A0A3Q0KRU0_SCHMA Loading...

Reticulon-like protein

AlphaFold DB (A0A5K4EVC2), UniProt , Accession A0A3Q0KRU0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 381 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
1M43.3Very low73.3Confident249 Ų249104.4 Ų104.4100%1.22750%0.5SS*.  0119.80-81.1164.2166.800107.3
2R57.8Low74.1Confident173 Ų17397.5 Ų97.565%0.65347%0.469SS*.  trans-75.6137.2179-177.2174.8-67.8177.50.7108D6R2-D6 HydrophobicContact CG-CB 3.6Å
3S74Confident74.8Confident48 Ų4896.1 Ų96.134%0.33646%0.457SS..  trans-64.2147.5-177.579.10000109.4H5 D6 K7S3-H5 PolarHBondContact O-N 3.48Å; S3-H5 VanDerWaalsContact O-N 3.16Å; S3-D6 WeakPolarHBondContact CB-OD2 3.28Å; S3-D6 PolarHBondContact N-OD2 2.89Å; S3-D6 PolarHBondContact O-N 3.32Å; S3-D6 PolarHBondContact OG-N 3.26Å; S3-D6 PolarHBondContact OG-OD1 3.15Å; S3-D6 PolarHBondContact OG-OD2 3.26Å; S3-K7 PolarHBondContact O-N 3.05Å
4P71.8Confident75.5Confident100 Ų10093.2 Ų93.265%0.64945%0.452SS*.Hα-helixtrans-53.5-35.6176.4-25.833.8000112.1D6 K7 F8P4-D6 PolarHBondContact O-N 2.84Å; P4-K7 PolarHBondContact O-N 2.93Å; P4-F8 WeakPolarHBondContact O-CD2 3.25Å; P4-F8 PolarHBondContact O-N 2.95Å
5H72.9Confident76.1Confident49 Ų4992.6 Ų92.623%0.22746%0.456CS..Hα-helixtrans-59.9-43.9176.7-173.8-93.3000112.6S3 K7 F8 F9 Y122S3-H5 PolarHBondContact O-N 3.48Å; S3-H5 VanDerWaalsContact O-N 3.16Å; H5-K7 VanDerWaalsContact C-N 3.33Å; H5-K7 PolarHBondContact O-N 2.94Å; H5-F8 PolarHBondContact O-N 3.48Å; H5-F9 PolarHBondContact O-N 3.2Å; H5-Y122 AromaticContact CD2-CG 3.76Å
6D79.5Confident76.6Confident65 Ų6587.7 Ų87.735%0.34843%0.432SS..Hα-helixtrans-66.4-37.2-179.7-53.9-36.2000111.5R2 S3 P4 F9 Y10R2-D6 HydrophobicContact CG-CB 3.6Å; S3-D6 WeakPolarHBondContact CB-OD2 3.28Å; S3-D6 PolarHBondContact N-OD2 2.89Å; S3-D6 PolarHBondContact O-N 3.32Å; S3-D6 PolarHBondContact OG-N 3.26Å; S3-D6 PolarHBondContact OG-OD1 3.15Å; S3-D6 PolarHBondContact OG-OD2 3.26Å; P4-D6 PolarHBondContact O-N 2.84Å; D6-F9 WeakPolarHBondContact O-CB 3.34Å; D6-F9 PolarHBondContact O-N 3.13Å; D6-Y10 HydrophobicContact CB-CE2 4.28Å; D6-Y10 WeakPolarHBondContact O-CD2 3.29Å; D6-Y10 PolarHBondContact O-N 2.84Å
7K80Confident76.8Confident135 Ų13585.1 Ų85.159%0.58743%0.425SS*.Hα-helixtrans-62.9-47.6177.6-171.3-175.9174.3-169.30110.8S3 P4 H5 F9 Y10 D11S3-K7 PolarHBondContact O-N 3.05Å; P4-K7 PolarHBondContact O-N 2.93Å; H5-K7 VanDerWaalsContact C-N 3.33Å; H5-K7 PolarHBondContact O-N 2.94Å; K7-F9 VanDerWaalsContact C-N 3.3Å; K7-F9 PolarHBondContact O-N 3.12Å; K7-Y10 PolarHBondContact O-N 3.3Å; K7-D11 PolarHBondContact O-N 3.43Å
8F78.5Confident77.1Confident90 Ų9088.9 Ų88.940%0.39544%0.441SS..Hα-helixtrans-58-42.6174.9-88.3-74.9000112.2P4 H5 D11 V12 L125P4-F8 WeakPolarHBondContact O-CD2 3.25Å; P4-F8 PolarHBondContact O-N 2.95Å; H5-F8 PolarHBondContact O-N 3.48Å; F8-D11 PolarHBondContact O-N 3.17Å; F8-V12 WeakPolarHBondContact O-CB 3.49Å; F8-V12 VanDerWaalsContact O-CG2 3.24Å; F8-V12 WeakPolarHBondContact O-CG2 3.19Å; F8-V12 PolarHBondContact O-N 3.26Å; F8-L125 HydrophobicContact CE2-CD2 4.06Å; F8-L125 HydrophobicContact CZ-CD2 3.97Å
9F82.5Confident77.4Confident39 Ų3991.7 Ų91.717%0.17145%0.446CS..Hα-helixtrans-58.9-48.1176173-94.1000112.1H5 D6 K7 D11 V12 Y13 T111 S114 H115H5-F9 PolarHBondContact O-N 3.2Å; D6-F9 WeakPolarHBondContact O-CB 3.34Å; D6-F9 PolarHBondContact O-N 3.13Å; K7-F9 VanDerWaalsContact C-N 3.3Å; K7-F9 PolarHBondContact O-N 3.12Å; F9-D11 PolarHBondContact O-N 2.94Å; F9-V12 PolarHBondContact O-N 3.17Å; F9-Y13 HydrophobicContact CZ-CD2 4.47Å; F9-Y13 WeakPolarHBondContact O-CB 3.22Å; F9-Y13 PolarHBondContact O-N 3Å; F9-T111 HydrophobicContact CZ-CG2 4.33Å; F9-S114 WeakPolarHBondContact CE2-OG 3.37Å; F9-H115 HydrophobicContact CE2-CB 4.1Å
10Y81.9Confident77.4Confident116 Ų11690.9 Ų90.946%0.45544%0.441SS..Hα-helixtrans-65.2-39.3-179.8-74.4-63.7000112.9D6 K7 Y13 S14D6-Y10 HydrophobicContact CB-CE2 4.28Å; D6-Y10 WeakPolarHBondContact O-CD2 3.29Å; D6-Y10 PolarHBondContact O-N 2.84Å; K7-Y10 PolarHBondContact O-N 3.3Å; Y10-Y13 PolarHBondContact O-N 3.31Å; Y10-S14 WeakPolarHBondContact O-CB 3.23Å; Y10-S14 PolarHBondContact O-N 2.95Å
11D83.8Confident77.3Confident84 Ų8492.5 Ų92.545%0.44945%0.446SS..Hα-helixtrans-63.2-48.1177.6-68.1-18.5000110K7 F8 F9 S14 V15K7-D11 PolarHBondContact O-N 3.43Å; F8-D11 PolarHBondContact O-N 3.17Å; F9-D11 PolarHBondContact O-N 2.94Å; D11-S14 PolarHBondContact O-N 3.07Å; D11-S14 PolarHBondContact O-OG 2.91Å; D11-V15 PolarHBondContact O-N 3.43Å
12V82.9Confident79Confident22 Ų2284.4 Ų84.413%0.13341%0.407CS..Hα-helixtrans-63-45176.91700000111.6F8 F9 S14 V15 I16 I117 L121F8-V12 WeakPolarHBondContact O-CB 3.49Å; F8-V12 VanDerWaalsContact O-CG2 3.24Å; F8-V12 WeakPolarHBondContact O-CG2 3.19Å; F8-V12 PolarHBondContact O-N 3.26Å; F9-V12 PolarHBondContact O-N 3.17Å; V12-S14 VanDerWaalsContact C-N 3.33Å; V12-S14 PolarHBondContact O-N 2.99Å; V12-V15 PolarHBondContact O-N 3.28Å; V12-I16 HydrophobicContact CG1-CD1 3.4Å; V12-I16 VanDerWaalsContact CG1-CD1 3.4Å; V12-I16 HydrophobicContact CG1-CG1 4.36Å; V12-I16 WeakPolarHBondContact O-CB 3.44Å; V12-I16 WeakPolarHBondContact O-CD1 3.26Å; V12-I16 VanDerWaalsContact O-CG1 3.27Å; V12-I16 WeakPolarHBondContact O-CG1 3.1Å; V12-I16 PolarHBondContact O-N 3.39Å; V12-I117 HydrophobicContact CG1-CB 4.16Å; V12-I117 HydrophobicContact CG1-CG2 3.82Å; V12-L121 HydrophobicContact CG2-CD1 3.96Å
13Y83.5Confident80Confident79 Ų7978.3 Ų78.331%0.3139%0.387SS..Hα-helixtrans-61.8-40.3177.2179.8-100.1000111.8F9 Y10 V15 I16 S17F9-Y13 HydrophobicContact CZ-CD2 4.47Å; F9-Y13 WeakPolarHBondContact O-CB 3.22Å; F9-Y13 PolarHBondContact O-N 3Å; Y10-Y13 PolarHBondContact O-N 3.31Å; Y13-V15 VanDerWaalsContact C-N 3.34Å; Y13-V15 PolarHBondContact O-N 2.85Å; Y13-I16 PolarHBondContact O-N 3.25Å; Y13-S17 WeakPolarHBondContact O-CB 3.35Å; Y13-S17 PolarHBondContact O-N 2.68Å; Y13-S17 PolarHBondContact O-OG 3.46Å
14S84.7Confident80.3Confident56 Ų5677 Ų7739%0.39238%0.376SS..Hα-helixtrans-60.8-43.4178.976.20000111.9Y10 D11 V12 S17 Q18Y10-S14 WeakPolarHBondContact O-CB 3.23Å; Y10-S14 PolarHBondContact O-N 2.95Å; D11-S14 PolarHBondContact O-N 3.07Å; D11-S14 PolarHBondContact O-OG 2.91Å; V12-S14 VanDerWaalsContact C-N 3.33Å; V12-S14 PolarHBondContact O-N 2.99Å; S14-S17 PolarHBondContact O-OG 3.03Å; S14-Q18 WeakPolarHBondContact O-CG 3.37Å
15V84.5Confident80.6Confident84 Ų8473.2 Ų73.251%0.50935%0.349SS..Hα-helixtrans-68.4-47.3176.8178.20000110.5D11 V12 Y13 S17 Q18 W19D11-V15 PolarHBondContact O-N 3.43Å; V12-V15 PolarHBondContact O-N 3.28Å; Y13-V15 VanDerWaalsContact C-N 3.34Å; Y13-V15 PolarHBondContact O-N 2.85Å; V15-S17 VanDerWaalsContact C-N 3.34Å; V15-S17 PolarHBondContact O-N 3.44Å; V15-Q18 PolarHBondContact O-N 3.23Å; V15-W19 VanDerWaalsContact O-CD1 3.28Å
16I83.6Confident80.9Confident14 Ų1474.2 Ų74.27%0.07236%0.355CS..Hα-helixtrans-63-40.9-178.6-69.6165.1000111.4V12 Y13 Q18 W19 E20 I23 T110 L113 I117V12-I16 HydrophobicContact CG1-CD1 3.4Å; V12-I16 VanDerWaalsContact CG1-CD1 3.4Å; V12-I16 HydrophobicContact CG1-CG1 4.36Å; V12-I16 WeakPolarHBondContact O-CB 3.44Å; V12-I16 WeakPolarHBondContact O-CD1 3.26Å; V12-I16 VanDerWaalsContact O-CG1 3.27Å; V12-I16 WeakPolarHBondContact O-CG1 3.1Å; V12-I16 PolarHBondContact O-N 3.39Å; Y13-I16 PolarHBondContact O-N 3.25Å; I16-Q18 VanDerWaalsContact C-N 3.26Å; I16-Q18 PolarHBondContact O-N 3.28Å; I16-W19 CarbonylContact O-C 3.51Å; I16-W19 VanDerWaalsContact O-C 3.32Å; I16-W19 WeakPolarHBondContact O-CA 3.25Å; I16-W19 PolarHBondContact O-N 3.2Å; I16-E20 PolarHBondContact O-N 3.43Å; I16-I23 HydrophobicContact CB-CD1 4.48Å; I16-I23 HydrophobicContact CG2-CD1 3.96Å; I16-T110 HydrophobicContact CG2-CG2 4.39Å; I16-L113 HydrophobicContact CD1-CD2 3.69Å; I16-L113 HydrophobicContact CG1-CD2 4.33Å; I16-L113 HydrophobicContact CG2-CD2 4.16Å; I16-I117 HydrophobicContact CD1-CD1 4Å
17S79.8Confident81Confident44 Ų4472.9 Ų72.931%0.30835%0.347SS..Hα-helixtrans-61.2-33.5-178.6690000112.7Y13 S14 V15 W19 E20Y13-S17 WeakPolarHBondContact O-CB 3.35Å; Y13-S17 PolarHBondContact O-N 2.68Å; Y13-S17 PolarHBondContact O-OG 3.46Å; S14-S17 PolarHBondContact O-OG 3.03Å; V15-S17 VanDerWaalsContact C-N 3.34Å; V15-S17 PolarHBondContact O-N 3.44Å; S17-W19 PolarHBondContact O-N 2.82Å; S17-E20 WeakPolarHBondContact O-CB 3.46Å; S17-E20 PolarHBondContact O-N 3.34Å
18Q83.2Confident80.9Confident154 Ų15466.5 Ų66.572%0.7232%0.32SS*.Hα-helixtrans-65.5-30.9174.8-68.6177.3-9.500112.4S14 V15 I16S14-Q18 WeakPolarHBondContact O-CG 3.37Å; V15-Q18 PolarHBondContact O-N 3.23Å; I16-Q18 VanDerWaalsContact C-N 3.26Å; I16-Q18 PolarHBondContact O-N 3.28Å
19W82.4Confident81Confident141 Ų14162.4 Ų62.453%0.53430%0.302SS..THydrogen-bonded Turntrans-103.97.1-178.9-63.297.9000113V15 I16 S17 F21 I22 I23V15-W19 VanDerWaalsContact O-CD1 3.28Å; I16-W19 CarbonylContact O-C 3.51Å; I16-W19 VanDerWaalsContact O-C 3.32Å; I16-W19 WeakPolarHBondContact O-CA 3.25Å; I16-W19 PolarHBondContact O-N 3.2Å; S17-W19 PolarHBondContact O-N 2.82Å; W19-F21 VanDerWaalsContact C-N 3.26Å; W19-F21 PolarHBondContact O-N 2.95Å; W19-F21 VanDerWaalsContact O-N 3.14Å; W19-I22 HydrophobicContact CE3-CB 4.44Å; W19-I22 HydrophobicContact CE3-CD1 3.46Å; W19-I22 VanDerWaalsContact CE3-CD1 3.46Å; W19-I22 HydrophobicContact CE3-CG1 4.49Å; W19-I22 HydrophobicContact CZ3-CD1 3.56Å; W19-I22 PolarHBondContact O-N 3.42Å; W19-I23 HydrophobicContact CB-CD1 3.67Å; W19-I23 HydrophobicContact CB-CG1 4.01Å; W19-I23 WeakPolarHBondContact O-CG1 3.21Å; W19-I23 PolarHBondContact O-N 3.34Å
20E78.3Confident81Confident75 Ų7561.7 Ų61.735%0.3530%0.299SS..Hα-helixtrans-46-51.5-174.5164.1158.2-129.600111.7I16 S17 I22 I23 L24 T110I16-E20 PolarHBondContact O-N 3.43Å; S17-E20 WeakPolarHBondContact O-CB 3.46Å; S17-E20 PolarHBondContact O-N 3.34Å; E20-I22 VanDerWaalsContact C-N 3.31Å; E20-I22 PolarHBondContact O-N 2.85Å; E20-I23 PolarHBondContact O-N 3.49Å; E20-L24 HydrophobicContact CG-CD1 3.79Å; E20-L24 HydrophobicContact CG-CG 4.41Å; E20-L24 WeakPolarHBondContact O-CB 3.13Å; E20-L24 VanDerWaalsContact O-CG 3.31Å; E20-L24 WeakPolarHBondContact O-CG 3.29Å; E20-L24 PolarHBondContact O-N 3.49Å; E20-T110 HydrophobicContact CB-CG2 3.72Å; E20-T110 HydrophobicContact CG-CG2 3.38Å; E20-T110 WeakPolarHBondContact OE1-CB 3.42Å; E20-T110 WeakPolarHBondContact OE1-CG2 3.15Å; E20-T110 PolarHBondContact OE1-OG1 3.48Å
21F74.3Confident81Confident126 Ų12656.3 Ų56.355%0.55328%0.279SS*.Hα-helixtrans-59.8-41.6-178.6-177.9-101.7000112.5W19 R25W19-F21 VanDerWaalsContact C-N 3.26Å; W19-F21 PolarHBondContact O-N 2.95Å; W19-F21 VanDerWaalsContact O-N 3.14Å; F21-R25 VanDerWaalsContact CE1-NH1 3.34Å; F21-R25 VanDerWaalsContact CE2-NH2 3.29Å; F21-R25 WeakPolarHBondContact O-CD 3.26Å; F21-R25 WeakPolarHBondContact O-CG 3.46Å; F21-R25 PolarHBondContact O-N 3.46Å
