Å; Y282-M286 HydrophobicContact CE2-CG 4.23Å; Y282-M286 HydrophobicContact CE2-SD 4.44Å; Y282-M286 WeakPolarHBondContact O-CG 3.47Å; Y282-M286 PolarHBondContact O-N 3.14Å
283D87.1Confident90.1Very high84 Ų8471.4 Ų71.445%0.44933%0.334SS..Hα-helixtrans-65.4-35-179.4-47.8-33.2000113.1R281 L285 M286 H287R281-D283 VanDerWaalsContact C-N 3.29Å; R281-D283 IonicContact CZ-OD2 3.16Å; R281-D283 IonicContact NE-OD2 2.84Å; R281-D283 PolarHBondContact NE-OD2 3.5Å; R281-D283 IonicContact NH2-OD2 2.73Å; R281-D283 PolarHBondContact NH2-OD2 2.88Å; R281-D283 PolarHBondContact O-N 3.48Å; D283-L285 VanDerWaalsContact C-N 3.35Å; D283-M286 PolarHBondContact O-N 3.48Å; D283-H287 WeakPolarHBondContact O-CB 3.44Å; D283-H287 PolarHBondContact O-N 3.36Å
284Q90.3Very high90.2Very high99 Ų9972 Ų7246%0.46334%0.337SS..Hα-helixtrans-69.8-38.6179.3-66.8172.8-22.600110.5F280 R281 Y282 H287 L288F280-Q284 HydrophobicContact CD1-CB 4.01Å; R281-Q284 HydrophobicContact CB-CG 4.19Å; R281-Q284 WeakPolarHBondContact O-CB 3.47Å; R281-Q284 PolarHBondContact O-N 3.34Å; Y282-Q284 VanDerWaalsContact C-N 3.32Å; Y282-Q284 PolarHBondContact O-N 2.7Å; Q284-H287 PolarHBondContact O-N 2.66Å; Q284-L288 WeakPolarHBondContact O-CB 3.32Å; Q284-L288 PolarHBondContact O-N 3.04Å
285L88.8Confident90.5Very high0 Ų072.1 Ų72.10%035%0.346CS..Hα-helixtrans-59.8-50.2173.1-178.2154.9000110.7Q138 Y142 F198 L200 R281 Y282 D283 H287 L288 L289Q138-L285 HydrophobicContact CG-CD1 4.2Å; Q138-L285 HydrophobicContact CG-CD2 4.44Å; Y142-L285 HydrophobicContact CE2-CD1 3.84Å; Y142-L285 HydrophobicContact CE2-CD2 3.58Å; Y142-L285 HydrophobicContact CE2-CG 3.94Å; Y142-L285 WeakPolarHBondContact OH-CD1 3.39Å; Y142-L285 WeakPolarHBondContact OH-CG 3.37Å; F198-L285 HydrophobicContact CB-CD1 3.96Å; F198-L285 HydrophobicContact CD1-CD1 3.61Å; F198-L285 HydrophobicContact CD1-CG 4.16Å; F198-L285 HydrophobicContact CG-CD1 4.15Å; L200-L285 HydrophobicContact CD1-CB 4.26Å; L200-L285 HydrophobicContact CD1-CD1 3.51Å; L200-L285 HydrophobicContact CD1-CG 4.36Å; L200-L285 HydrophobicContact CG-CD1 4.3Å; R281-L285 PolarHBondContact O-N 3.28Å; Y282-L285 WeakPolarHBondContact O-CB 3.28Å; Y282-L285 PolarHBondContact O-N 3.03Å; D283-L285 VanDerWaalsContact C-N 3.35Å; L285-H287 VanDerWaalsContact C-N 3.29Å; L285-H287 PolarHBondContact O-N 2.92Å; L285-L288 WeakPolarHBondContact O-CB 3.43Å; L285-L288 PolarHBondContact O-N 3.49Å; L285-L289 HydrophobicContact CD2-CD1 3.98Å; L285-L289 PolarHBondContact O-N 2.9Å; L285-L289 VanDerWaalsContact O-N 3.11Å