22I78.3Confident80.7Confident79 Ų7956.4 Ų56.441%0.40527%0.273SS..Hα-helixtrans-74.9-43.3-178.3-69.2165.7000109.9W19 E20 R25 I26W19-I22 HydrophobicContact CE3-CB 4.44Å; W19-I22 HydrophobicContact CE3-CD1 3.46Å; W19-I22 VanDerWaalsContact CE3-CD1 3.46Å; W19-I22 HydrophobicContact CE3-CG1 4.49Å; W19-I22 HydrophobicContact CZ3-CD1 3.56Å; W19-I22 PolarHBondContact O-N 3.42Å; E20-I22 VanDerWaalsContact C-N 3.31Å; E20-I22 PolarHBondContact O-N 2.85Å; I22-R25 PolarHBondContact O-N 2.95Å; I22-I26 HydrophobicContact CG2-CD1 3.56Å; I22-I26 HydrophobicContact CG2-CG1 4.27Å; I22-I26 WeakPolarHBondContact O-CB 3.39Å; I22-I26 VanDerWaalsContact O-CG1 3.3Å; I22-I26 WeakPolarHBondContact O-CG1 3.44Å; I22-I26 PolarHBondContact O-N 3.03Å
23I80.5Confident80.3Confident45 Ų4559.7 Ų59.723%0.23129%0.286CS..Hα-helixtrans-62-51.1-178.3-67.8168.8000110.8I16 W19 E20 R25 I26 Q27 L113I16-I23 HydrophobicContact CB-CD1 4.48Å; I16-I23 HydrophobicContact CG2-CD1 3.96Å; W19-I23 HydrophobicContact CB-CD1 3.67Å; W19-I23 HydrophobicContact CB-CG1 4.01Å; W19-I23 WeakPolarHBondContact O-CG1 3.21Å; W19-I23 PolarHBondContact O-N 3.34Å; E20-I23 PolarHBondContact O-N 3.49Å; I23-R25 PolarHBondContact O-N 3.06Å; I23-I26 PolarHBondContact O-N 2.9Å; I23-Q27 WeakPolarHBondContact O-CB 3.49Å; I23-Q27 PolarHBondContact O-N 2.88Å; I23-L113 HydrophobicContact CG2-CD1 3.83Å
24L78.6Confident79.9Confident20 Ų2061 Ų6111%0.10529%0.291CS..Hα-helixtrans-58.5-38.9-179.6-71175.6000111.3E20 Q27 T28 V98 I107 T110E20-L24 HydrophobicContact CG-CD1 3.79Å; E20-L24 HydrophobicContact CG-CG 4.41Å; E20-L24 WeakPolarHBondContact O-CB 3.13Å; E20-L24 VanDerWaalsContact O-CG 3.31Å; E20-L24 WeakPolarHBondContact O-CG 3.29Å; E20-L24 PolarHBondContact O-N 3.49Å; L24-Q27 WeakPolarHBondContact O-CB 3.45Å; L24-Q27 PolarHBondContact O-N 2.88Å; L24-T28 PolarHBondContact O-N 3.14Å; L24-T28 PolarHBondContact O-OG1 2.88Å; L24-V98 HydrophobicContact CB-CG1 4.23Å; L24-I107 HydrophobicContact CD2-CG2 3.86Å; L24-T110 HydrophobicContact CD1-CG2 4.32Å; L24-T110 HydrophobicContact CD2-CG2 4.3Å; L24-T110 HydrophobicContact CG-CG2 4.18Å
25R78.4Confident79.6Confident20 Ų2062.9 Ų62.98%0.07530%0.3CS..Hα-helixtrans-72.7-42.7-179.7-63.9173.4161.2-136-15.8112.9F21 I22 I23 Q27 T28 I29 F84 F94F21-R25 VanDerWaalsContact CE1-NH1 3.34Å; F21-R25 VanDerWaalsContact CE2-NH2 3.29Å; F21-R25 WeakPolarHBondContact O-CD 3.26Å; F21-R25 WeakPolarHBondContact O-CG 3.46Å; F21-R25 PolarHBondContact O-N 3.46Å; I22-R25 PolarHBondContact O-N 2.95Å; I23-R25 PolarHBondContact O-N 3.06Å; R25-Q27 VanDerWaalsContact C-N 3.26Å; R25-Q27 PolarHBondContact O-N 3.31Å; R25-T28 PolarHBondContact O-N 3.06Å; R25-I29 WeakPolarHBondContact O-CD1 3.32Å; R25-I29 VanDerWaalsContact O-CG1 3.28Å; R25-I29 WeakPolarHBondContact O-CG1 3.25Å; R25-I29 PolarHBondContact O-N 3Å; R25-F84 VanDerWaalsContact NH1-C 3.27Å; R25-F84 PolarHBondContact NH1-O 3.42Å; R25-F84 PolarHBondContact NH2-O 3.02Å; R25-F94 HydrophobicContact CB-CE1 3.64Å; R25-F94 HydrophobicContact CB-CZ 4.11Å; R25-F94 HydrophobicContact CG-CD1 4.15Å; R25-F94 HydrophobicContact CG-CE1 3.55Å; R25-F94 HydrophobicContact CG-CZ 4.48Å; R25-F94 WeakPolarHBondContact O-CZ 3.23Å
26I80.4Confident79.2Confident70 Ų7064 Ų6436%0.35931%0.307SS..Hα-helixtrans-58.8-45.8172.7-71.3172.2000108.7I22 I23 T28 I29 L30 F41I22-I26 HydrophobicContact CG2-CD1 3.56Å; I22-I26 HydrophobicContact CG2-CG1 4.27Å; I22-I26 WeakPolarHBondContact O-CB 3.39Å; I22-I26 VanDerWaalsContact O-CG1 3.3Å; I22-I26 WeakPolarHBondContact O-CG1 3.44Å; I22-I26 PolarHBondContact O-N 3.03Å; I23-I26 PolarHBondContact O-N 2.9Å; I26-T28 PolarHBondContact O-N 3.31Å; I26-I29 PolarHBondContact O-N 3.28Å; I26-I29 VanDerWaalsContact O-N 3.13Å; I26-L30 HydrophobicContact CG2-CD1 3.56Å; I26-L30 WeakPolarHBondContact O-CD1 3.41Å; I26-L30 PolarHBondContact O-N 3Å; I26-F41 HydrophobicContact CG2-CZ 4.38Å
27Q81.5Confident79Confident37 Ų3764.5 Ų64.517%0.17331%0.311CS..Hα-helixtrans-56.3-52.5176.8-173.61692.600111.4I23 L24 R25 I29 L30 L31 I107I23-Q27 WeakPolarHBondContact O-CB 3.49Å; I23-Q27 PolarHBondContact O-N 2.88Å; L24-Q27 WeakPolarHBondContact O-CB 3.45Å; L24-Q27 PolarHBondContact O-N 2.88Å; R25-Q27 VanDerWaalsContact C-N 3.26Å; R25-Q27 PolarHBondContact O-N 3.31Å; Q27-I29 PolarHBondContact O-N 3.3Å; Q27-L30 PolarHBondContact O-N 3.35Å; Q27-L31 HydrophobicContact CG-CD1 3.65Å; Q27-L31 WeakPolarHBondContact O-CD1 3.45Å; Q27-L31 PolarHBondContact O-N 3.37Å; Q27-I107 HydrophobicContact CG-CG1 4.32Å; Q27-I107 HydrophobicContact CG-CG2 4.18Å
28T76.9Confident79.2Confident2 Ų262.5 Ų62.51%0.01230%0.297CS..Hα-helixtrans-56.1-37.6177.1-470000112.9L24 R25 I26 L31 F94 L97 V98 I107L24-T28 PolarHBondContact O-N 3.14Å; L24-T28 PolarHBondContact O-OG1 2.88Å; R25-T28 PolarHBondContact O-N 3.06Å; I26-T28 PolarHBondContact O-N 3.31Å; T28-L31 PolarHBondContact O-N 3.42Å; T28-F94 HydrophobicContact CG2-CE2 4.19Å; T28-F94 HydrophobicContact CG2-CZ 3.93Å; T28-L97 HydrophobicContact CG2-CD2 3.44Å; T28-L97 VanDerWaalsContact CG2-CD2 3.44Å; T28-L97 HydrophobicContact CG2-CG 4.08Å; T28-V98 HydrophobicContact CG2-CG2 4.43Å; T28-V98 WeakPolarHBondContact OG1-CG2 3.47Å; T28-I107 HydrophobicContact CG2-CD1 4.12Å; T28-I107 WeakPolarHBondContact OG1-CD1 3.27Å
29I81.4Confident79.2Confident4 Ų461.2 Ų61.22%0.02129%0.289CS..Hα-helixtrans-69.4-39.4176.9-67.8165.6000111.1R25 I26 Q27 L31 W32 S38 F41 F84 F94R25-I29 WeakPolarHBondContact O-CD1 3.32Å; R25-I29 VanDerWaalsContact O-CG1 3.28Å; R25-I29 WeakPolarHBondContact O-CG1 3.25Å; R25-I29 PolarHBondContact O-N 3Å; I26-I29 PolarHBondContact O-N 3.28Å; I26-I29 VanDerWaalsContact O-N 3.13Å; Q27-I29 PolarHBondContact O-N 3.3Å; I29-L31 PolarHBondContact O-N 3.5Å; I29-W32 PolarHBondContact O-N 3.38Å; I29-S38 WeakPolarHBondContact O-CB 3.2Å; I29-S38 PolarHBondContact O-OG 3.22Å; I29-F41 HydrophobicContact CG2-CB 3.46Å; I29-F41 VanDerWaalsContact CG2-CB 3.46Å; I29-F41 HydrophobicContact CG2-CD1 3.76Å; I29-F41 HydrophobicContact CG2-CD2 4.3Å; I29-F41 HydrophobicContact CG2-CG 3.57Å; I29-F84 HydrophobicContact CD1-CE1 3.52Å; I29-F84 HydrophobicContact CD1-CZ 3.49Å; I29-F84 VanDerWaalsContact CD1-CZ 3.49Å; I29-F94 HydrophobicContact CD1-CE2 4.39Å; I29-F94 HydrophobicContact CD1-CZ 4.21Å; I29-F94 HydrophobicContact CG1-CE2 3.84Å; I29-F94 HydrophobicContact CG1-CZ 3.81Å
30L82.9Confident79.2Confident23 Ų2357.2 Ų57.212%0.1228%0.28CS..Hα-helixtrans-70.1-19.4175.6-8776.3000112.8I26 Q27 W32 F41 L174 P177 T178I26-L30 HydrophobicContact CG2-CD1 3.56Å; I26-L30 WeakPolarHBondContact O-CD1 3.41Å; I26-L30 PolarHBondContact O-N 3Å; Q27-L30 PolarHBondContact O-N 3.35Å; L30-W32 PolarHBondContact O-N 2.93Å; L30-F41 HydrophobicContact CD1-CD1 4.1Å; L30-F41 HydrophobicContact CD1-CE1 3.46Å; L30-F41 VanDerWaalsContact CD1-CE1 3.46Å; L30-F41 HydrophobicContact CD1-CZ 4.1Å; L30-F41 HydrophobicContact CG-CE1 4.49Å; L30-L174 HydrophobicContact CD2-CD2 4.44Å; L30-P177 HydrophobicContact CB-CB 4.21Å; L30-P177 HydrophobicContact CB-CG 4.42Å; L30-P177 HydrophobicContact CD2-CB 4.45Å; L30-P177 HydrophobicContact CD2-CG 3.77Å; L30-T178 PolarHBondContact O-OG1 3.34Å
31L80.2Confident79.6Confident4 Ų456 Ų562%0.02127%0.273CS..THydrogen-bonded Turntrans-72.2-7.1175.4-91.884.1000114Q27 T28 I29 E33 S106 I107 H181Q27-L31 HydrophobicContact CG-CD1 3.65Å; Q27-L31 WeakPolarHBondContact O-CD1 3.45Å; Q27-L31 PolarHBondContact O-N 3.37Å; T28-L31 PolarHBondContact O-N 3.42Å; I29-L31 PolarHBondContact O-N 3.5Å; L31-E33 PolarHBondContact O-N 2.84Å; L31-E33 VanDerWaalsContact O-N 3.08Å; L31-S106 WeakPolarHBondContact CD2-OG 3.28Å; L31-I107 HydrophobicContact CD1-CG1 4.15Å; L31-I107 HydrophobicContact CD2-CG1 3.93Å; L31-H181 HydrophobicContact CD2-CB 4.09Å; L31-H181 VanDerWaalsContact CD2-CG 3.47Å; L31-H181 WeakPolarHBondContact CD2-ND1 3.3Å; L31-H181 HydrophobicContact CG-CB 4.03Å
32W78.5Confident80.1Confident86 Ų8651.1 Ų51.133%0.32625%0.254SS..THydrogen-bonded Turntrans5913.9-178.4-78.280.3000115.8I29 L30 R34 V35 S38 F39 T178I29-W32 PolarHBondContact O-N 3.38Å; L30-W32 PolarHBondContact O-N 2.93Å; W32-R34 PolarHBondContact O-N 2.97Å; W32-R34 VanDerWaalsContact O-N 3.14Å; W32-V35 HydrophobicContact CE3-CG1 4.17Å; W32-V35 HydrophobicContact CZ3-CG1 3.93Å; W32-S38 WeakPolarHBondContact CA-OG 3.28Å; W32-F39 HydrophobicContact CH2-CB 4.04Å; W32-F39 HydrophobicContact CH2-CD2 4.15Å; W32-F39 HydrophobicContact CZ3-CB 4.16Å; W32-T178 HydrophobicContact CB-CG2 4.38Å; W32-T178 HydrophobicContact CG-CG2 4.37Å
33E75Confident80.4Confident90 Ų9049 Ų4942%0.42125%0.249SC..SBendtrans-58.6-32.9-179.8-170.1172.5-179.900112.1L31 L97 C101L31-E33 PolarHBondContact O-N 2.84Å; L31-E33 VanDerWaalsContact O-N 3.08Å; E33-L97 VanDerWaalsContact CD-CD1 3.5Å; E33-L97 HydrophobicContact CG-CD1 4.1Å; E33-L97 WeakPolarHBondContact OE1-CD1 3.21Å; E33-C101 PolarHBondContact OE2-SG 3.16Å
34R75Confident80.6Confident108 Ų10850.5 Ų50.541%0.40825%0.253SS..SBendtrans-116107167.1-155.7-179.8-159.9161.87.6110W32 V36 P37 S38W32-R34 PolarHBondContact O-N 2.97Å; W32-R34 VanDerWaalsContact O-N 3.14Å; R34-V36 VanDerWaalsContact C-N 3.34Å; R34-V36 PolarHBondContact O-N 3.44Å; R34-P37 HydrophobicContact CB-CG 3.61Å; R34-P37 HydrophobicContact CG-CG 3.8Å; R34-P37 WeakPolarHBondContact O-CD 3.46Å; R34-P37 WeakPolarHBondContact O-CG 3.29Å; R34-S38 WeakPolarHBondContact O-CB 2.87Å; R34-S38 PolarHBondContact O-N 3.05Å; R34-S38 PolarHBondContact O-OG 3.26Å
35V77.7Confident81Confident95 Ų9551 Ų5158%0.57626%0.258SS*.Hα-helixtrans-56.6-43.7-173.1-176.30000112.8W32 F39W32-V35 HydrophobicContact CE3-CG1 4.17Å; W32-V35 HydrophobicContact CZ3-CG1 3.93Å; V35-F39 WeakPolarHBondContact O-CB 3.46Å; V35-F39 PolarHBondContact O-N 3.28Å
36V77.2Confident81.6Confident108 Ų10851.6 Ų51.666%0.65526%0.261SS*.Hα-helixtrans-63.9-57.6-175.1-179.70000113.2R34 S38 F39 V40R34-V36 VanDerWaalsContact C-N 3.34Å; R34-V36 PolarHBondContact O-N 3.44Å; V36-S38 VanDerWaalsContact C-N 3.29Å; V36-S38 PolarHBondContact O-N 2.98Å; V36-F39 PolarHBondContact O-N 3.07Å; V36-V40 VanDerWaalsContact O-CG2 3.32Å; V36-V40 WeakPolarHBondContact O-CG2 3.36Å; V36-V40 PolarHBondContact O-N 3.23Å
37P77.9Confident81.8Confident24 Ų2451.5 Ų51.516%0.15626%0.261CS..Hα-helixtrans-65.2-33.6178.727.5-36.8000112.5R34 V40 F41R34-P37 HydrophobicContact CB-CG 3.61Å; R34-P37 HydrophobicContact CG-CG 3.8Å; R34-P37 WeakPolarHBondContact O-CD 3.46Å; R34-P37 WeakPolarHBondContact O-CG 3.29Å; P37-V40 PolarHBondContact O-N 2.84Å; P37-F41 VanDerWaalsContact O-CB 3.26Å; P37-F41 WeakPolarHBondContact O-CB 3.44Å; P37-F41 PolarHBondContact O-N 2.81Å
38S84Confident81.9Confident2 Ų252.7 Ų52.71%0.01427%0.27CS..Hα-helixtrans-64.8-42.6176.9-48.10000111.5I29 W32 R34 V36 T42I29-S38 WeakPolarHBondContact O-CB 3.2Å; I29-S38 PolarHBondContact O-OG 3.22Å; W32-S38 WeakPolarHBondContact CA-OG 3.28Å; R34-S38 WeakPolarHBondContact O-CB 2.87Å; R34-S38 PolarHBondContact O-N 3.05Å; R34-S38 PolarHBondContact O-OG 3.26Å; V36-S38 VanDerWaalsContact C-N 3.29Å; V36-S38 PolarHBondContact O-N 2.98Å; S38-T42 VanDerWaalsContact O-CB 3.29Å; S38-T42 WeakPolarHBondContact O-CB 3.19Å; S38-T42 PolarHBondContact O-N 2.94Å; S38-T42 PolarHBondContact O-OG1 3.28Å
39F82.8Confident82.3Confident126 Ų12654.2 Ų54.255%0.55328%0.277SS*.Hα-helixtrans-64.8-46.2173.7179.9-96.8000111.9W32 V35 V36 F41 T42 A43W32-F39 HydrophobicContact CH2-CB 4.04Å; W32-F39 HydrophobicContact CH2-CD2 4.15Å; W32-F39 HydrophobicContact CZ3-CB 4.16Å; V35-F39 WeakPolarHBondContact O-CB 3.46Å; V35-F39 PolarHBondContact O-N 3.28Å; V36-F39 PolarHBondContact O-N 3.07Å; F39-F41 VanDerWaalsContact C-N 3.34Å; F39-F41 PolarHBondContact O-N 3.44Å; F39-T42 PolarHBondContact O-N 2.95Å; F39-A43 VanDerWaalsContact O-CB 3.28Å; F39-A43 WeakPolarHBondContact O-CB 3.43Å; F39-A43 PolarHBondContact O-N 3.19Å
40V84.1Confident82.4Confident58 Ų5858.3 Ų58.335%0.35230%0.299SS..Hα-helixtrans-61.2-43.81781710000111V36 P37 A43 F44 L76V36-V40 VanDerWaalsContact O-CG2 3.32Å; V36-V40 WeakPolarHBondContact O-CG2 3.36Å; V36-V40 PolarHBondContact O-N 3.23Å; P37-V40 PolarHBondContact O-N 2.84Å; V40-A43 PolarHBondContact O-N 2.84Å; V40-F44 WeakPolarHBondContact O-CB 3.27Å; V40-F44 PolarHBondContact O-N 2.77Å; V40-L76 HydrophobicContact CG1-CD1 4.33Å
41F85Confident82.1Confident48 Ų4857.9 Ų57.921%0.21130%0.298CS..Hα-helixtrans-63.4-46.3176.3176.6-95.1000111.8I26 I29 L30 P37 F39 A43 F44 V45 L174I26-F41 HydrophobicContact CG2-CZ 4.38Å; I29-F41 HydrophobicContact CG2-CB 3.46Å; I29-F41 VanDerWaalsContact CG2-CB 3.46Å; I29-F41 HydrophobicContact CG2-CD1 3.76Å; I29-F41 HydrophobicContact CG2-CD2 4.3Å; I29-F41 HydrophobicContact CG2-CG 3.57Å; L30-F41 HydrophobicContact CD1-CD1 4.1Å; L30-F41 HydrophobicContact CD1-CE1 3.46Å; L30-F41 VanDerWaalsContact CD1-CE1 3.46Å; L30-F41 HydrophobicContact CD1-CZ 4.1Å; L30-F41 HydrophobicContact CG-CE1 4.49Å; P37-F41 VanDerWaalsContact O-CB 3.26Å; P37-F41 WeakPolarHBondContact O-CB 3.44Å; P37-F41 PolarHBondContact O-N 2.81Å; F39-F41 VanDerWaalsContact C-N 3.34Å; F39-F41 PolarHBondContact O-N 3.44Å; F41-A43 PolarHBondContact O-N 3.24Å; F41-F44 WeakPolarHBondContact O-CB 3.23Å; F41-F44 PolarHBondContact O-N 3.24Å; F41-V45 HydrophobicContact CD1-CG2 4.3Å; F41-V45 HydrophobicContact CE1-CG2 3.82Å; F41-V45 HydrophobicContact CE2-CG2 4.26Å; F41-V45 HydrophobicContact CZ-CG2 3.82Å; F41-V45 WeakPolarHBondContact O-CG2 3.39Å; F41-V45 PolarHBondContact O-N 2.86Å; F41-L174 HydrophobicContact CE1-CD2 4.19Å
42T85.9Confident82.1Confident25 Ų2565.4 Ų65.415%0.15333%0.33CS..Hα-helixtrans-60.5-46.8177-60.80000111S38 F39 F44 V45 H46 L174S38-T42 VanDerWaalsContact O-CB 3.29Å; S38-T42 WeakPolarHBondContact O-CB 3.19Å; S38-T42 PolarHBondContact O-N 2.94Å; S38-T42 PolarHBondContact O-OG1 3.28Å; F39-T42 PolarHBondContact O-N 2.95Å; T42-F44 VanDerWaalsContact C-N 3.32Å; T42-F44 PolarHBondContact O-N 3.36Å; T42-V45 PolarHBondContact O-N 3.44Å; T42-H46 PolarHBondContact O-CD2 3.1Å; T42-H46 PolarHBondContact O-N 2.94Å; T42-L174 HydrophobicContact CG2-CD1 4.17Å
43A84.8Confident82Confident34 Ų3463.8 Ų63.828%0.28133%0.328SS..Hα-helixtrans-60.7-41.1175.600000111.8F39 V40 F41 H46 L47F39-A43 VanDerWaalsContact O-CB 3.28Å; F39-A43 WeakPolarHBondContact O-CB 3.43Å; F39-A43 PolarHBondContact O-N 3.19Å; V40-A43 PolarHBondContact O-N 2.84Å; F41-A43 PolarHBondContact O-N 3.24Å; A43-H46 PolarHBondContact O-N 2.79Å; A43-L47 WeakPolarHBondContact O-CB 3.44Å; A43-L47 VanDerWaalsContact O-CG 3.25Å; A43-L47 WeakPolarHBondContact O-CG 3.21Å; A43-L47 PolarHBondContact O-N 3.29Å
44F85.4Confident81.9Confident76 Ų7664.3 Ų64.333%0.33333%0.328SS..Hα-helixtrans-60.8-48.1174.8173.5-98.2000111.8V40 F41 T42 H46 L47 V48 L69V40-F44 WeakPolarHBondContact O-CB 3.27Å; V40-F44 PolarHBondContact O-N 2.77Å; F41-F44 WeakPolarHBondContact O-CB 3.23Å; F41-F44 PolarHBondContact O-N 3.24Å; T42-F44 VanDerWaalsContact C-N 3.32Å; T42-F44 PolarHBondContact O-N 3.36Å; F44-H46 VanDerWaalsContact C-N 3.34Å; F44-H46 PolarHBondContact O-N 2.76Å; F44-L47 PolarHBondContact O-N 3.43Å; F44-V48 HydrophobicContact CD1-CG2 4.34Å; F44-V48 HydrophobicContact CD2-CG2 4.37Å; F44-V48 HydrophobicContact CE1-CG2 3.93Å; F44-V48 HydrophobicContact CE2-CG2 3.96Å; F44-V48 HydrophobicContact CZ-CG2 3.72Å; F44-V48 WeakPolarHBondContact O-CG2 3.45Å; F44-V48 PolarHBondContact O-N 3.34Å; F44-L69 HydrophobicContact CD2-CD2 4.17Å; F44-L69 HydrophobicContact CE2-CD2 4.13Å
45V86.9Confident81.7Confident32 Ų3261 Ų6119%0.19432%0.321CS..Hα-helixtrans-60.8-43.7177.8173.10000111F41 T42 V48 F49 L170 L174F41-V45 HydrophobicContact CD1-CG2 4.3Å; F41-V45 HydrophobicContact CE1-CG2 3.82Å; F41-V45 HydrophobicContact CE2-CG2 4.26Å; F41-V45 HydrophobicContact CZ-CG2 3.82Å; F41-V45 WeakPolarHBondContact O-CG2 3.39Å; F41-V45 PolarHBondContact O-N 2.86Å; T42-V45 PolarHBondContact O-N 3.44Å; V45-V48 PolarHBondContact O-N 3.26Å; V45-F49 WeakPolarHBondContact O-CB 3.41Å; V45-F49 PolarHBondContact O-N 2.92Å; V45-L170 HydrophobicContact CG1-CD1 3.96Å; V45-L170 HydrophobicContact CG1-CD2 4.19Å; V45-L170 HydrophobicContact CG1-CG 4.23Å; V45-L174 HydrophobicContact CB-CD1 4.44Å; V45-L174 HydrophobicContact CG1-CD1 4.08Å; V45-L174 HydrophobicContact CG1-CD2 4.38Å
46H89.3Confident81.3Confident31 Ų3163.9 Ų63.914%0.14433%0.334CS..Hα-helixtrans-63.5-42174.9-75.6-63.1000112.6T42 A43 F44 F49 L50 Y167T42-H46 PolarHBondContact O-CD2 3.1Å; T42-H46 PolarHBondContact O-N 2.94Å; A43-H46 PolarHBondContact O-N 2.79Å; F44-H46 VanDerWaalsContact C-N 3.34Å; F44-H46 PolarHBondContact O-N 2.76Å; H46-F49 PolarHBondContact O-N 3.46Å; H46-L50 WeakPolarHBondContact O-CB 3.35Å; H46-L50 VanDerWaalsContact O-CG 3.23Å; H46-L50 WeakPolarHBondContact O-CG 3.35Å; H46-L50 PolarHBondContact O-N 3.32Å; H46-Y167 AromaticContact CE1-CE2 3.75Å; H46-Y167 AromaticContact CE1-CZ 3.85Å; H46-Y167 PolarHBondContact CE1-OH 2.87Å; H46-Y167 AromaticContact ND1-CE2 3.34Å; H46-Y167 VanDerWaalsContact ND1-CE2 3.34Å; H46-Y167 WeakPolarHBondContact ND1-CE2 3.44Å; H46-Y167 AromaticContact ND1-CZ 3.79Å; H46-Y167 PolarHBondContact ND1-OH 3.42Å
47L85.3Confident80.4Confident69 Ų6965.3 Ų65.336%0.36133%0.332SS..Hα-helixtrans-61.7-46.7176.6-77172.6000111A43 F44 F49 L50 S51 L69A43-L47 WeakPolarHBondContact O-CB 3.44Å; A43-L47 VanDerWaalsContact O-CG 3.25Å; A43-L47 WeakPolarHBondContact O-CG 3.21Å; A43-L47 PolarHBondContact O-N 3.29Å; F44-L47 PolarHBondContact O-N 3.43Å; L47-F49 VanDerWaalsContact C-N 3.34Å; L47-F49 PolarHBondContact O-N 3.08Å; L47-L50 PolarHBondContact O-N 2.79Å; L47-S51 WeakPolarHBondContact O-CB 3.06Å; L47-S51 PolarHBondContact O-N 3.42Å; L47-S51 PolarHBondContact O-OG 2.89Å; L47-L69 HydrophobicContact CB-CD2 4.35Å
48V83.9Confident80Confident61 Ų6168 Ų6837%0.3735%0.351SS..Hα-helixtrans-59.9-44.8176.4172.30000110.9F44 V45 S51 F52 L69F44-V48 HydrophobicContact CD1-CG2 4.34Å; F44-V48 HydrophobicContact CD2-CG2 4.37Å; F44-V48 HydrophobicContact CE1-CG2 3.93Å; F44-V48 HydrophobicContact CE2-CG2 3.96Å; F44-V48 HydrophobicContact CZ-CG2 3.72Å; F44-V48 WeakPolarHBondContact O-CG2 3.45Å; F44-V48 PolarHBondContact O-N 3.34Å; V45-V48 PolarHBondContact O-N 3.26Å; V48-S51 WeakPolarHBondContact O-CB 3.29Å; V48-S51 PolarHBondContact O-N 2.88Å; V48-F52 PolarHBondContact O-N 3.16Å; V48-L69 HydrophobicContact CG2-CD1 3.86Å
49F85.2Confident79.5Confident34 Ų3473.1 Ų73.115%0.14938%0.382CS..Hα-helixtrans-65.6-44.5178.7-177.5-99.9000112.6V45 H46 L47 S51 F52 I53 A166 Y167 L170V45-F49 WeakPolarHBondContact O-CB 3.41Å; V45-F49 PolarHBondContact O-N 2.92Å; H46-F49 PolarHBondContact O-N 3.46Å; L47-F49 VanDerWaalsContact C-N 3.34Å; L47-F49 PolarHBondContact O-N 3.08Å; F49-S51 VanDerWaalsContact C-N 3.25Å; F49-S51 PolarHBondContact O-N 2.93Å; F49-F52 WeakPolarHBondContact O-CB 3.26Å; F49-F52 PolarHBondContact O-N 3.14Å; F49-F52 VanDerWaalsContact O-N 3.13Å; F49-I53 HydrophobicContact CD1-CD1 3.51Å; F49-I53 HydrophobicContact CD1-CG1 4.35Å; F49-I53 HydrophobicContact CE1-CD1 3.11Å; F49-I53 HydrophobicContact CE1-CG1 4.02Å; F49-I53 HydrophobicContact CG-CD1 4.44Å; F49-I53 HydrophobicContact CZ-CD1 3.75Å; F49-I53 HydrophobicContact CZ-CG1 4.25Å; F49-I53 WeakPolarHBondContact O-CG1 3.2Å; F49-I53 PolarHBondContact O-N 3.46Å; F49-A166 HydrophobicContact CE2-CB 4.07Å; F49-A166 HydrophobicContact CZ-CB 3.82Å; F49-Y167 AromaticContact CD1-CD2 3.65Å; F49-Y167 HydrophobicContact CD1-CD2 3.65Å; F49-Y167 HydrophobicContact CD1-CE2 4.38Å; F49-Y167 AromaticContact CE1-CD2 3.47Å; F49-Y167 HydrophobicContact CE1-CD2 3.47Å; F49-Y167 VanDerWaalsContact CE1-CD2 3.47Å; F49-Y167 HydrophobicContact CE1-CG 4.04Å; F49-L170 HydrophobicContact CB-CD1 3.59Å; F49-L170 HydrophobicContact CD1-CD1 4.2Å; F49-L170 HydrophobicContact CD2-CD1 3.53Å; F49-L170 HydrophobicContact CE2-CD1 4.25Å; F49-L170 HydrophobicContact CG-CD1 3.51Å
50L82.4Confident78.9Confident91 Ų9172.7 Ų72.748%0.47639%0.385SS..Hα-helixtrans-63.3-33.6173.9-71.4171.8000111.9H46 L47 F52 I53 K54H46-L50 WeakPolarHBondContact O-CB 3.35Å; H46-L50 VanDerWaalsContact O-CG 3.23Å; H46-L50 WeakPolarHBondContact O-CG 3.35Å; H46-L50 PolarHBondContact O-N 3.32Å; L47-L50 PolarHBondContact O-N 2.79Å; L50-F52 VanDerWaalsContact C-N 3.33Å; L50-I53 HydrophobicContact CD2-CD1 4.42Å; L50-I53 PolarHBondContact O-N 2.83Å; L50-K54 WeakPolarHBondContact O-CB 3.26Å; L50-K54 PolarHBondContact O-N 3.42Å
51S76.9Confident78.5Confident14 Ų1473.5 Ų73.510%0.09838%0.384CS..Hα-helixtrans-58.9-47.6172.1-520000110.4L47 V48 F49 K54 S55 L65L47-S51 WeakPolarHBondContact O-CB 3.06Å; L47-S51 PolarHBondContact O-N 3.42Å; L47-S51 PolarHBondContact O-OG 2.89Å; V48-S51 WeakPolarHBondContact O-CB 3.29Å; V48-S51 PolarHBondContact O-N 2.88Å; F49-S51 VanDerWaalsContact C-N 3.25Å; F49-S51 PolarHBondContact O-N 2.93Å; S51-K54 CarbonylContact O-C 3.57Å; S51-K54 PolarHBondContact O-N 2.81Å; S51-S55 WeakPolarHBondContact O-CB 3.49Å; S51-S55 PolarHBondContact O-N 2.94Å; S51-L65 WeakPolarHBondContact OG-CD2 3.35Å; S51-L65 VanDerWaalsContact OG-CG 3.25Å; S51-L65 WeakPolarHBondContact OG-CG 3.42Å
52F80.2Confident77.9Confident162 Ų16274.1 Ų74.171%0.71139%0.389SS*.Hα-helixtrans-66.8-38.8-180-171.4-98000112.5V48 F49 L50 S55V48-F52 PolarHBondContact O-N 3.16Å; F49-F52 WeakPolarHBondContact O-CB 3.26Å; F49-F52 PolarHBondContact O-N 3.14Å; F49-F52 VanDerWaalsContact O-N 3.13Å; L50-F52 VanDerWaalsContact C-N 3.33Å; F52-S55 WeakPolarHBondContact O-CB 3.26Å; F52-S55 PolarHBondContact O-N 2.88Å