286M90.6Very high90.9Very high42 Ų4274.1 Ų74.121%0.20736%0.355CS..Hα-helixtrans-62.6-38.7178.5-65.5-60.1-8100111.5Y282 D283 L289 W290Y282-M286 HydrophobicContact CD1-CG 4.36Å; Y282-M286 HydrophobicContact CE1-CG 3.9Å; Y282-M286 HydrophobicContact CE2-CG 4.23Å; Y282-M286 HydrophobicContact CE2-SD 4.44Å; Y282-M286 WeakPolarHBondContact O-CG 3.47Å; Y282-M286 PolarHBondContact O-N 3.14Å; D283-M286 PolarHBondContact O-N 3.48Å; M286-L289 PolarHBondContact O-N 2.81Å; M286-W290 WeakPolarHBondContact O-CB 3.43Å; M286-W290 VanDerWaalsContact O-CD1 3.25Å; M286-W290 PolarHBondContact O-N 2.88Å
287H93.1Very high91.2Very high83 Ų8371.5 Ų71.538%0.38433%0.333SS..Hα-helixtrans-64.1-42.4174.8-170.6-63.3000112.4D283 Q284 L285 L289 K291 N292D283-H287 WeakPolarHBondContact O-CB 3.44Å; D283-H287 PolarHBondContact O-N 3.36Å; Q284-H287 PolarHBondContact O-N 2.66Å; L285-H287 VanDerWaalsContact C-N 3.29Å; L285-H287 PolarHBondContact O-N 2.92Å; H287-L289 VanDerWaalsContact C-N 3.32Å; H287-L289 PolarHBondContact O-N 3.29Å; H287-K291 WeakPolarHBondContact NE2-CD 3.12Å; H287-K291 WeakPolarHBondContact O-CB 3.32Å; H287-K291 PolarHBondContact O-N 3.06Å; H287-N292 PolarHBondContact O-N 3.49Å
288L93.2Very high91.5Very high34 Ų3468.5 Ų68.518%0.17833%0.326CS..Iπ-helixtrans-56.3-50177.5-178.279.2000110.2I187 F198 Q284 L285 N292 F293I187-L288 HydrophobicContact CG2-CD2 4.27Å; F198-L288 HydrophobicContact CE1-CD2 4.07Å; F198-L288 HydrophobicContact CZ-CD2 4.05Å; Q284-L288 WeakPolarHBondContact O-CB 3.32Å; Q284-L288 PolarHBondContact O-N 3.04Å; L285-L288 WeakPolarHBondContact O-CB 3.43Å; L285-L288 PolarHBondContact O-N 3.49Å; L288-N292 WeakPolarHBondContact O-CA 3.32Å; L288-N292 WeakPolarHBondContact O-CB 3.04Å; L288-N292 PolarHBondContact O-N 3.07Å; L288-N292 VanDerWaalsContact O-N 3.13Å; L288-F293 HydrophobicContact CD1-CE1 4.14Å; L288-F293 HydrophobicContact CD1-CZ 4.34Å; L288-F293 HydrophobicContact CD2-CE2 4.17Å; L288-F293 HydrophobicContact CD2-CZ 4.04Å; L288-F293 HydrophobicContact CG-CE1 4.21Å; L288-F293 HydrophobicContact CG-CE2 4.39Å; L288-F293 HydrophobicContact CG-CZ 4.13Å; L288-F293 PolarHBondContact O-N 2.93Å
289L91.8Very high91.9Very high1 Ų166.3 Ų66.31%0.00532%0.317CS..Iπ-helixtrans-70.2-54.9-177.1-78.3173.7000113.5S141 Y142 T145 L285 M286 H287 F293 L294S141-L289 VanDerWaalsContact CB-CD1 3.48Å; S141-L289 WeakPolarHBondContact OG-CD1 3.36Å; Y142-L289 HydrophobicContact CD1-CD1 3.53Å; Y142-L289 HydrophobicContact CD1-CD2 3.14Å; Y142-L289 HydrophobicContact CD1-CG 3.73Å; Y142-L289 HydrophobicContact CD2-CD1 3.66Å; Y142-L289 HydrophobicContact CE1-CD1 3.42Å; Y142-L289 VanDerWaalsContact CE1-CD1 3.42Å; Y142-L289 HydrophobicContact CE1-CD2 3.12Å; Y142-L289 HydrophobicContact CE1-CG 3.37Å; Y142-L289 HydrophobicContact CE2-CD1 3.53Å; Y142-L289 HydrophobicContact CE2-CG 4.34Å; Y142-L289 HydrophobicContact CG-CD1 3.63Å; Y142-L289 HydrophobicContact CG-CD2 4.03Å; Y142-L289 HydrophobicContact CG-CG 4.34Å; T145-L289 HydrophobicContact CG2-CD2 4.06Å; L285-L289 HydrophobicContact