53I77Confident77.4Confident52 Ų5279 Ų7927%0.26741%0.408SS..Hα-helixtrans-65.5-46.6174.6-65.4163.8000110.9F49 L50 S55 N56 V163F49-I53 HydrophobicContact CD1-CD1 3.51Å; F49-I53 HydrophobicContact CD1-CG1 4.35Å; F49-I53 HydrophobicContact CE1-CD1 3.11Å; F49-I53 HydrophobicContact CE1-CG1 4.02Å; F49-I53 HydrophobicContact CG-CD1 4.44Å; F49-I53 HydrophobicContact CZ-CD1 3.75Å; F49-I53 HydrophobicContact CZ-CG1 4.25Å; F49-I53 WeakPolarHBondContact O-CG1 3.2Å; F49-I53 PolarHBondContact O-N 3.46Å; L50-I53 HydrophobicContact CD2-CD1 4.42Å; L50-I53 PolarHBondContact O-N 2.83Å; I53-S55 PolarHBondContact O-N 3.46Å; I53-N56 PolarHBondContact O-N 3.49Å; I53-V163 HydrophobicContact CB-CG1 4.34Å; I53-V163 HydrophobicContact CD1-CG1 3.36Å; I53-V163 HydrophobicContact CG1-CG1 3.68Å; I53-V163 HydrophobicContact CG2-CG1 3.69Å; I53-V163 HydrophobicContact CG2-CG2 4.33Å
54K74.1Confident77.1Confident101 Ų10181.1 Ų81.144%0.43942%0.42SS..Hα-helixtrans-74.6-11-177.8-164167.1168.578.50112.2L50 S51 N56 F57 F61L50-K54 WeakPolarHBondContact O-CB 3.26Å; L50-K54 PolarHBondContact O-N 3.42Å; S51-K54 CarbonylContact O-C 3.57Å; S51-K54 PolarHBondContact O-N 2.81Å; K54-N56 PolarHBondContact O-N 2.8Å; K54-N56 VanDerWaalsContact O-N 3.08Å; K54-F57 HydrophobicContact CG-CD2 4.08Å; K54-F57 WeakPolarHBondContact O-CB 3.3Å; K54-F57 PolarHBondContact O-N 3.44Å; K54-F61 HydrophobicContact CB-CD1 4.3Å; K54-F61 HydrophobicContact CB-CE1 3.75Å; K54-F61 HydrophobicContact CD-CD1 4.32Å; K54-F61 HydrophobicContact CD-CE1 3.47Å; K54-F61 VanDerWaalsContact CD-CE1 3.47Å; K54-F61 HydrophobicContact CD-CE2 4.29Å; K54-F61 HydrophobicContact CD-CZ 3.45Å; K54-F61 VanDerWaalsContact CD-CZ 3.45Å; K54-F61 VanDerWaalsContact CE-CZ 3.4Å; K54-F61 HydrophobicContact CG-CD1 3.97Å; K54-F61 HydrophobicContact CG-CE1 3.51Å; K54-F61 HydrophobicContact CG-CZ 4.03Å
55S70.4Confident76.7Confident37 Ų3779 Ų7926%0.25941%0.412SS..THydrogen-bonded Turntrans-54.6-19170.9-173.90000114S51 F52 I53 F57 I62S51-S55 WeakPolarHBondContact O-CB 3.49Å; S51-S55 PolarHBondContact O-N 2.94Å; F52-S55 WeakPolarHBondContact O-CB 3.26Å; F52-S55 PolarHBondContact O-N 2.88Å; I53-S55 PolarHBondContact O-N 3.46Å; S55-F57 PolarHBondContact O-N 3.46Å; S55-F57 VanDerWaalsContact O-N 3.16Å; S55-I62 WeakPolarHBondContact OG-CD1 3.37Å; S55-I62 VanDerWaalsContact OG-CG1 3.28Å; S55-I62 WeakPolarHBondContact OG-CG1 3.43Å
56N68.1Low76.3Confident157 Ų15779.6 Ų79.684%0.8442%0.421SS*.THydrogen-bonded Turntrans-62.2-16.5171.2-141.11.8000111.9I53 K54I53-N56 PolarHBondContact O-N 3.49Å; K54-N56 PolarHBondContact O-N 2.8Å; K54-N56 VanDerWaalsContact O-N 3.08Å
57F59.3Low75.9Confident138 Ų13882.4 Ų82.461%0.60544%0.436SS*.SBendtrans-92.6127.6165.4-64.2-75.8000110.6K54 S55K54-F57 HydrophobicContact CG-CD2 4.08Å; K54-F57 WeakPolarHBondContact O-CB 3.3Å; K54-F57 PolarHBondContact O-N 3.44Å; S55-F57 PolarHBondContact O-N 3.46Å; S55-F57 VanDerWaalsContact O-N 3.16Å
58S69.5Low75.8Confident79 Ų7984.3 Ų84.355%0.55244%0.442SS*.  trans19.5115.6164.5-1710000115.3L60 F61S58-L60 CarbonylContact O-C 3.31Å; S58-L60 PolarHBondContact O-N 3.04Å; S58-F61 PolarHBondContact O-N 3.45Å
59T72.2Confident75.6Confident111 Ų11182.4 Ų82.468%0.68143%0.429SS*.Hα-helixtrans-35.2-31.3174.8510000115.7F61 I62 F63T59-F61 PolarHBondContact O-N 3.42Å; T59-I62 WeakPolarHBondContact O-CB 3.36Å; T59-I62 PolarHBondContact O-N 2.91Å; T59-F63 PolarHBondContact O-N 2.67Å
60L72.1Confident75.4Confident117 Ų11784.6 Ų84.661%0.61345%0.445SS*.Hα-helixtrans-58.8-39.9172.9-64.4178.9000114.5S58 I62 F63 C64S58-L60 CarbonylContact O-C 3.31Å; S58-L60 PolarHBondContact O-N 3.04Å; L60-I62 VanDerWaalsContact C-N 3.35Å; L60-F63 PolarHBondContact O-N 2.81Å; L60-C64 WeakPolarHBondContact O-CB 3.13Å; L60-C64 PolarHBondContact O-N 3.46Å; L60-C64 PolarHBondContact O-SG 3.23Å; L60-C64 VanDerWaalsContact O-SG 3.34Å
61F74.1Confident75.3Confident74 Ų7485.8 Ų85.833%0.32545%0.451SS..Hα-helixtrans-64.3-43177.9-178.6-98.9000110.8K54 S58 T59 F63 C64 L65K54-F61 HydrophobicContact CB-CD1 4.3Å; K54-F61 HydrophobicContact CB-CE1 3.75Å; K54-F61 HydrophobicContact CD-CD1 4.32Å; K54-F61 HydrophobicContact CD-CE1 3.47Å; K54-F61 VanDerWaalsContact CD-CE1 3.47Å; K54-F61 HydrophobicContact CD-CE2 4.29Å; K54-F61 HydrophobicContact CD-CZ 3.45Å; K54-F61 VanDerWaalsContact CD-CZ 3.45Å; K54-F61 VanDerWaalsContact CE-CZ 3.4Å; K54-F61 HydrophobicContact CG-CD1 3.97Å; K54-F61 HydrophobicContact CG-CE1 3.51Å; K54-F61 HydrophobicContact CG-CZ 4.03Å; S58-F61 PolarHBondContact O-N 3.45Å; T59-F61 PolarHBondContact O-N 3.42Å; F61-F63 VanDerWaalsContact C-N 3.32Å; F61-F63 PolarHBondContact O-N 2.92Å; F61-C64 PolarHBondContact O-N 2.86Å; F61-L65 HydrophobicContact CD1-CD2 4.35Å; F61-L65 HydrophobicContact CE1-CD2 3.51Å; F61-L65 HydrophobicContact CZ-CD2 3.79Å; F61-L65 WeakPolarHBondContact O-CB 3.35Å; F61-L65 PolarHBondContact O-N 2.75Å
62I74Confident75.5Confident62 Ų6287.5 Ų87.532%0.31846%0.459SS..Hα-helixtrans-60-46.3173.9-49.2163.7000109.8S55 T59 L60 L65 A66S55-I62 WeakPolarHBondContact OG-CD1 3.37Å; S55-I62 VanDerWaalsContact OG-CG1 3.28Å; S55-I62 WeakPolarHBondContact OG-CG1 3.43Å; T59-I62 WeakPolarHBondContact O-CB 3.36Å; T59-I62 PolarHBondContact O-N 2.91Å; L60-I62 VanDerWaalsContact C-N 3.35Å; I62-L65 PolarHBondContact O-N 2.82Å; I62-A66 WeakPolarHBondContact O-CB 3.36Å; I62-A66 PolarHBondContact O-N 3.3Å
63F74.3Confident75.3Confident126 Ų12682.7 Ų82.755%0.55345%0.445SS*.Hα-helixtrans-62.5-49.4-179.1-178.3-102.1000111.9T59 L60 F61 L65 A66 L67T59-F63 PolarHBondContact O-N 2.67Å; L60-F63 PolarHBondContact O-N 2.81Å; F61-F63 VanDerWaalsContact C-N 3.32Å; F61-F63 PolarHBondContact O-N 2.92Å; F63-L65 VanDerWaalsContact C-N 3.28Å; F63-L65 PolarHBondContact O-N 3.18Å; F63-A66 PolarHBondContact O-N 3.06Å; F63-L67 HydrophobicContact CD1-CD1 3.89Å; F63-L67 HydrophobicContact CD1-CG 4.37Å; F63-L67 HydrophobicContact CE1-CD1 3.3Å; F63-L67 HydrophobicContact CE1-CG 4.04Å; F63-L67 HydrophobicContact CE2-CD1 4.42Å; F63-L67 HydrophobicContact CE2-CG 4.39Å; F63-L67 HydrophobicContact CZ-CD1 3.62Å; F63-L67 HydrophobicContact CZ-CD2 4.31Å; F63-L67 HydrophobicContact CZ-CG 4.05Å; F63-L67 WeakPolarHBondContact O-CB 2.98Å; F63-L67 WeakPolarHBondContact O-CG 3.29Å; F63-L67 PolarHBondContact O-N 2.82Å
64C79Confident75.4Confident79 Ų7984.2 Ų84.253%0.53445%0.454SS..Hα-helixtrans-60.1-39.8176.5-71.90000112L60 F61 F68L60-C64 WeakPolarHBondContact O-CB 3.13Å; L60-C64 PolarHBondContact O-N 3.46Å; L60-C64 PolarHBondContact O-SG 3.23Å; L60-C64 VanDerWaalsContact O-SG 3.34Å; F61-C64 PolarHBondContact O-N 2.86Å; C64-F68 WeakPolarHBondContact O-CB 3.5Å; C64-F68 PolarHBondContact O-N 3.45Å
65L77.2Confident75.5Confident32 Ų3285.5 Ų85.517%0.16847%0.465CS..Hα-helixtrans-73.7-38.7179.7-170.751.1000112.1S51 F61 I62 F63 F68 L69S51-L65 WeakPolarHBondContact OG-CD2 3.35Å; S51-L65 VanDerWaalsContact OG-CG 3.25Å; S51-L65 WeakPolarHBondContact OG-CG 3.42Å; F61-L65 HydrophobicContact CD1-CD2 4.35Å; F61-L65 HydrophobicContact CE1-CD2 3.51Å; F61-L65 HydrophobicContact CZ-CD2 3.79Å; F61-L65 WeakPolarHBondContact O-CB 3.35Å; F61-L65 PolarHBondContact O-N 2.75Å; I62-L65 PolarHBondContact O-N 2.82Å; F63-L65 VanDerWaalsContact C-N 3.28Å; F63-L65 PolarHBondContact O-N 3.18Å; L65-F68 HydrophobicContact CD1-CD1 4.23Å; L65-F68 WeakPolarHBondContact O-CB 3.2Å; L65-F68 PolarHBondContact O-N 2.92Å; L65-L69 WeakPolarHBondContact O-CB 3.46Å; L65-L69 VanDerWaalsContact O-CG 3.28Å; L65-L69 WeakPolarHBondContact O-CG 3.28Å; L65-L69 PolarHBondContact O-N 2.77Å
66A78Confident75.6Confident45 Ų4585.9 Ų85.937%0.37246%0.464SS..Hα-helixtrans-62.4-44.2171.700000110.7I62 F63 F68 L69 V70I62-A66 WeakPolarHBondContact O-CB 3.36Å; I62-A66 PolarHBondContact O-N 3.3Å; F63-A66 PolarHBondContact O-N 3.06Å; A66-F68 VanDerWaalsContact C-N 3.34Å; A66-F68 PolarHBondContact O-N 3.49Å; A66-L69 PolarHBondContact O-N 3.3Å; A66-V70 WeakPolarHBondContact O-CB 3.25Å; A66-V70 VanDerWaalsContact O-CG2 3.23Å; A66-V70 WeakPolarHBondContact O-CG2 3.38Å; A66-V70 PolarHBondContact O-N 2.83Å
67L80.5Confident75.7Confident90 Ų9083.9 Ų83.947%0.47145%0.449SS..Hα-helixtrans-62.2-40.9172.7-73.2-175.6000112.1F63 V70 L71F63-L67 HydrophobicContact CD1-CD1 3.89Å; F63-L67 HydrophobicContact CD1-CG 4.37Å; F63-L67 HydrophobicContact CE1-CD1 3.3Å; F63-L67 HydrophobicContact CE1-CG 4.04Å; F63-L67 HydrophobicContact CE2-CD1 4.42Å; F63-L67 HydrophobicContact CE2-CG 4.39Å; F63-L67 HydrophobicContact CZ-CD1 3.62Å; F63-L67 HydrophobicContact CZ-CD2 4.31Å; F63-L67 HydrophobicContact CZ-CG 4.05Å; F63-L67 WeakPolarHBondContact O-CB 2.98Å; F63-L67 WeakPolarHBondContact O-CG 3.29Å; F63-L67 PolarHBondContact O-N 2.82Å; L67-V70 PolarHBondContact O-N 3.27Å; L67-L71 VanDerWaalsContact O-CB 3.22Å; L67-L71 WeakPolarHBondContact O-CB 3.24Å; L67-L71 PolarHBondContact O-N 3.24Å
68F83.2Confident76Confident109 Ų10981 Ų8148%0.47844%0.444SS..Hα-helixtrans-62.8-43.6174.7174.8-97.8000111.7C64 L65 A66 L71 L72C64-F68 WeakPolarHBondContact O-CB 3.5Å; C64-F68 PolarHBondContact O-N 3.45Å; L65-F68 HydrophobicContact CD1-CD1 4.23Å; L65-F68 WeakPolarHBondContact O-CB 3.2Å; L65-F68 PolarHBondContact O-N 2.92Å; A66-F68 VanDerWaalsContact C-N 3.34Å; A66-F68 PolarHBondContact O-N 3.49Å; F68-L71 PolarHBondContact O-N 3.05Å; F68-L72 HydrophobicContact CE1-CD2 4.4Å; F68-L72 VanDerWaalsContact O-CB 3.26Å; F68-L72 WeakPolarHBondContact O-CB 3.47Å; F68-L72 PolarHBondContact O-N 2.74Å
69L80.8Confident75.7Confident21 Ų2181.4 Ų81.411%0.1144%0.44CS..Hα-helixtrans-66.5-41.6176.6-71.3174.2000111.4F44 L47 V48 L65 A66 L72 C73F44-L69 HydrophobicContact CD2-CD2 4.17Å; F44-L69 HydrophobicContact CE2-CD2 4.13Å; L47-L69 HydrophobicContact CB-CD2 4.35Å; V48-L69 HydrophobicContact CG2-CD1 3.86Å; L65-L69 WeakPolarHBondContact O-CB 3.46Å; L65-L69 VanDerWaalsContact O-CG 3.28Å; L65-L69 WeakPolarHBondContact O-CG 3.28Å; L65-L69 PolarHBondContact O-N 2.77Å; A66-L69 PolarHBondContact O-N 3.3Å; L69-L72 PolarHBondContact O-N 2.8Å; L69-C73 WeakPolarHBondContact O-CB 3.48Å; L69-C73 PolarHBondContact O-N 3.25Å; L69-C73 PolarHBondContact O-SG 3.05Å
70V79.7Confident75.3Confident80 Ų8079.5 Ų79.549%0.48542%0.424SS..Hα-helixtrans-62.6-43.5173.31680000110.5A66 L67 C73 N74A66-V70 WeakPolarHBondContact O-CB 3.25Å; A66-V70 VanDerWaalsContact O-CG2 3.23Å; A66-V70 WeakPolarHBondContact O-CG2 3.38Å; A66-V70 PolarHBondContact O-N 2.83Å; L67-V70 PolarHBondContact O-N 3.27Å; V70-C73 PolarHBondContact O-N 3.23Å; V70-N74 WeakPolarHBondContact CG1-ND2 3.24Å; V70-N74 WeakPolarHBondContact O-CB 3.49Å; V70-N74 PolarHBondContact O-N 3.16Å; V70-N74 PolarHBondContact O-ND2 3.04Å
71L81.8Confident74.9Confident115 Ų11575.9 Ų75.960%0.60241%0.411SS*.Hα-helixtrans-63.9-41.8175.8-178.266.5000111.3L67 F68 N74 L75L67-L71 VanDerWaalsContact O-CB 3.22Å; L67-L71 WeakPolarHBondContact O-CB 3.24Å; L67-L71 PolarHBondContact O-N 3.24Å; F68-L71 PolarHBondContact O-N 3.05Å; L71-N74 PolarHBondContact O-N 3.23Å; L71-L75 VanDerWaalsContact O-CB 3.29Å; L71-L75 WeakPolarHBondContact O-CB 3.45Å; L71-L75 PolarHBondContact O-N 3.29Å
72L79.8Confident74.3Confident50 Ų5081.9 Ų81.926%0.26243%0.432SS..Hα-helixtrans-64.1-43.9175.5-175.164.9000110.7F68 L69 N74 L75 L76F68-L72 HydrophobicContact CE1-CD2 4.4Å; F68-L72 VanDerWaalsContact O-CB 3.26Å; F68-L72 WeakPolarHBondContact O-CB 3.47Å; F68-L72 PolarHBondContact O-N 2.74Å; L69-L72 PolarHBondContact O-N 2.8Å; L72-N74 VanDerWaalsContact C-N 3.34Å; L72-N74 PolarHBondContact O-N 3Å; L72-L75 PolarHBondContact O-N 3.19Å; L72-L76 HydrophobicContact CD1-CD1 4.04Å; L72-L76 HydrophobicContact CD1-CG 4.24Å; L72-L76 HydrophobicContact CG-CD1 3.9Å; L72-L76 HydrophobicContact CG-CG 4.42Å; L72-L76 WeakPolarHBondContact O-CB 3.49Å; L72-L76 WeakPolarHBondContact O-CG 3.19Å; L72-L76 PolarHBondContact O-N 3.4Å
73C76.9Confident73.6Confident61 Ų6182.3 Ų82.341%0.41243%0.432SS..Hα-helixtrans-61.2-40.7173.3-73.30000111.9L69 V70 L76 Q77L69-C73 WeakPolarHBondContact O-CB 3.48Å; L69-C73 PolarHBondContact O-N 3.25Å; L69-C73 PolarHBondContact O-SG 3.05Å; V70-C73 PolarHBondContact O-N 3.23Å; C73-L76 CarbonylContact O-C 3.59Å; C73-Q77 VanDerWaalsContact O-CA 3.3Å; C73-Q77 WeakPolarHBondContact O-CA 3.29Å; C73-Q77 WeakPolarHBondContact O-CB 3.31Å; C73-Q77 PolarHBondContact O-N 3.36Å
74N78Confident72.7Confident84 Ų8478.6 Ų78.645%0.44942%0.415SS..Hα-helixtrans-67.2-43.1175.4-79.5-51.9000112V70 L71 L72 L76 Q77V70-N74 WeakPolarHBondContact CG1-ND2 3.24Å; V70-N74 WeakPolarHBondContact O-CB 3.49Å; V70-N74 PolarHBondContact O-N 3.16Å; V70-N74 PolarHBondContact O-ND2 3.04Å; L71-N74 PolarHBondContact O-N 3.23Å; L72-N74 VanDerWaalsContact C-N 3.34Å; L72-N74 PolarHBondContact O-N 3Å; N74-L76 VanDerWaalsContact C-N 3.32Å; N74-Q77 WeakPolarHBondContact O-CB 2.84Å; N74-Q77 PolarHBondContact O-N 2.99Å; N74-Q77 VanDerWaalsContact O-N 3.1Å; N74-Q77 PolarHBondContact OD1-OE1 3.42Å
75L76Confident71.5Confident129 Ų12981.1 Ų81.168%0.67542%0.423SS*.Hα-helixtrans-65.6-40177.2-179.264.7000111.1L71 L72 Q77 P78L71-L75 VanDerWaalsContact O-CB 3.29Å; L71-L75 WeakPolarHBondContact O-CB 3.45Å; L71-L75 PolarHBondContact O-N 3.29Å; L72-L75 PolarHBondContact O-N 3.19Å; L75-Q77 VanDerWaalsContact C-N 3.3Å; L75-P78 WeakPolarHBondContact O-CD 3.28Å
76L73.6Confident70.4Confident45 Ų4582 Ų8224%0.23643%0.428CS..Hα-helixtrans-78.7-13.1173.8-64.9176.1000111.6V40 L72 C73 N74 L79 M80V40-L76 HydrophobicContact CG1-CD1 4.33Å; L72-L76 HydrophobicContact CD1-CD1 4.04Å; L72-L76 HydrophobicContact CD1-CG 4.24Å; L72-L76 HydrophobicContact CG-CD1 3.9Å; L72-L76 HydrophobicContact CG-CG 4.42Å; L72-L76 WeakPolarHBondContact O-CB 3.49Å; L72-L76 WeakPolarHBondContact O-CG 3.19Å; L72-L76 PolarHBondContact O-N 3.4Å; C73-L76 CarbonylContact O-C 3.59Å; N74-L76 VanDerWaalsContact C-N 3.32Å; L76-L79 HydrophobicContact CD2-CD2 4.24Å; L76-L79 CarbonylContact O-C 3.58Å; L76-L79 VanDerWaalsContact O-CA 3.3Å; L76-L79 WeakPolarHBondContact O-CA 2.95Å; L76-L79 WeakPolarHBondContact O-CB 3.48Å; L76-L79 PolarHBondContact O-N 3.32Å; L76-M80 HydrophobicContact CB-CG 3.95Å; L76-M80 WeakPolarHBondContact O-CB 3.47Å; L76-M80 VanDerWaalsContact O-CG 3.24Å; L76-M80 WeakPolarHBondContact O-CG 3.44Å; L76-M80 PolarHBondContact O-N 3.33Å
77Q68.9Low69.1Low114 Ų11484.5 Ų84.553%0.53344%0.442SS..Hα-helixtrans-51.8-45.1-176.4-174.1178.8-33.200113.8C73 N74 L75 L79 M80 A81C73-Q77 VanDerWaalsContact O-CA 3.3Å; C73-Q77 WeakPolarHBondContact O-CA 3.29Å; C73-Q77 WeakPolarHBondContact O-CB 3.31Å; C73-Q77 PolarHBondContact O-N 3.36Å; N74-Q77 WeakPolarHBondContact O-CB 2.84Å; N74-Q77 PolarHBondContact O-N 2.99Å; N74-Q77 VanDerWaalsContact O-N 3.1Å; N74-Q77 PolarHBondContact OD1-OE1 3.42Å; L75-Q77 VanDerWaalsContact C-N 3.3Å; Q77-L79 VanDerWaalsContact C-N 3.3Å; Q77-L79 PolarHBondContact O-N 3.36Å; Q77-M80 CarbonylContact O-C 3.6Å; Q77-M80 PolarHBondContact O-N 3.23Å; Q77-A81 WeakPolarHBondContact O-CA 3.35Å; Q77-A81 WeakPolarHBondContact O-CB 3.44Å; Q77-A81 PolarHBondContact O-N 3.43Å
78P67.5Low67.7Low78 Ų7887.8 Ų87.851%0.50645%0.453SS..Hα-helixtrans-65.6-34.3174.524.4-34.8000112.5L75 R82L75-P78 WeakPolarHBondContact O-CD 3.28Å; P78-R82 WeakPolarHBondContact O-CB 3.44Å; P78-R82 VanDerWaalsContact O-CG 3.24Å; P78-R82 WeakPolarHBondContact O-CG 3.32Å; P78-R82 PolarHBondContact O-N 3.01Å
79L62.1Low66.1Low87 Ų8792.8 Ų92.846%0.45547%0.468SS..Hα-helixtrans-68.9-47.8176.2-161.4109.1000110.4L76 Q77 A81 R82 F83L76-L79 HydrophobicContact CD2-CD2 4.24Å; L76-L79 CarbonylContact O-C 3.58Å; L76-L79 VanDerWaalsContact O-CA 3.3Å; L76-L79 WeakPolarHBondContact O-CA 2.95Å; L76-L79 WeakPolarHBondContact O-CB 3.48Å; L76-L79 PolarHBondContact O-N 3.32Å; Q77-L79 VanDerWaalsContact C-N 3.3Å; Q77-L79 PolarHBondContact O-N 3.36Å; L79-A81 VanDerWaalsContact C-N 3.32Å; L79-A81 PolarHBondContact O-N 3.41Å; L79-R82 PolarHBondContact O-N 3.48Å; L79-F83 HydrophobicContact CD1-CE2 4.04Å; L79-F83 HydrophobicContact CD2-CD2 3.78Å; L79-F83 HydrophobicContact CD2-CE2 3.7Å; L79-F83 HydrophobicContact CG-CD2 3.69Å; L79-F83 HydrophobicContact CG-CE2 3.53Å; L79-F83 WeakPolarHBondContact O-CB 3.49Å; L79-F83 WeakPolarHBondContact O-CD2 3.47Å; L79-F83 PolarHBondContact O-N 3.44Å
80M63.4Low64.9Low71 Ų7193.9 Ų93.935%0.3548%0.478SS..Hα-helixtrans-62-38.5173.3-62.5-69.4-75.100110.6L76 Q77 F83 F84L76-M80 HydrophobicContact CB-CG 3.95Å; L76-M80 WeakPolarHBondContact O-CB 3.47Å; L76-M80 VanDerWaalsContact O-CG 3.24Å; L76-M80 WeakPolarHBondContact O-CG 3.44Å; L76-M80 PolarHBondContact O-N 3.33Å; Q77-M80 CarbonylContact O-C 3.6Å; Q77-M80 PolarHBondContact O-N 3.23Å; M80-F83 PolarHBondContact O-N 3.49Å; M80-F84 HydrophobicContact CB-CD2 4.02Å; M80-F84 HydrophobicContact CB-CE2 4.48Å; M80-F84 HydrophobicContact CE-CD2 3.63Å; M80-F84 HydrophobicContact CE-CE1 4.24Å; M80-F84 HydrophobicContact CE-CE2 3.08Å; M80-F84 HydrophobicContact CE-CG 4.42Å; M80-F84 HydrophobicContact CE-CZ 3.43Å; M80-F84 VanDerWaalsContact CE-CZ 3.43Å; M80-F84 VanDerWaalsContact O-CA 3.3Å; M80-F84 WeakPolarHBondContact O-CA 3.38Å; M80-F84 WeakPolarHBondContact O-CB 2.93Å; M80-F84 VanDerWaalsContact O-CD2 3.31Å; M80-F84 WeakPolarHBondContact O-CD2 3.39Å; M80-F84 PolarHBondContact O-N 3.47Å; M80-F84 HydrophobicContact SD-CD2 3.79Å; M80-F84 HydrophobicContact SD-CE2 3.26Å; M80-F84 WeakPolarHBondContact SD-CE2 3.23Å; M80-F84 HydrophobicContact SD-CZ 4.11Å
81A65Low63.6Low42 Ų4295.9 Ų95.935%0.34749%0.493SS..Hα-helixtrans-69.5-37.6177.700000111.1Q77 L79 L85 D86Q77-A81 WeakPolarHBondContact O-CA 3.35Å; Q77-A81 WeakPolarHBondContact O-CB 3.44Å; Q77-A81 PolarHBondContact O-N 3.43Å; L79-A81 VanDerWaalsContact C-N 3.32Å; L79-A81 PolarHBondContact O-N 3.41Å; A81-L85 HydrophobicContact CB-CB 4.4Å; A81-L85 CarbonylContact O-C 3.44Å; A81-L85 VanDerWaalsContact O-C 3.31Å; A81-L85 WeakPolarHBondContact O-CA 3.35Å; A81-L85 WeakPolarHBondContact O-CB 3.34Å; A81-L85 PolarHBondContact O-N 2.85Å; A81-D86 PolarHBondContact O-N 3.48Å; A81-D86 VanDerWaalsContact O-N 3.14Å
82R61.5Low62.5Low199 Ų19993 Ų9375%0.75149%0.49SS*.Hα-helixtrans-68.7-35.5172.7-74.7176.1180-138.12.2112.9P78 L79 D86P78-R82 WeakPolarHBondContact O-CB 3.44Å; P78-R82 VanDerWaalsContact O-CG 3.24Å; P78-R82 WeakPolarHBondContact O-CG 3.32Å; P78-R82 PolarHBondContact O-N 3.01Å; L79-R82 PolarHBondContact O-N 3.48Å; R82-D86 VanDerWaalsContact O-CB 3.22Å; R82-D86 WeakPolarHBondContact O-CB 3.38Å
83F57.6Low61.8Low72 Ų7291 Ų9132%0.31648%0.48SS..Hα-helixtrans-87.9-45.2-178.5-74.4-59.7000113L79 M80 F94L79-F83 HydrophobicContact CD1-CE2 4.04Å; L79-F83 HydrophobicContact CD2-CD2 3.78Å; L79-F83 HydrophobicContact CD2-CE2 3.7Å; L79-F83 HydrophobicContact CG-CD2 3.69Å; L79-F83 HydrophobicContact CG-CE2 3.53Å; L79-F83 WeakPolarHBondContact O-CB 3.49Å; L79-F83 WeakPolarHBondContact O-CD2 3.47Å; L79-F83 PolarHBondContact O-N 3.44Å; M80-F83 PolarHBondContact O-N 3.49Å; F83-F94 WeakPolarHBondContact O-CB 3.28Å
84F56.5Low61.3Low47 Ų4788.7 Ų88.721%0.20646%0.463CS..THydrogen-bonded Turntrans-86-52.9178.4-65.2-104.6000111.1R25 I29 M80 D86R25-F84 VanDerWaalsContact NH1-C 3.27Å; R25-F84 PolarHBondContact NH1-O 3.42Å; R25-F84 PolarHBondContact NH2-O 3.02Å; I29-F84 HydrophobicContact CD1-CE1 3.52Å; I29-F84 HydrophobicContact CD1-CZ 3.49Å; I29-F84 VanDerWaalsContact CD1-CZ 3.49Å; M80-F84 HydrophobicContact CB-CD2 4.02Å; M80-F84 HydrophobicContact CB-CE2 4.48Å; M80-F84 HydrophobicContact CE-CD2 3.63Å; M80-F84 HydrophobicContact CE-CE1 4.24Å; M80-F84 HydrophobicContact CE-CE2 3.08Å; M80-F84 HydrophobicContact CE-CG 4.42Å; M80-F84 HydrophobicContact CE-CZ 3.43Å; M80-F84 VanDerWaalsContact CE-CZ 3.43Å; M80-F84 VanDerWaalsContact O-CA 3.3Å; M80-F84 WeakPolarHBondContact O-CA 3.38Å; M80-F84 WeakPolarHBondContact O-CB 2.93Å; M80-F84 VanDerWaalsContact O-CD2 3.31Å; M80-F84 WeakPolarHBondContact O-CD2 3.39Å; M80-F84 PolarHBondContact O-N 3.47Å; M80-F84 HydrophobicContact SD-CD2 3.79Å; M80-F84 HydrophobicContact SD-CE2 3.26Å; M80-F84 WeakPolarHBondContact SD-CE2 3.23Å; M80-F84 HydrophobicContact SD-CZ 4.11Å; F84-D86 PolarHBondContact O-N 2.86Å
85L53.1Low60.8Low133 Ų13386.9 Ų86.970%0.69646%0.458SS*.SBendtrans-84.5-3.4-171-108.895.8000115.5A81 S87A81-L85 HydrophobicContact CB-CB 4.4Å; A81-L85 CarbonylContact O-C 3.44Å; A81-L85 VanDerWaalsContact O-C 3.31Å; A81-L85 WeakPolarHBondContact O-CA 3.35Å; A81-L85 WeakPolarHBondContact O-CB 3.34Å; A81-L85 PolarHBondContact O-N 2.85Å; L85-S87 PolarHBondContact O-N 2.85Å
86D54.3Low60.6Low51 Ų5183.6 Ų83.627%0.27344%0.439SS..  trans-72.280.9174.2-158.422.2000109.8A81 R82 F84 K88 S90A81-D86 PolarHBondContact O-N 3.48Å; A81-D86 VanDerWaalsContact O-N 3.14Å; R82-D86 VanDerWaalsContact O-CB 3.22Å; R82-D86 WeakPolarHBondContact O-CB 3.38Å; F84-D86 PolarHBondContact O-N 2.86Å; D86-K88 PolarHBondContact O-N 3.23Å; D86-K88 VanDerWaalsContact OD1-CB 3.23Å; D86-K88 WeakPolarHBondContact OD1-CB 3.49Å; D86-K88 WeakPolarHBondContact OD1-CG 3.18Å; D86-K88 PolarHBondContact OD1-N 2.79Å; D86-S90 PolarHBondContact OD2-OG 2.84Å
87S50.7Low60.4Low97 Ų9783.3 Ų83.368%0.67844%0.437SS*.  trans-69.5-8.9167.5-177.50000111L85 R89L85-S87 PolarHBondContact O-N 2.85Å; S87-R89 PolarHBondContact O-N 3.39Å; S87-R89 VanDerWaalsContact O-N 3.16Å
88K50.8Low60.6Low159 Ų15978.7 Ų78.769%0.69142%0.417SS*.SBendtrans-69.5119.4171.3-58.3-172.8177.6-176.50105.9D86 S90 S93D86-K88 PolarHBondContact O-N 3.23Å; D86-K88 VanDerWaalsContact OD1-CB 3.23Å; D86-K88 WeakPolarHBondContact OD1-CB 3.49Å; D86-K88 WeakPolarHBondContact OD1-CG 3.18Å; D86-K88 PolarHBondContact OD1-N 2.79Å; K88-S90 PolarHBondContact O-N 3.4Å; K88-S93 WeakPolarHBondContact O-CB 3.21Å; K88-S93 PolarHBondContact O-OG 3.46Å