CD2-CD1 3.98Å; L285-L289 PolarHBondContact O-N 2.9Å; L285-L289 VanDerWaalsContact O-N 3.11Å; M286-L289 PolarHBondContact O-N 2.81Å; H287-L289 VanDerWaalsContact C-N 3.32Å; H287-L289 PolarHBondContact O-N 3.29Å; L289-F293 HydrophobicContact CD2-CB 4.45Å; L289-F293 HydrophobicContact CD2-CD2 3.72Å; L289-F293 HydrophobicContact CD2-CE2 4.47Å; L289-F293 HydrophobicContact CD2-CG 4.48Å; L289-F293 PolarHBondContact O-N 2.87Å; L289-L294 WeakPolarHBondContact O-CB 3.35Å; L289-L294 PolarHBondContact O-N 3.45Å
290W94.2Very high92.3Very high122 Ų12263.4 Ų63.446%0.46231%0.308SS..Iπ-helixtrans-75.7-34.4-169.9-74.993.7000112.7M286 L294M286-W290 WeakPolarHBondContact O-CB 3.43Å; M286-W290 VanDerWaalsContact O-CD1 3.25Å; M286-W290 PolarHBondContact O-N 2.88Å; W290-L294 HydrophobicContact CE3-CD2 3.89Å; W290-L294 HydrophobicContact CZ3-CD2 4.13Å
291K93.4Very high92.9Very high136 Ų13661.4 Ų61.459%0.59130%0.3SS*.Iπ-helixtrans-102.9-25.7-175.3-55.8-161.9-161.2166.80114H287 P295H287-K291 WeakPolarHBondContact NE2-CD 3.12Å; H287-K291 WeakPolarHBondContact O-CB 3.32Å; H287-K291 PolarHBondContact O-N 3.06Å; K291-P295 WeakPolarHBondContact O-CG 3.39Å
292N94.3Very high93.3Very high81 Ų8160.9 Ų60.943%0.43331%0.306SS..Iπ-helixtrans-103.3-56.9179.6-53.2-7.7000111.3H287 L288 L296H287-N292 PolarHBondContact O-N 3.49Å; L288-N292 WeakPolarHBondContact O-CA 3.32Å; L288-N292 WeakPolarHBondContact O-CB 3.04Å; L288-N292 PolarHBondContact O-N 3.07Å; L288-N292 VanDerWaalsContact O-N 3.13Å; N292-L296 WeakPolarHBondContact O-CB 3.4Å; N292-L296 PolarHBondContact O-N 3.3Å
293F94.2Very high93.9Very high18 Ų1864.8 Ų64.88%0.07932%0.32CS..Iπ-helixtrans-72.9-45.6-174.5-71.80.9000112.7T145 M184 I187 L288 L289 L296 T297T145-F293 HydrophobicContact CG2-CB 4.07Å; M184-F293 HydrophobicContact CG-CD1 4.16Å; M184-F293 HydrophobicContact CG-CE1 4.15Å; M184-F293 HydrophobicContact CG-CG 4.48Å; M184-F293 HydrophobicContact CG-CZ 4.46Å; M184-F293 HydrophobicContact SD-CB 4.47Å; M184-F293 HydrophobicContact SD-CD1 4.15Å; M184-F293 HydrophobicContact SD-CG 4.34Å; I187-F293 HydrophobicContact CB-CE2 3.92Å; I187-F293 HydrophobicContact CB-CZ 3.88Å; I187-F293 HydrophobicContact CD1-CZ 3.8Å; I187-F293 HydrophobicContact CG1-CZ 4.45Å; I187-F293 HydrophobicContact CG2-CE2 3.66Å; I187-F293 HydrophobicContact CG2-CZ 3.67Å; L288-F293 HydrophobicContact CD1-CE1 4.14Å; L288-F293 HydrophobicContact CD1-CZ 4.34Å; L288-F293 HydrophobicContact CD2-CE2 4.17Å; L288-F293 HydrophobicContact CD2-CZ 4.04Å; L288-F293 HydrophobicContact CG-CE1 4.21Å; L288-F293 HydrophobicContact CG-CE2 4.39Å; L288-F293 HydrophobicContact CG-CZ 4.13Å; L288-F293 PolarHBondContact O-N 2.93Å; L289-F293 HydrophobicContact CD2-CB 4.45Å; L289-F293 HydrophobicContact CD2-CD2 3.72Å; L289-F293 HydrophobicContact CD2-CE2 4.47Å; L289-F293 HydrophobicContact CD2-CG 4.48Å; L289-F293 PolarHBondContact O-N 2.87Å; F293-L296 PolarHBondContact O-N 3.5Å; F293-T297 WeakPolarHBondContact O-CB 3.38Å; F293-T297 VanDerWaalsContact O-CG2 3.23Å; F293-T297 WeakPolarHBondContact O-CG2 3.49Å; F293-T297 PolarHBondContact O-N 3.01Å; F293-T297 PolarHBondContact O-OG1 2.94Å