89R49.8Very low60.8Low213 Ų21377.3 Ų77.380%0.80441%0.409SS*.  trans-63.550.7172.1-148.9179.1-163.9173.63.2110.3S87S87-R89 PolarHBondContact O-N 3.39Å; S87-R89 VanDerWaalsContact O-N 3.16Å
90S56.6Low61.3Low44 Ų4476.2 Ų76.231%0.30840%0.403SS..  trans-74.7141.7172.972.60000107.2D86 K88 G92 S93D86-S90 PolarHBondContact OD2-OG 2.84Å; K88-S90 PolarHBondContact O-N 3.4Å; S90-G92 PolarHBondContact O-N 2.89Å; S90-S93 VanDerWaalsContact O-CB 3.29Å; S90-S93 WeakPolarHBondContact O-CB 3.45Å; S90-S93 PolarHBondContact O-N 3.35Å; S90-S93 PolarHBondContact O-OG 2.84Å
91P52.3Low61.5Low123 Ų12372.8 Ų72.880%0.79939%0.386SS*.THydrogen-bonded Turntrans-57.8113.1176.122.2-31.2000109.1E96P91-E96 WeakPolarHBondContact CA-OE2 3.25Å
92G58.1Low61.9Low53 Ų5374.3 Ų74.355%0.54639%0.388SS..THydrogen-bonded Turntrans100.46.9-175.400000116.1S90 E96S90-G92 PolarHBondContact O-N 2.89Å; G92-E96 PolarHBondContact N-OE2 2.89Å
93S65.1Low62.5Low8 Ų872.8 Ų72.86%0.05639%0.389CS..  trans-70.8152.7172.664.10000111.9K88 S90 S95 E96 L97K88-S93 WeakPolarHBondContact O-CB 3.21Å; K88-S93 PolarHBondContact O-OG 3.46Å; S90-S93 VanDerWaalsContact O-CB 3.29Å; S90-S93 WeakPolarHBondContact O-CB 3.45Å; S90-S93 PolarHBondContact O-N 3.35Å; S90-S93 PolarHBondContact O-OG 2.84Å; S93-S95 PolarHBondContact O-N 3.3Å; S93-E96 WeakPolarHBondContact O-CB 3.41Å; S93-E96 PolarHBondContact O-N 3.41Å; S93-E96 VanDerWaalsContact O-N 3.14Å; S93-E96 PolarHBondContact OG-N 3.34Å; S93-L97 PolarHBondContact O-N 3.42Å; S93-L97 VanDerWaalsContact O-N 3.07Å
94F65.8Low63.2Low13 Ų1375 Ų756%0.05741%0.405CS..Hα-helixtrans-64.1-29.5178.1-168.8-84.5000112.4R25 T28 I29 F83 E96 L97 V98R25-F94 HydrophobicContact CB-CE1 3.64Å; R25-F94 HydrophobicContact CB-CZ 4.11Å; R25-F94 HydrophobicContact CG-CD1 4.15Å; R25-F94 HydrophobicContact CG-CE1 3.55Å; R25-F94 HydrophobicContact CG-CZ 4.48Å; R25-F94 WeakPolarHBondContact O-CZ 3.23Å; T28-F94 HydrophobicContact CG2-CE2 4.19Å; T28-F94 HydrophobicContact CG2-CZ 3.93Å; I29-F94 HydrophobicContact CD1-CE2 4.39Å; I29-F94 HydrophobicContact CD1-CZ 4.21Å; I29-F94 HydrophobicContact CG1-CE2 3.84Å; I29-F94 HydrophobicContact CG1-CZ 3.81Å; F83-F94 WeakPolarHBondContact O-CB 3.28Å; F94-E96 VanDerWaalsContact C-N 3.33Å; F94-L97 HydrophobicContact CD2-CD2 4.46Å; F94-L97 WeakPolarHBondContact O-CB 3.33Å; F94-L97 PolarHBondContact O-N 3.36Å; F94-V98 HydrophobicContact CD1-CG2 3.59Å; F94-V98 HydrophobicContact CE1-CG2 3.34Å; F94-V98 HydrophobicContact CZ-CG2 4.27Å; F94-V98 WeakPolarHBondContact O-CG2 3.46Å; F94-V98 PolarHBondContact O-N 3.29Å
95S69Low63.7Low47 Ų4775.7 Ų75.733%0.32943%0.425SS..Hα-helixtrans-65-38174.4-171.20000112.2S93 S99S93-S95 PolarHBondContact O-N 3.3Å; S95-S99 PolarHBondContact O-N 2.71Å; S95-S99 VanDerWaalsContact O-N 3.11Å; S95-S99 PolarHBondContact O-OG 2.91Å
96E72Confident64.3Low59 Ų5970.7 Ų70.728%0.27640%0.401SS..Hα-helixtrans-68.6-43.9174.7-174.5-176.7-165.500110.5P91 G92 S93 F94 V98 S99 I100P91-E96 WeakPolarHBondContact CA-OE2 3.25Å; G92-E96 PolarHBondContact N-OE2 2.89Å; S93-E96 WeakPolarHBondContact O-CB 3.41Å; S93-E96 PolarHBondContact O-N 3.41Å; S93-E96 VanDerWaalsContact O-N 3.14Å; S93-E96 PolarHBondContact OG-N 3.34Å; F94-E96 VanDerWaalsContact C-N 3.33Å; E96-V98 PolarHBondContact O-N 2.91Å; E96-S99 WeakPolarHBondContact CA-OG 3.27Å; E96-S99 CarbonylContact O-C 3.59Å; E96-S99 PolarHBondContact O-N 3.36Å; E96-S99 VanDerWaalsContact O-N 3.09Å; E96-S99 PolarHBondContact O-OG 3.45Å; E96-I100 HydrophobicContact CG-CD1 3.8Å; E96-I100 HydrophobicContact CG-CG1 4.31Å; E96-I100 WeakPolarHBondContact O-CG1 3.34Å; E96-I100 PolarHBondContact O-N 3.43Å
97L68.5Low64.9Low39 Ų3968.5 Ų68.520%0.20439%0.39CS..Hα-helixtrans-53.5-54.1174.3-165.681.9000110.5T28 E33 S93 F94 S99 I100 C101T28-L97 HydrophobicContact CG2-CD2 3.44Å; T28-L97 VanDerWaalsContact CG2-CD2 3.44Å; T28-L97 HydrophobicContact CG2-CG 4.08Å; E33-L97 VanDerWaalsContact CD-CD1 3.5Å; E33-L97 HydrophobicContact CG-CD1 4.1Å; E33-L97 WeakPolarHBondContact OE1-CD1 3.21Å; S93-L97 PolarHBondContact O-N 3.42Å; S93-L97 VanDerWaalsContact O-N 3.07Å; F94-L97 HydrophobicContact CD2-CD2 4.46Å; F94-L97 WeakPolarHBondContact O-CB 3.33Å; F94-L97 PolarHBondContact O-N 3.36Å; L97-S99 VanDerWaalsContact C-N 3.25Å; L97-S99 PolarHBondContact O-N 3.03Å; L97-I100 PolarHBondContact O-N 2.85Å; L97-C101 PolarHBondContact O-N 2.68Å; L97-C101 PolarHBondContact O-SG 3.41Å
98V73.4Confident65.7Low18 Ų1867.9 Ų67.911%0.10938%0.377CS..Hα-helixtrans-55-42177.5175.70000111.3L24 T28 F94 E96 C101 L102L24-V98 HydrophobicContact CB-CG1 4.23Å; T28-V98 HydrophobicContact CG2-CG2 4.43Å; T28-V98 WeakPolarHBondContact OG1-CG2 3.47Å; F94-V98 HydrophobicContact CD1-CG2 3.59Å; F94-V98 HydrophobicContact CE1-CG2 3.34Å; F94-V98 HydrophobicContact CZ-CG2 4.27Å; F94-V98 WeakPolarHBondContact O-CG2 3.46Å; F94-V98 PolarHBondContact O-N 3.29Å; E96-V98 PolarHBondContact O-N 2.91Å; V98-C101 PolarHBondContact O-N 2.89Å; V98-L102 VanDerWaalsContact O-CB 3.26Å; V98-L102 WeakPolarHBondContact O-CB 3.46Å; V98-L102 PolarHBondContact O-N 2.94Å
99S72.1Confident66.8Low48 Ų4861.9 Ų61.934%0.33636%0.355SS..Hα-helixtrans-67.6-39177.264.70000113.3S95 E96 L97 L102 E103S95-S99 PolarHBondContact O-N 2.71Å; S95-S99 VanDerWaalsContact O-N 3.11Å; S95-S99 PolarHBondContact O-OG 2.91Å; E96-S99 WeakPolarHBondContact CA-OG 3.27Å; E96-S99 CarbonylContact O-C 3.59Å; E96-S99 PolarHBondContact O-N 3.36Å; E96-S99 VanDerWaalsContact O-N 3.09Å; E96-S99 PolarHBondContact O-OG 3.45Å; L97-S99 VanDerWaalsContact C-N 3.25Å; L97-S99 PolarHBondContact O-N 3.03Å; S99-L102 PolarHBondContact O-N 3.33Å; S99-E103 WeakPolarHBondContact O-CB 3.36Å; S99-E103 PolarHBondContact O-N 3.14Å
100I71.1Confident67.8Low64 Ų6452 Ų5233%0.32832%0.318SS..Hα-helixtrans-66.1-43.7175.8-69.8168.4000109.9E96 L97 L102 E103 N104E96-I100 HydrophobicContact CG-CD1 3.8Å; E96-I100 HydrophobicContact CG-CG1 4.31Å; E96-I100 WeakPolarHBondContact O-CG1 3.34Å; E96-I100 PolarHBondContact O-N 3.43Å; L97-I100 PolarHBondContact O-N 2.85Å; I100-L102 VanDerWaalsContact C-N 3.32Å; I100-L102 PolarHBondContact O-N 3.49Å; I100-E103 PolarHBondContact O-N 3.37Å; I100-N104 WeakPolarHBondContact CG2-ND2 3.42Å; I100-N104 VanDerWaalsContact O-CB 3.22Å; I100-N104 WeakPolarHBondContact O-CB 3.48Å; I100-N104 PolarHBondContact O-N 3.37Å; I100-N104 PolarHBondContact O-ND2 2.9Å
101C68.3Low68.7Low0 Ų052.9 Ų52.90%032%0.322CS..Hα-helixtrans-65.8-37.4177.7-45.40000111.9E33 L97 V98 G105 S106 I107E33-C101 PolarHBondContact OE2-SG 3.16Å; L97-C101 PolarHBondContact O-N 2.68Å; L97-C101 PolarHBondContact O-SG 3.41Å; V98-C101 PolarHBondContact O-N 2.89Å; C101-G105 PolarHBondContact O-N 3.27Å; C101-S106 WeakPolarHBondContact O-CA 3.48Å; C101-S106 WeakPolarHBondContact O-CB 3.47Å; C101-S106 PolarHBondContact O-N 2.74Å; C101-I107 HydrophobicContact CB-CB 3.98Å; C101-I107 HydrophobicContact CB-CD1 3.26Å; C101-I107 HydrophobicContact CB-CG1 3.46Å; C101-I107 VanDerWaalsContact CB-CG1 3.46Å; C101-I107 PolarHBondContact O-N 3.08Å; C101-I107 VanDerWaalsContact O-N 3.1Å
102L74.1Confident69.9Low74 Ų7451 Ų5139%0.38731%0.305SS..Hα-helixtrans-66.3-43.4176.6-174.166.4000110.7V98 S99 I100 G105V98-L102 VanDerWaalsContact O-CB 3.26Å; V98-L102 WeakPolarHBondContact O-CB 3.46Å; V98-L102 PolarHBondContact O-N 2.94Å; S99-L102 PolarHBondContact O-N 3.33Å; I100-L102 VanDerWaalsContact C-N 3.32Å; I100-L102 PolarHBondContact O-N 3.49Å; L102-G105 PolarHBondContact O-N 2.99Å
103E74.1Confident70.8Confident166 Ų16649.9 Ų49.978%0.77629%0.286SS*.Hα-helixtrans-66.4-41.2176.4-176175.3-17600112.3S99 I100 G105S99-E103 WeakPolarHBondContact O-CB 3.36Å; S99-E103 PolarHBondContact O-N 3.14Å; I100-E103 PolarHBondContact O-N 3.37Å; E103-G105 PolarHBondContact O-N 3.48Å; E103-G105 VanDerWaalsContact O-N 3.1Å
104N71.5Confident71.5Confident119 Ų11949.5 Ų49.564%0.63628%0.284SS*.THydrogen-bonded Turntrans-68.6-4.6176.3-72.2-19.3000113.2I100 S106I100-N104 WeakPolarHBondContact CG2-ND2 3.42Å; I100-N104 VanDerWaalsContact O-CB 3.22Å; I100-N104 WeakPolarHBondContact O-CB 3.48Å; I100-N104 PolarHBondContact O-N 3.37Å; I100-N104 PolarHBondContact O-ND2 2.9Å; N104-S106 PolarHBondContact O-N 3.33Å
105G68.1Low72.1Confident62 Ų6253.6 Ų53.664%0.63930%0.303SS*.THydrogen-bonded Turntrans6417.2-172.400000113.4C101 L102 E103C101-G105 PolarHBondContact O-N 3.27Å; L102-G105 PolarHBondContact O-N 2.99Å; E103-G105 PolarHBondContact O-N 3.48Å; E103-G105 VanDerWaalsContact O-N 3.1Å
106S64.8Low72.6Confident28 Ų2859 Ų5920%0.19632%0.316CS..  trans-75.8-34.8178.9164.30000111.2L31 C101 N104 H181L31-S106 WeakPolarHBondContact CD2-OG 3.28Å; C101-S106 WeakPolarHBondContact O-CA 3.48Å; C101-S106 WeakPolarHBondContact O-CB 3.47Å; C101-S106 PolarHBondContact O-N 2.74Å; N104-S106 PolarHBondContact O-N 3.33Å; S106-H181 PolarHBondContact OG-CE1 3.35Å; S106-H181 PolarHBondContact OG-ND1 2.78Å; S106-H181 VanDerWaalsContact OG-ND1 3.13Å
107I67.8Low73Confident5 Ų558.7 Ų58.73%0.02632%0.316CS..SBendtrans-109.1137.1176.1-70.5-179.8000109.1L24 Q27 T28 L31 C101L24-I107 HydrophobicContact CD2-CG2 3.86Å; Q27-I107 HydrophobicContact CG-CG1 4.32Å; Q27-I107 HydrophobicContact CG-CG2 4.18Å; T28-I107 HydrophobicContact CG2-CD1 4.12Å; T28-I107 WeakPolarHBondContact OG1-CD1 3.27Å; L31-I107 HydrophobicContact CD1-CG1 4.15Å; L31-I107 HydrophobicContact CD2-CG1 3.93Å; C101-I107 HydrophobicContact CB-CB 3.98Å; C101-I107 HydrophobicContact CB-CD1 3.26Å; C101-I107 HydrophobicContact CB-CG1 3.46Å; C101-I107 VanDerWaalsContact CB-CG1 3.46Å; C101-I107 PolarHBondContact O-N 3.08Å; C101-I107 VanDerWaalsContact O-N 3.1Å
108M66.9Low73.6Confident83 Ų8356.9 Ų56.941%0.40931%0.306SS..  trans-72.8124.7178-163.366.888.900108.7D112 L113M108-D112 HydrophobicContact CG-CB 3.51Å; M108-D112 HydrophobicContact SD-CB 3.24Å; M108-D112 WeakPolarHBondContact SD-CB 3.23Å; M108-L113 HydrophobicContact CB-CB 4.44Å; M108-L113 HydrophobicContact CG-CB 3.99Å
109S72.9Confident74Confident34 Ų3458 Ų5824%0.23832%0.315CS..  trans-56.6152.5172.4179.50000109.8T111 D112 L113S109-T111 PolarHBondContact O-N 3.16Å; S109-D112 WeakPolarHBondContact CB-OD2 3.19Å; S109-D112 PolarHBondContact O-N 3.34Å; S109-L113 WeakPolarHBondContact O-CB 3.46Å; S109-L113 PolarHBondContact O-N 3.49Å
110T72.5Confident74.5Confident5 Ų563.1 Ų63.13%0.03133%0.328CS..Hα-helixtrans-55.4-35.5176.944.20000112.5I16 E20 L24 S114I16-T110 HydrophobicContact CG2-CG2 4.39Å; E20-T110 HydrophobicContact CB-CG2 3.72Å; E20-T110 HydrophobicContact CG-CG2 3.38Å; E20-T110 WeakPolarHBondContact OE1-CB 3.42Å; E20-T110 WeakPolarHBondContact OE1-CG2 3.15Å; E20-T110 PolarHBondContact OE1-OG1 3.48Å; L24-T110 HydrophobicContact CD1-CG2 4.32Å; L24-T110 HydrophobicContact CD2-CG2 4.3Å; L24-T110 HydrophobicContact CG-CG2 4.18Å; T110-S114 WeakPolarHBondContact O-CB 3.4Å; T110-S114 PolarHBondContact O-N 2.86Å; T110-S114 PolarHBondContact O-OG 3.37Å
111T75.3Confident75.2Confident62 Ų6263.9 Ų63.938%0.3833%0.332SS..Hα-helixtrans-62.3-48.4172.4-50.80000111.6F9 S109 L113 S114 H115F9-T111 HydrophobicContact CZ-CG2 4.33Å; S109-T111 PolarHBondContact O-N 3.16Å; T111-L113 PolarHBondContact O-N 2.85Å; T111-S114 PolarHBondContact O-N 3.3Å; T111-S114 PolarHBondContact O-OG 3.35Å; T111-H115 PolarHBondContact O-N 2.91Å
112D77.7Confident75.9Confident84 Ų8468.8 Ų68.845%0.44935%0.352SS..Hα-helixtrans-69.8-36.2-177.8-57.4-32.7000111.6M108 S109 H115 W116M108-D112 HydrophobicContact CG-CB 3.51Å; M108-D112 HydrophobicContact SD-CB 3.24Å; M108-D112 WeakPolarHBondContact SD-CB 3.23Å; S109-D112 WeakPolarHBondContact CB-OD2 3.19Å; S109-D112 PolarHBondContact O-N 3.34Å; D112-H115 PolarHBondContact O-N 3.5Å; D112-W116 WeakPolarHBondContact O-CB 3.28Å; D112-W116 PolarHBondContact O-N 2.73Å
113L76.6Confident76.3Confident29 Ų2968 Ų6815%0.15235%0.352CS..Hα-helixtrans-63.9-44174.3-174.1153.1000110.2I16 I23 M108 S109 T111 H115 W116 I117I16-L113 HydrophobicContact CD1-CD2 3.69Å; I16-L113 HydrophobicContact CG1-CD2 4.33Å; I16-L113 HydrophobicContact CG2-CD2 4.16Å; I23-L113 HydrophobicContact CG2-CD1 3.83Å; M108-L113 HydrophobicContact CB-CB 4.44Å; M108-L113 HydrophobicContact CG-CB 3.99Å; S109-L113 WeakPolarHBondContact O-CB 3.46Å; S109-L113 PolarHBondContact O-N 3.49Å; T111-L113 PolarHBondContact O-N 2.85Å; L113-H115 VanDerWaalsContact C-N 3.31Å; L113-H115 PolarHBondContact O-N 2.76Å; L113-W116 PolarHBondContact O-N 3.27Å; L113-I117 HydrophobicContact CD2-CD1 3.39Å; L113-I117 HydrophobicContact CD2-CG1 4.15Å; L113-I117 HydrophobicContact CG-CD1 4.33Å; L113-I117 WeakPolarHBondContact O-CG1 3.25Å; L113-I117 PolarHBondContact O-N 2.86Å
114S78.7Confident76.8Confident0 Ų062.1 Ų62.10%033%0.332CS..Hα-helixtrans-63.5-37.7175.571.30000112.3F9 T110 T111 S118F9-S114 WeakPolarHBondContact CE2-OG 3.37Å; T110-S114 WeakPolarHBondContact O-CB 3.4Å; T110-S114 PolarHBondContact O-N 2.86Å; T110-S114 PolarHBondContact O-OG 3.37Å; T111-S114 PolarHBondContact O-N 3.3Å; T111-S114 PolarHBondContact O-OG 3.35Å; S114-S118 VanDerWaalsContact O-CB 3.25Å; S114-S118 WeakPolarHBondContact O-CB 3.16Å; S114-S118 PolarHBondContact O-N 3.16Å; S114-S118 PolarHBondContact O-OG 3.39Å
115H78.1Confident77.5Confident100 Ų10059.8 Ų59.846%0.46332%0.319SS..Hα-helixtrans-66.5-40.2175.2-172.3-80.2000111.7F9 T111 D112 L113 S118 S119F9-H115 HydrophobicContact CE2-CB 4.1Å; T111-H115 PolarHBondContact O-N 2.91Å; D112-H115 PolarHBondContact O-N 3.5Å; L113-H115 VanDerWaalsContact C-N 3.31Å; L113-H115 PolarHBondContact O-N 2.76Å; H115-S118 WeakPolarHBondContact CA-OG 3.2Å; H115-S118 PolarHBondContact O-OG 3.09Å; H115-S119 VanDerWaalsContact O-CB 3.24Å; H115-S119 WeakPolarHBondContact O-CB 3.22Å; H115-S119 PolarHBondContact O-N 2.82Å; H115-S119 PolarHBondContact O-OG 3.33Å
116W79.7Confident78.4Confident159 Ų15959.6 Ų59.660%0.60230%0.304SS*.Hα-helixtrans-66.5-46.5177.1-173.580000111.8D112 L113 S119 Y120D112-W116 WeakPolarHBondContact O-CB 3.28Å; D112-W116 PolarHBondContact O-N 2.73Å; L113-W116 PolarHBondContact O-N 3.27Å; W116-S119 PolarHBondContact O-N 3.26Å; W116-Y120 WeakPolarHBondContact O-CB 3.47Å; W116-Y120 PolarHBondContact O-N 2.78Å
117I81.5Confident79.3Confident53 Ų5362.9 Ų62.927%0.27232%0.318SS..Hα-helixtrans-63.6-44.7176.4-67.5-179.3000110.8V12 I16 L113 S119 Y120 L121V12-I117 HydrophobicContact CG1-CB 4.16Å; V12-I117 HydrophobicContact CG1-CG2 3.82Å; I16-I117 HydrophobicContact CD1-CD1 4Å; L113-I117 HydrophobicContact CD2-CD1 3.39Å; L113-I117 HydrophobicContact CD2-CG1 4.15Å; L113-I117 HydrophobicContact CG-CD1 4.33Å; L113-I117 WeakPolarHBondContact O-CG1 3.25Å; L113-I117 PolarHBondContact O-N 2.86Å; I117-S119 VanDerWaalsContact C-N 3.31Å; I117-S119 PolarHBondContact O-N 3.5Å; I117-Y120 PolarHBondContact O-N 3.17Å; I117-L121 HydrophobicContact CG2-CD1 3.83Å; I117-L121 HydrophobicContact CG2-CG 4.22Å; I117-L121 WeakPolarHBondContact O-CB 3.21Å; I117-L121 WeakPolarHBondContact O-CG 2.92Å; I117-L121 PolarHBondContact O-N 2.98Å
118S80.7Confident80.1Confident1 Ų165.1 Ų65.11%0.00734%0.338CS..Hα-helixtrans-62.3-40.817871.20000111.4S114 H115 L121 Y122S114-S118 VanDerWaalsContact O-CB 3.25Å; S114-S118 WeakPolarHBondContact O-CB 3.16Å; S114-S118 PolarHBondContact O-N 3.16Å; S114-S118 PolarHBondContact O-OG 3.39Å; H115-S118 WeakPolarHBondContact CA-OG 3.2Å; H115-S118 PolarHBondContact O-OG 3.09Å; S118-L121 PolarHBondContact O-N 2.84Å; S118-Y122 WeakPolarHBondContact O-CB 3.47Å; S118-Y122 PolarHBondContact O-N 3.24Å
119S82.1Confident80.9Confident42 Ų4265.8 Ų65.829%0.29434%0.342SS..Hα-helixtrans-63.8-42.1175.9-61.20000111.8H115 W116 I117 S123H115-S119 VanDerWaalsContact O-CB 3.24Å; H115-S119 WeakPolarHBondContact O-CB 3.22Å; H115-S119 PolarHBondContact O-N 2.82Å; H115-S119 PolarHBondContact O-OG 3.33Å; W116-S119 PolarHBondContact O-N 3.26Å; I117-S119 VanDerWaalsContact C-N 3.31Å; I117-S119 PolarHBondContact O-N 3.5Å; S119-S123 VanDerWaalsContact O-CB 3.28Å; S119-S123 WeakPolarHBondContact O-CB 3.36Å; S119-S123 PolarHBondContact O-N 3.44Å
120Y82.7Confident81.3Confident156 Ų15671 Ų7161%0.61236%0.361SS*.Hα-helixtrans-64.5-48.3176.8-178.9-95.6000111.7W116 I117 Y122 S123 A124W116-Y120 WeakPolarHBondContact O-CB 3.47Å; W116-Y120 PolarHBondContact O-N 2.78Å; I117-Y120 PolarHBondContact O-N 3.17Å; Y120-Y122 PolarHBondContact O-N 2.91Å; Y120-S123 PolarHBondContact O-N 2.88Å; Y120-A124 WeakPolarHBondContact O-CB 3.25Å; Y120-A124 PolarHBondContact O-N 3.34Å
121L84.9Confident81.6Confident79 Ų7974.9 Ų74.941%0.41438%0.381SS..Hα-helixtrans-62.8-42.1177.8-70.4175.2000111.8V12 I117 S118 A124 L125V12-L121 HydrophobicContact CG2-CD1 3.96Å; I117-L121 HydrophobicContact CG2-CD1 3.83Å; I117-L121 HydrophobicContact CG2-CG 4.22Å; I117-L121 WeakPolarHBondContact O-CB 3.21Å; I117-L121 WeakPolarHBondContact O-CG 2.92Å; I117-L121 PolarHBondContact O-N 2.98Å; S118-L121 PolarHBondContact O-N 2.84Å; L121-A124 PolarHBondContact O-N 3.49Å; L121-L125 VanDerWaalsContact O-CB 3.29Å; L121-L125 WeakPolarHBondContact O-CB 3.33Å; L121-L125 PolarHBondContact O-N 2.88Å
122Y82.8Confident81.7Confident104 Ų10474.8 Ų74.841%0.40839%0.387SS..Hα-helixtrans-63.9-42.3175.4-178.2-98000111.6H5 S118 Y120 L125 N126H5-Y122 AromaticContact CD2-CG 3.76Å; S118-Y122 WeakPolarHBondContact O-CB 3.47Å; S118-Y122 PolarHBondContact O-N 3.24Å; Y120-Y122 PolarHBondContact O-N 2.91Å; Y122-L125 PolarHBondContact O-N 3.3Å; Y122-N126 WeakPolarHBondContact O-CB 3.1Å; Y122-N126 PolarHBondContact O-N 3.35Å
123S83.8Confident81.6Confident57 Ų5773.9 Ų73.940%0.39939%0.385SS..Hα-helixtrans-62.2-46.3175.1-172.70000111.5S119 Y120 L125 N126 I127S119-S123 VanDerWaalsContact O-CB 3.28Å; S119-S123 WeakPolarHBondContact O-CB 3.36Å; S119-S123 PolarHBondContact O-N 3.44Å; Y120-S123 PolarHBondContact O-N 2.88Å; S123-L125 PolarHBondContact O-N 3.32Å; S123-N126 PolarHBondContact O-N 3.36Å; S123-I127 VanDerWaalsContact O-CG1 3.25Å; S123-I127 WeakPolarHBondContact O-CG1 3.45Å; S123-I127 PolarHBondContact O-N 3.42Å
124A83.7Confident81.2Confident43 Ų4374.4 Ų74.436%0.35539%0.391SS..Hα-helixtrans-60.4-44.3176.200000111.7Y120 L121 I127 A128Y120-A124 WeakPolarHBondContact O-CB 3.25Å; Y120-A124 PolarHBondContact O-N 3.34Å; L121-A124 PolarHBondContact O-N 3.49Å; A124-I127 PolarHBondContact O-N 2.92Å; A124-A128 WeakPolarHBondContact O-CB 3.35Å; A124-A128 PolarHBondContact O-N 3.25Å
125L86Confident80.8Confident69 Ų6979.7 Ų79.736%0.36142%0.416SS..Hα-helixtrans-65.8-39.9176.2-174.365.6000111.7F8 L121 Y122 S123 A128 N129F8-L125 HydrophobicContact CE2-CD2 4.06Å; F8-L125 HydrophobicContact CZ-CD2 3.97Å; L121-L125 VanDerWaalsContact O-CB 3.29Å; L121-L125 WeakPolarHBondContact O-CB 3.33Å; L121-L125 PolarHBondContact O-N 2.88Å; Y122-L125 PolarHBondContact O-N 3.3Å; S123-L125 PolarHBondContact O-N 3.32Å; L125-A128 PolarHBondContact O-N 2.86Å; L125-N129 VanDerWaalsContact O-CB 3.28Å; L125-N129 WeakPolarHBondContact O-CB 3.24Å; L125-N129 PolarHBondContact O-N 3.17Å; L125-N129 PolarHBondContact O-ND2 2.98Å
126N86.6Confident80.8Confident59 Ų5985.3 Ų85.332%0.31643%0.433SS..Hα-helixtrans-64.8-40.5175.8179.355.5000111.5Y122 S123 N129 K130Y122-N126 WeakPolarHBondContact O-CB 3.1Å; Y122-N126 PolarHBondContact O-N 3.35Å; S123-N126 PolarHBondContact O-N 3.36Å; N126-N129 PolarHBondContact O-N 2.8Å; N126-K130 WeakPolarHBondContact O-CB 3.15Å; N126-K130 VanDerWaalsContact O-CG 3.28Å; N126-K130 WeakPolarHBondContact O-CG 3.49Å; N126-K130 PolarHBondContact O-N 2.87Å
127I84.4Confident80.7Confident97 Ų9783 Ų8350%0.49743%0.433SS..Hα-helixtrans-62.8-47.6173.3-67.8161.8000109.8S123 A124 N129 K130 L131S123-I127 VanDerWaalsContact O-CG1 3.25Å; S123-I127 WeakPolarHBondContact O-CG1 3.45Å; S123-I127 PolarHBondContact O-N 3.42Å; A124-I127 PolarHBondContact O-N 2.92Å; I127-N129 VanDerWaalsContact C-N 3.33Å; I127-N129 PolarHBondContact O-N 2.97Å; I127-K130 PolarHBondContact O-N 3.23Å; I127-K130 VanDerWaalsContact O-N 3.16Å; I127-L131 WeakPolarHBondContact O-CB 3.47Å; I127-L131 PolarHBondContact O-N 3.39Å
128A83.8Confident80.6Confident52 Ų5286.1 Ų86.143%0.4345%0.446SS..Hα-helixtrans-59.4-43.3176.600000112.1A124 L125 K130 L131 A132A124-A128 WeakPolarHBondContact O-CB 3.35Å; A124-A128 PolarHBondContact O-N 3.25Å; L125-A128 PolarHBondContact O-N 2.86Å; A128-K130 VanDerWaalsContact C-N 3.33Å; A128-K130 PolarHBondContact O-N 2.88Å; A128-L131 WeakPolarHBondContact O-CB 3.46Å; A128-L131 PolarHBondContact O-N 3.41Å; A128-L131 VanDerWaalsContact O-N 3.14Å; A128-A132 PolarHBondContact O-N 3.33Å
129N84.5Confident80.8Confident96 Ų9689.7 Ų89.751%0.51347%0.468SS..Hα-helixtrans-68.1-30.1176.9-73.3-19000112.9L125 N126 I127 P133L125-N129 VanDerWaalsContact O-CB 3.28Å; L125-N129 WeakPolarHBondContact O-CB 3.24Å; L125-N129 PolarHBondContact O-N 3.17Å; L125-N129 PolarHBondContact O-ND2 2.98Å; N126-N129 PolarHBondContact O-N 2.8Å; I127-N129 VanDerWaalsContact C-N 3.33Å; I127-N129 PolarHBondContact O-N 2.97Å; N129-P133 WeakPolarHBondContact O-CD 3.5Å
130K81.1Confident80.8Confident143 Ų14393.9 Ų93.962%0.62249%0.487SS*.Hα-helixtrans-74.8-30.1170.9-75.6-178.7177.7-165.50112N126 I127 A128N126-K130 WeakPolarHBondContact O-CB 3.15Å; N126-K130 VanDerWaalsContact O-CG 3.28Å; N126-K130 WeakPolarHBondContact O-CG 3.49Å; N126-K130 PolarHBondContact O-N 2.87Å; I127-K130 PolarHBondContact O-N 3.23Å; I127-K130 VanDerWaalsContact O-N 3.16Å; A128-K130 VanDerWaalsContact C-N 3.33Å; A128-K130 PolarHBondContact O-N 2.88Å