294L94.4Very high94.2Very high33 Ų3361 Ų6117%0.17330%0.3CS..Hα-helixtrans-59.4-48.3-176-174.774.7000112.6V144 T145 I148 L289 W290 L296 T297 L298V144-L294 HydrophobicContact CG1-CD1 3.84Å; T145-L294 HydrophobicContact CG2-CB 4.48Å; T145-L294 HydrophobicContact CG2-CD1 4.47Å; I148-L294 HydrophobicContact CD1-CD1 3.82Å; L289-L294 WeakPolarHBondContact O-CB 3.35Å; L289-L294 PolarHBondContact O-N 3.45Å; W290-L294 HydrophobicContact CE3-CD2 3.89Å; W290-L294 HydrophobicContact CZ3-CD2 4.13Å; L294-L296 VanDerWaalsContact C-N 3.33Å; L294-L296 PolarHBondContact O-N 2.79Å; L294-T297 WeakPolarHBondContact CA-OG1 3.32Å; L294-T297 PolarHBondContact O-N 3.18Å; L294-T297 PolarHBondContact O-OG1 3.38Å; L294-L298 HydrophobicContact CG-CD1 4.2Å; L294-L298 WeakPolarHBondContact O-CB 3.31Å; L294-L298 WeakPolarHBondContact O-CG 3.42Å; L294-L298 PolarHBondContact O-N 3.36Å
295P96.4Very high94.5Very high68 Ų6859.5 Ų59.544%0.44230%0.297SS..Hα-helixtrans-63.9-38.3177.3-23.636.7000112.9K291 A299K291-P295 WeakPolarHBondContact O-CG 3.39Å; P295-A299 WeakPolarHBondContact O-CB 3.25Å; P295-A299 PolarHBondContact O-N 2.75Å
296L96.5Very high94.8Very high86 Ų8661.9 Ų61.945%0.4531%0.313SS..Hα-helixtrans-70.2-43.1-179.5-174.662.1000112M184 N292 F293 L294 L298 A299 L300M184-L296 HydrophobicContact CE-CD2 4.18Å; M184-L296 HydrophobicContact CE-CG 4.15Å; M184-L296 HydrophobicContact SD-CB 4.2Å; M184-L296 HydrophobicContact SD-CD2 3.65Å; M184-L296 HydrophobicContact SD-CG 4Å; N292-L296 WeakPolarHBondContact O-CB 3.4Å; N292-L296 PolarHBondContact O-N 3.3Å; F293-L296 PolarHBondContact O-N 3.5Å; L294-L296 VanDerWaalsContact C-N 3.33Å; L294-L296 PolarHBondContact O-N 2.79Å; L296-L298 VanDerWaalsContact C-N 3.33Å; L296-L298 PolarHBondContact O-N 2.88Å; L296-A299 PolarHBondContact O-N 3.4Å; L296-L300 HydrophobicContact CD1-CD1 4.42Å; L296-L300 HydrophobicContact CG-CD1 4.07Å; L296-L300 WeakPolarHBondContact O-CB 3.46Å; L296-L300 VanDerWaalsContact O-CG 3.31Å; L296-L300 WeakPolarHBondContact O-CG 3.47Å; L296-L300 PolarHBondContact O-N 3.22Å
297T95.9Very high94.9Very high0 Ų061.8 Ų61.80%031%0.313CS..Hα-helixtrans-63.5-38.1176.253.80000111.7I149 M184 F293 L294 L300 L301I149-T297 HydrophobicContact CD1-CG2 3.86Å; I149-T297 HydrophobicContact CG1-CG2 3.53Å; M184-T297 HydrophobicContact CE-CG2 3.59Å; M184-T297 HydrophobicContact SD-CG2 3.72Å; F293-T297 WeakPolarHBondContact O-CB 3.38Å; F293-T297 VanDerWaalsContact O-CG2 3.23Å; F293-T297 WeakPolarHBondContact O-CG2 3.49Å; F293-T297 PolarHBondContact O-N 3.01Å; F293-T297 PolarHBondContact O-OG1 2.94Å; L294-T297 WeakPolarHBondContact CA-OG1 3.32Å; L294-T297 PolarHBondContact O-N 3.18Å; L294-T297 PolarHBondContact O-OG1 3.38Å; T297-L300 PolarHBondContact O-N 3.17Å; T297-L301 WeakPolarHBondContact O-CB 3.42Å; T297-L301 PolarHBondContact O-N 3.28Å
298L96Very high94.9Very high78 Ų7858.2 Ų58.241%0.40830%0.297SS..Hα-helixtrans-66.4-43.7173.1-72.9170.2000112.3I148 L294 L296 L300 L301 M302I148-L298 HydrophobicContact CD1-CD2 4.17Å; L294-L298 HydrophobicContact CG-CD1 4.2Å; L294-L298 WeakPolarHBondContact O-CB 3.31Å; L294-L298 WeakPolarHBondContact O-CG 3.42Å; L294-L298 PolarHBondContact O-N 3.36Å; L296-L298 VanDerWaalsContact C-N 3.33Å; L296-L298 PolarHBondContact O-N 2.88Å; L298-L300 VanDerWaalsContact C-N 3.3Å; L298-L300 PolarHBondContact O-N 2.87Å; L298-L301 WeakPolarHBondContact O-CB 3.45Å; L298-L301 PolarHBondContact O-N 2.83Å; L298-M302 WeakPolarHBondContact O-CG 3.42Å; L298-M302 PolarHBondContact O-N 3.06Å; L298-M302 VanDerWaalsContact O-N 3.11Å
299A96.8Very high95Very high60 Ų6061.8 Ų61.850%0.49632%0.316SS..Hα-helixtrans-60.9-42.5175.500000111.3P295 L296 M302 W303P295-A299 WeakPolarHBondContact O-CB 3.25Å; P295-A299 PolarHBondContact O-N 2.75Å; L296-A299 PolarHBondContact O-N 3.4Å; A299-M302 PolarHBondContact O-N 3.15Å; A299-W303 PolarHBondContact O-N 3.12Å; A299-W303 VanDerWaalsContact O-N 3.09Å
300L96Very high95.1Very high25 Ų2567.1 Ų67.113%0.13135%0.348CS..Hα-helixtrans-67.6-38.8176-72168000111.8P180 L181 M184 L296 T297 L298 M302 W303 Y304P180-L300 HydrophobicContact CB-CD1 3.98Å; L181-L300 HydrophobicContact CD2-CB 3.96Å; L181-L300 HydrophobicContact CD2-CD1 3.75Å; L181-L300 HydrophobicContact CD2-CG 4.49Å; L181-L300 HydrophobicContact CG-CD1 4.17Å; M184-L300 HydrophobicContact CE-CD1 3.38Å; L296-L300 HydrophobicContact CD1-CD1 4.42Å; L296-L300 HydrophobicContact CG-CD1 4.07Å; L296-L300 WeakPolarHBondContact O-CB 3.46Å; L296-L300 VanDerWaalsContact O-CG 3.31Å; L296-L300 WeakPolarHBondContact O-CG 3.47Å; L296-L300 PolarHBondContact O-N 3.22Å; T297-L300 PolarHBondContact O-N 3.17Å; L298-L300 VanDerWaalsContact C-N 3.3Å; L298-L300 PolarHBondContact O-N 2.87Å; L300-M302 VanDerWaalsContact C-N 3.3Å; L300-M302 PolarHBondContact O-N 2.98Å; L300-W303 CarbonylContact O-C 3.56Å; L300-W303 WeakPolarHBondContact O-CA 3.32Å; L300-W303 VanDerWaalsContact O-CB 3.32Å; L300-W303 WeakPolarHBondContact O-CB 3.44Å; L300-W303 PolarHBondContact O-N 3.35Å; L300-Y304 HydrophobicContact CB-CD2 4.25Å; L300-Y304 HydrophobicContact CB-CE2 4.11Å; L300-Y304 HydrophobicContact CD2-CE2 4.14Å; L300-Y304 WeakPolarHBondContact O-CD2 3.47Å; L300-Y304 PolarHBondContact O-N 3.09Å
301L96.6Very high95.1Very high32 Ų3264.8 Ų64.817%0.16835%0.347CS..Hα-helixtrans-54.3-49173.3-176.687.4000110.6I148 L151 T297 L298 W303 Y304 V305I148-L301 HydrophobicContact CG2-CB 4.18Å; I148-L301 HydrophobicContact CG2-CD1 4.24Å; L151-L301 HydrophobicContact CB-CD1 4.28Å; L151-L301 HydrophobicContact CD2-CD1 3.78Å; L151-L301 HydrophobicContact CG-CD1 3.97Å; T297-L301 WeakPolarHBondContact O-CB 3.42Å; T297-L301 PolarHBondContact O-N 3.28Å; L298-L301 WeakPolarHBondContact O-CB 3.45Å; L298-L301 PolarHBondContact O-N 2.83Å; L301-W303 VanDerWaalsContact C-N 3.27Å; L301-W303 PolarHBondContact O-N 2.82Å; L301-Y304 PolarHBondContact O-N 2.83Å; L301-V305 VanDerWaalsContact O-CG2 3.3Å; L301-V305 WeakPolarHBondContact O-CG2 3.47Å; L301-V305 PolarHBondContact O-N 3.08Å
302M96.1Very high95.1Very high131 Ų13163.6 Ų63.665%0.64536%0.356SS*.Hα-helixtrans-61.2-37177.6-64.5-59.5-7000112.2L298 A299 L300 S306L298-M302 WeakPolarHBondContact O-CG 3.42Å; L298-M302 PolarHBondContact O-N 3.06Å; L298-M302 VanDerWaalsContact O-N 3.11Å; A299-M302 PolarHBondContact O-N 3.15Å; L300-M302 VanDerWaalsContact C-N 3.3Å; L300-M302 PolarHBondContact O-N 2.98Å; M302-S306 WeakPolarHBondContact O-CB 3.26Å; M302-S306 PolarHBondContact O-N 2.81Å; M302-S306 VanDerWaalsContact O-N 3.08Å; M302-S306 PolarHBondContact O-OG 3.19Å
303W95.4Very high95Very high148 Ų14862.8 Ų62.856%0.56136%0.357SS*.Hα-helixtrans-63.3-49.7172.8177.4-98.6000112.3A299 L300 L301 V305 S306 M307A299-W303 PolarHBondContact O-N 3.12Å; A299-W303 VanDerWaalsContact O-N 3.09Å; L300-W303 CarbonylContact O-C 3.56Å; L300-W303 WeakPolarHBondContact O-CA 3.32Å; L300-W303 VanDerWaalsContact O-CB 3.32Å; L300-W303 WeakPolarHBondContact O-CB 3.44Å; L300-W303 PolarHBondContact O-N 3.35Å; L301-W303 VanDerWaalsContact C-N 3.27Å; L301-W303 PolarHBondContact O-N 2.82Å; W303-V305 VanDerWaalsContact C-N 3.28Å; W303-V305 PolarHBondContact O-N 3.2Å; W303-S306 PolarHBondContact O-N 3.07Å; W303-S306 PolarHBondContact O-OG 3.34Å; W303-S306 VanDerWaalsContact O-OG 3.12Å; W303-M307 HydrophobicContact CZ2-CG 4.33Å; W303-M307 VanDerWaalsContact O-CB 3.26Å; W303-M307 WeakPolarHBondContact O-CB 3.43Å; W303-M307 PolarHBondContact O-N 3.37Å
304Y94.8Very high94.9Very high5 Ų567.6 Ų67.62%0.0238%0.382CS..Hα-helixtrans-71.5-19.4-179.5-72.4-74.1000113.8M156 P177 S178 L181 L300 L301 P308M156-Y304 HydrophobicContact CG-CD1 4.15Å; M156-Y304 HydrophobicContact SD-CD1 3.93Å; M156-Y304 HydrophobicContact SD-CE1 3.74Å; P177-Y304 PolarHBondContact O-OH 3.4Å; P177-Y304 VanDerWaalsContact O-OH 3.06Å; S178-Y304 VanDerWaalsContact CA-OH 3.25Å; S178-Y304 WeakPolarHBondContact CA-OH 3.42Å; L181-Y304 HydrophobicContact CD1-CD2 3.57Å; L181-Y304 HydrophobicContact CD1-CE1 4.45Å; L181-Y304 HydrophobicContact CD1-CE2 3.15Å; L181-Y304 HydrophobicContact CD1-CG 4.43Å; L181-Y304 HydrophobicContact CG-CD2 4.47Å; L181-Y304 HydrophobicContact CG-CE2 3.78Å; L300-Y304 HydrophobicContact CB-CD2 4.25Å; L300-Y304 HydrophobicContact CB-CE2 4.11Å; L300-Y304 HydrophobicContact CD2-CE2 4.14Å; L300-Y304 WeakPolarHBondContact O-CD2 3.47Å; L300-Y304 PolarHBondContact O-N 3.09Å; L301-Y304 PolarHBondContact O-N 2.83Å; Y304-P308 WeakPolarHBondContact O-CD 3.32Å; Y304-P308 WeakPolarHBondContact O-CG 2.99Å
305V95.2Very high94.8Very high66 Ų6667.2 Ų67.240%0.438%0.382SS..Hα-helixtrans-73.9-46.6167.6171.70000110.6L155 L301 W303 I309L155-V305 HydrophobicContact CD1-CB 4.37Å; L155-V305 HydrophobicContact CD1-CG2 3.46Å; L155-V305 VanDerWaalsContact CD1-CG2 3.46Å; L301-V305 VanDerWaalsContact O-CG2 3.3Å; L301-V305 WeakPolarHBondContact O-CG2 3.47Å; L301-V305 PolarHBondContact O-N 3.08Å; W303-V305 VanDerWaalsContact C-N 3.28Å; W303-V305 PolarHBondContact O-N 3.2Å; V305-I309 VanDerWaalsContact O-CD1 3.28Å; V305-I309 WeakPolarHBondContact O-CD1 3.43Å; V305-I309 WeakPolarHBondContact O-CG1 3.3Å
306S95.6Very high94.6Very high50 Ų5068.5 Ų68.535%0.3539%0.39SS..Hα-helixtrans-78.2-37.2-173.954.30000113.6M302 W303 I309 T310M302-S306 WeakPolarHBondContact O-CB 3.26Å; M302-S306 PolarHBondContact O-N 2.81Å; M302-S306 VanDerWaalsContact O-N 3.08Å; M302-S306 PolarHBondContact O-OG 3.19Å; W303-S306 PolarHBondContact O-N 3.07Å; W303-S306 PolarHBondContact O-OG 3.34Å; W303-S306 VanDerWaalsContact O-OG 3.12Å; S306-I309 PolarHBondContact O-N 3.36Å; S306-T310 WeakPolarHBondContact O-CG2 3.28Å; S306-T310 PolarHBondContact O-N 2.86Å; S306-T310 PolarHBondContact O-OG1 2.91Å
307M93.8Very high94.1Very high40 Ų4072.5 Ų72.520%0.19741%0.406CS..Hα-helixtrans-57.8-55.3-174.2-177.1-86.6-85.400112.3W303 I309 T310 T311W303-M307 HydrophobicContact CZ2-CG 4.33Å; W303-M307 VanDerWaalsContact O-CB 3.26Å; W303-M307 WeakPolarHBondContact O-CB 3.43Å; W303-M307 PolarHBondContact O-N 3.37Å; M307-I309 PolarHBondContact O-N 3.11Å; M307-I309 VanDerWaalsContact O-N 3.15Å; M307-T310 PolarHBondContact O-N 3.27Å; M307-T310 PolarHBondContact O-OG1 3.45Å; M307-T311 HydrophobicContact CG-CG2 4.49Å; M307-T311 PolarHBondContact O-N 3.01Å; M307-T311 PolarHBondContact O-OG1 3.34Å; M307-T311 HydrophobicContact SD-CG2 4.44Å
308P92.7Very high93.3Very high8 Ų881.1 Ų81.15%0.05246%0.46CS..Hα-helixtrans-58.9-32-180-23.934.8000113.9Y304 S312 S313 I314Y304-P308 WeakPolarHBondContact O-CD 3.32Å; Y304-P308 WeakPolarHBondContact O-CG 2.99Å; P308-S312 CarbonylContact O-C 3.55Å; P308-S312 WeakPolarHBondContact O-CA 3.49Å; P308-S312 PolarHBondContact O-N 3.19Å; P308-S313 PolarHBondContact O-N 2.99Å; P308-I314 HydrophobicContact CB-CG1 4.24Å
309I94.6Very high93.2Very high110 Ų11081.3 Ų81.356%0.56446%0.462SS*.Hα-helixtrans-69.4-47.9177.2-58.9171.5000109.8V305 S306 M307 S312 I314V305-I309 VanDerWaalsContact O-CD1 3.28Å; V305-I309 WeakPolarHBondContact O-CD1 3.43Å; V305-I309 WeakPolarHBondContact O-CG1 3.3Å; S306-I309 PolarHBondContact O-N 3.36Å; M307-I309 PolarHBondContact O-N 3.11Å; M307-I309 VanDerWaalsContact O-N 3.15Å; I309-S312 PolarHBondContact O-N 3.3Å; I309-I314 HydrophobicContact CG1-CD1 4.3Å
310T95.1Very high93Very high112 Ų11282.4 Ų82.469%0.68746%0.46SS*.Hα-helixtrans-68.6-35.7-178.157.50000113.6S306 M307 S312S306-T310 WeakPolarHBondContact O-CG2 3.28Å; S306-T310 PolarHBondContact O-N 2.86Å; S306-T310 PolarHBondContact O-OG1 2.91Å; M307-T310 PolarHBondContact O-N 3.27Å; M307-T310 PolarHBondContact O-OG1 3.45Å; T310-S312 VanDerWaalsContact C-N 3.3Å
311T93.8Very high92.8Very high73 Ų7385.6 Ų85.645%0.44848%0.479SS..THydrogen-bonded Turntrans-88.93.4178.852.90000112.8M307 S313M307-T311 HydrophobicContact CG-CG2 4.49Å; M307-T311 PolarHBondContact O-N 3.01Å; M307-T311 PolarHBondContact O-OG1 3.34Å; M307-T311 HydrophobicContact SD-CG2 4.44Å; T311-S313 PolarHBondContact O-N 3.16Å; T311-S313 VanDerWaalsContact O-N 3.16Å; T311-S313 PolarHBondContact OG1-OG 3.24Å
312S92.2Very high92.6Very high112 Ų11288.8 Ų88.878%0.78350%0.497SS*.THydrogen-bonded Turntrans5231.5-17461.70000113.7P308 I309 T310P308-S312 CarbonylContact O-C 3.55Å; P308-S312 WeakPolarHBondContact O-CA 3.49Å; P308-S312 PolarHBondContact O-N 3.19Å; I309-S312 PolarHBondContact O-N 3.3Å; T310-S312 VanDerWaalsContact C-N 3.3Å
313S92.4Very high92.4Very high64 Ų6486.1 Ų86.145%0.44849%0.488SS..  trans-110.540.4-176.868.70000111.7P308 T311P308-S313 PolarHBondContact O-N 2.99Å; T311-S313 PolarHBondContact O-N 3.16Å; T311-S313 VanDerWaalsContact O-N 3.16Å; T311-S313 PolarHBondContact OG1-OG 3.24Å
314I93.1Very high92.2Very high119 Ų11982 Ų8261%0.6148%0.483SS*.PPolyproline II helixtrans-67.5123.2175.8-59.4174.7000108P308 I309P308-I314 HydrophobicContact CB-CG1 4.24Å; I309-I314 HydrophobicContact CG1-CD1 4.3Å
315P92.4Very high92Very high24 Ų2487.5 Ų87.516%0.15652%0.516CS..PPolyproline II helixtrans-68.9152.7-179.829.5-36.7000111.7L155 M156L155-P315 WeakPolarHBondContact O-CD 3.45Å; L155-P315 VanDerWaalsContact O-CG 3.25Å; L155-P315 WeakPolarHBondContact O-CG 3.32Å; M156-P315 WeakPolarHBondContact O-CB 3.36Å
316P92Very high91.7Very high95 Ų9589.2 Ų89.262%0.61753%0.525SS*.PPolyproline II helixtrans-67.6151175.730.5-35000111.2
317Q86.1Confident91.4Very high170 Ų17092.4 Ų92.479%0.79454%0.539SS*.  trans-82.8-17.9174.7-69.1-177.3-800113.1
318T78.8Confident91.2Very high182 Ų18297.2 Ų97.2100%1.11757%0.571SS**  trans-130.60-174.956.50000111.1

Retrieved 318 of 318 residues in 543.4 ms (Link to these results)

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