131L78.5Confident80.8Confident87 Ų8789.4 Ų89.446%0.45548%0.478SS..Hα-helixtrans-75-30.1176.8-13267.4000112.4I127 A128 C134 H135 F142I127-L131 WeakPolarHBondContact O-CB 3.47Å; I127-L131 PolarHBondContact O-N 3.39Å; A128-L131 WeakPolarHBondContact O-CB 3.46Å; A128-L131 PolarHBondContact O-N 3.41Å; A128-L131 VanDerWaalsContact O-N 3.14Å; L131-C134 VanDerWaalsContact O-CB 3.27Å; L131-C134 WeakPolarHBondContact O-CB 3.37Å; L131-C134 PolarHBondContact O-N 2.96Å; L131-C134 VanDerWaalsContact O-N 3.08Å; L131-H135 PolarHBondContact O-N 3.38Å; L131-F142 HydrophobicContact CD2-CE2 3.8Å; L131-F142 HydrophobicContact CG-CD2 4.26Å; L131-F142 HydrophobicContact CG-CE2 3.81Å
132A79Confident80.8Confident61 Ų6188.2 Ų88.250%0.50447%0.47SS..Hα-helixtrans-60.5-44.818000000113.7A128 H135A128-A132 PolarHBondContact O-N 3.33Å; A132-H135 WeakPolarHBondContact O-CB 3.42Å
133P74.8Confident80.9Confident64 Ų6489.5 Ų89.542%0.41648%0.478SS..Hα-helixtrans-69.8-30.1169.5-22.232.4000113.6N129 H135 R136 N137N129-P133 WeakPolarHBondContact O-CD 3.5Å; P133-H135 VanDerWaalsContact C-N 3.26Å; P133-H135 PolarHBondContact O-N 3.27Å; P133-R136 CarbonylContact O-C 3.58Å; P133-R136 WeakPolarHBondContact O-CA 3.31Å; P133-R136 PolarHBondContact O-N 2.93Å; P133-N137 PolarHBondContact O-N 3.46Å
134C67.5Low81.1Confident41 Ų4191.8 Ų91.828%0.27749%0.485SS..Hα-helixtrans-59.6-40.5177.2-170.60000111.1L131 R136 N137 H138L131-C134 VanDerWaalsContact O-CB 3.27Å; L131-C134 WeakPolarHBondContact O-CB 3.37Å; L131-C134 PolarHBondContact O-N 2.96Å; L131-C134 VanDerWaalsContact O-N 3.08Å; C134-R136 PolarHBondContact O-N 3.06Å; C134-N137 PolarHBondContact O-N 2.76Å; C134-H138 CarbonylContact O-C 3.47Å; C134-H138 PolarHBondContact O-N 3Å
135H71.6Confident81.3Confident111 Ų11194.4 Ų94.451%0.51449%0.491SS..Hα-helixtrans-55.9-35.8170.9177.9-97.2000112.9L131 A132 P133 P139 F142L131-H135 PolarHBondContact O-N 3.38Å; A132-H135 WeakPolarHBondContact O-CB 3.42Å; P133-H135 VanDerWaalsContact C-N 3.26Å; P133-H135 PolarHBondContact O-N 3.27Å; H135-P139 WeakPolarHBondContact O-CA 3.38Å; H135-F142 HydrophobicContact CB-CD1 4.32Å; H135-F142 HydrophobicContact CB-CG 4.35Å; H135-F142 AromaticContact CD2-CD1 3.62Å; H135-F142 AromaticContact CD2-CE1 3.71Å
136R76.6Confident81.4Confident217 Ų21793.1 Ų93.182%0.81949%0.489SS*.Hα-helixtrans-83.9-37.9-178.5-170.5171.4180167.50.5113.4P133 C134P133-R136 CarbonylContact O-C 3.58Å; P133-R136 WeakPolarHBondContact O-CA 3.31Å; P133-R136 PolarHBondContact O-N 2.93Å; C134-R136 PolarHBondContact O-N 3.06Å
137N78.2Confident81.5Confident112 Ų11292 Ų9260%0.59949%0.486SS*.Hα-helixtrans-85.5-34.8-173.8-64.9-5.9000112.5P133 C134P133-N137 PolarHBondContact O-N 3.46Å; C134-N137 PolarHBondContact O-N 2.76Å
138H80.4Confident81.8Confident118 Ų11890.9 Ų90.955%0.54649%0.486SS..  trans-137.368.7180-62.4-69.1000110.4C134 L140 S141 F142C134-H138 CarbonylContact O-C 3.47Å; C134-H138 PolarHBondContact O-N 3Å; H138-L140 VanDerWaalsContact C-N 3.27Å; H138-L140 PolarHBondContact O-N 2.96Å; H138-S141 PolarHBondContact O-N 3.4Å; H138-F142 PolarHBondContact O-N 3.23Å
139P83.1Confident82Confident75 Ų7593.5 Ų93.549%0.48749%0.492SS..Hα-helixtrans-58.3-38.6-175.522.8-33.4000112.3H135 F143H135-P139 WeakPolarHBondContact O-CA 3.38Å; P139-F143 VanDerWaalsContact O-CB 3.28Å; P139-F143 WeakPolarHBondContact O-CB 3.4Å; P139-F143 PolarHBondContact O-N 3.13Å
140L83.6Confident82.2Confident131 Ų13191.5 Ų91.569%0.68649%0.485SS*.Hα-helixtrans-66.6-45.9177.8-67.4179.2000112.6H138 F142 F143 I144H138-L140 VanDerWaalsContact C-N 3.27Å; H138-L140 PolarHBondContact O-N 2.96Å; L140-F142 VanDerWaalsContact C-N 3.33Å; L140-F142 PolarHBondContact O-N 3.24Å; L140-F143 PolarHBondContact O-N 3.38Å; L140-I144 VanDerWaalsContact O-CG1 3.3Å; L140-I144 WeakPolarHBondContact O-CG1 3.48Å; L140-I144 PolarHBondContact O-N 3.02Å
141S81.5Confident82.7Confident61 Ų6189 Ų8943%0.42748%0.478SS..Hα-helixtrans-63.7-41.3177.7-53.40000111.2H138 I144 I145H138-S141 PolarHBondContact O-N 3.4Å; S141-I144 PolarHBondContact O-N 2.81Å; S141-I145 WeakPolarHBondContact O-CB 3.3Å; S141-I145 WeakPolarHBondContact O-CD1 3.5Å; S141-I145 WeakPolarHBondContact O-CG1 3.42Å; S141-I145 PolarHBondContact O-N 3.39Å
142F84.6Confident83.1Confident55 Ų5586.7 Ų86.724%0.24148%0.475CS..Hα-helixtrans-63.1-42.9173.8179.3-92.8000111.9L131 H135 H138 L140 I145 S146L131-F142 HydrophobicContact CD2-CE2 3.8Å; L131-F142 HydrophobicContact CG-CD2 4.26Å; L131-F142 HydrophobicContact CG-CE2 3.81Å; H135-F142 HydrophobicContact CB-CD1 4.32Å; H135-F142 HydrophobicContact CB-CG 4.35Å; H135-F142 AromaticContact CD2-CD1 3.62Å; H135-F142 AromaticContact CD2-CE1 3.71Å; H138-F142 PolarHBondContact O-N 3.23Å; L140-F142 VanDerWaalsContact C-N 3.33Å; L140-F142 PolarHBondContact O-N 3.24Å; F142-I145 PolarHBondContact O-N 2.97Å; F142-S146 VanDerWaalsContact O-CB 3.23Å; F142-S146 WeakPolarHBondContact O-CB 3.4Å; F142-S146 PolarHBondContact O-N 3.46Å; F142-S146 PolarHBondContact O-OG 3.45Å
143F85.4Confident83.4Confident130 Ų13087.4 Ų87.457%0.5748%0.475SS*.Hα-helixtrans-61-48.1175.6178-101.6000111.7P139 L140 I145 S146 S147P139-F143 VanDerWaalsContact O-CB 3.28Å; P139-F143 WeakPolarHBondContact O-CB 3.4Å; P139-F143 PolarHBondContact O-N 3.13Å; L140-F143 PolarHBondContact O-N 3.38Å; F143-I145 PolarHBondContact O-N 3.35Å; F143-S146 WeakPolarHBondContact CA-OG 3.31Å; F143-S146 PolarHBondContact O-N 3.43Å; F143-S146 PolarHBondContact O-OG 3.24Å; F143-S147 WeakPolarHBondContact O-CB 3.28Å; F143-S147 PolarHBondContact O-N 2.86Å
144I89.3Confident83.9Confident106 Ų10688.8 Ų88.854%0.54448%0.478SS..Hα-helixtrans-62-44.9178.3-67.8167.3000110.7L140 S141 S148L140-I144 VanDerWaalsContact O-CG1 3.3Å; L140-I144 WeakPolarHBondContact O-CG1 3.48Å; L140-I144 PolarHBondContact O-N 3.02Å; S141-I144 PolarHBondContact O-N 2.81Å; I144-S148 WeakPolarHBondContact O-CB 3.39Å; I144-S148 PolarHBondContact O-N 3.3Å; I144-S148 PolarHBondContact O-OG 2.84Å
145I87.5Confident84.8Confident97 Ų9790 Ų9050%0.49748%0.484SS..Hα-helixtrans-64.6-49.7178.7-69164.9000110.7S141 F142 F143 S147 S148 I149S141-I145 WeakPolarHBondContact O-CB 3.3Å; S141-I145 WeakPolarHBondContact O-CD1 3.5Å; S141-I145 WeakPolarHBondContact O-CG1 3.42Å; S141-I145 PolarHBondContact O-N 3.39Å; F142-I145 PolarHBondContact O-N 2.97Å; F143-I145 PolarHBondContact O-N 3.35Å; I145-S147 PolarHBondContact O-N 2.85Å; I145-S148 PolarHBondContact O-N 3.34Å; I145-I149 HydrophobicContact CG2-CD1 3.77Å; I145-I149 VanDerWaalsContact O-CG1 3.24Å; I145-I149 WeakPolarHBondContact O-CG1 3.34Å; I145-I149 PolarHBondContact O-N 2.8Å
146S86.5Confident85.4Confident43 Ų4389 Ų8930%0.30148%0.482SS..Hα-helixtrans-64.4-39.9-179.262.30000112.3F142 F143 I149 S150F142-S146 VanDerWaalsContact O-CB 3.23Å; F142-S146 WeakPolarHBondContact O-CB 3.4Å; F142-S146 PolarHBondContact O-N 3.46Å; F142-S146 PolarHBondContact O-OG 3.45Å; F143-S146 WeakPolarHBondContact CA-OG 3.31Å; F143-S146 PolarHBondContact O-N 3.43Å; F143-S146 PolarHBondContact O-OG 3.24Å; S146-I149 PolarHBondContact O-N 2.79Å; S146-S150 WeakPolarHBondContact O-CB 3.34Å; S146-S150 PolarHBondContact O-N 2.78Å; S146-S150 PolarHBondContact O-OG 3.49Å
147S88.9Confident85.6Confident36 Ų3681.7 Ų81.725%0.25247%0.465SS..Hα-helixtrans-65.7-43.1173.3-175.70000111.7F143 I145 I149 S150 I151F143-S147 WeakPolarHBondContact O-CB 3.28Å; F143-S147 PolarHBondContact O-N 2.86Å; I145-S147 PolarHBondContact O-N 2.85Å; S147-I149 VanDerWaalsContact C-N 3.33Å; S147-I149 PolarHBondContact O-N 3.4Å; S147-S150 WeakPolarHBondContact CA-OG 3.46Å; S147-S150 PolarHBondContact O-N 2.92Å; S147-S150 PolarHBondContact O-OG 2.88Å; S147-I151 WeakPolarHBondContact O-CB 3.37Å; S147-I151 WeakPolarHBondContact O-CG1 3.3Å; S147-I151 PolarHBondContact O-N 2.83Å
148S91.1Very high85.7Confident72 Ų7283.7 Ų83.750%0.50347%0.472SS..Hα-helixtrans-62.6-41176-60.60000111.7I144 I145 G152I144-S148 WeakPolarHBondContact O-CB 3.39Å; I144-S148 PolarHBondContact O-N 3.3Å; I144-S148 PolarHBondContact O-OG 2.84Å; I145-S148 PolarHBondContact O-N 3.34Å; S148-G152 PolarHBondContact O-N 2.87Å
149I89.3Confident85.9Confident107 Ų10787.5 Ų87.555%0.54948%0.483SS..Hα-helixtrans-64.2-45.5174.7-68.5166.2000110.3I145 S146 S147 G152 C153I145-I149 HydrophobicContact CG2-CD1 3.77Å; I145-I149 VanDerWaalsContact O-CG1 3.24Å; I145-I149 WeakPolarHBondContact O-CG1 3.34Å; I145-I149 PolarHBondContact O-N 2.8Å; S146-I149 PolarHBondContact O-N 2.79Å; S147-I149 VanDerWaalsContact C-N 3.33Å; S147-I149 PolarHBondContact O-N 3.4Å; I149-G152 PolarHBondContact O-N 3.23Å; I149-C153 PolarHBondContact O-N 3.47Å; I149-C153 PolarHBondContact O-SG 3.28Å; I149-C153 VanDerWaalsContact O-SG 3.34Å
150S87.5Confident85.9Confident55 Ų5585.6 Ų85.639%0.38547%0.47SS..Hα-helixtrans-67-43.3-17972.50000112.1S146 S147 G152 C153 I154S146-S150 WeakPolarHBondContact O-CB 3.34Å; S146-S150 PolarHBondContact O-N 2.78Å; S146-S150 PolarHBondContact O-OG 3.49Å; S147-S150 WeakPolarHBondContact CA-OG 3.46Å; S147-S150 PolarHBondContact O-N 2.92Å; S147-S150 PolarHBondContact O-OG 2.88Å; S150-G152 VanDerWaalsContact C-N 3.32Å; S150-G152 PolarHBondContact O-N 2.93Å; S150-C153 WeakPolarHBondContact O-CB 3.43Å; S150-C153 PolarHBondContact O-N 3.24Å; S150-I154 VanDerWaalsContact O-CG1 3.29Å; S150-I154 WeakPolarHBondContact O-CG1 3.34Å; S150-I154 PolarHBondContact O-N 3.32Å
151I91.6Very high85.9Confident91 Ų9182.7 Ų82.747%0.46746%0.461SS..Hα-helixtrans-58.9-45.3172.1-67.9165.9000109.8S147 C153 I154 V155S147-I151 WeakPolarHBondContact O-CB 3.37Å; S147-I151 WeakPolarHBondContact O-CG1 3.3Å; S147-I151 PolarHBondContact O-N 2.83Å; I151-C153 VanDerWaalsContact C-N 3.33Å; I151-C153 PolarHBondContact O-N 2.8Å; I151-I154 PolarHBondContact O-N 3.29Å; I151-I154 VanDerWaalsContact O-N 3.16Å; I151-V155 HydrophobicContact CG2-CG2 4.25Å; I151-V155 WeakPolarHBondContact O-CB 3.25Å; I151-V155 VanDerWaalsContact O-CG2 3.31Å; I151-V155 WeakPolarHBondContact O-CG2 3.4Å; I151-V155 PolarHBondContact O-N 2.87Å
152G87.3Confident85.8Confident38 Ų3882.3 Ų82.339%0.39247%0.466SS..Hα-helixtrans-57.6-43.517500000112.8S148 I149 S150 L156S148-G152 PolarHBondContact O-N 2.87Å; I149-G152 PolarHBondContact O-N 3.23Å; S150-G152 VanDerWaalsContact C-N 3.32Å; S150-G152 PolarHBondContact O-N 2.93Å; G152-L156 VanDerWaalsContact O-CB 3.29Å; G152-L156 WeakPolarHBondContact O-CB 3.38Å; G152-L156 PolarHBondContact O-N 2.7Å
153C84.3Confident85.7Confident75 Ų7582.6 Ų82.651%0.50747%0.472SS..Hα-helixtrans-64.2-41.3174.2-70.90000112.6I149 S150 I151 L156 S157I149-C153 PolarHBondContact O-N 3.47Å; I149-C153 PolarHBondContact O-SG 3.28Å; I149-C153 VanDerWaalsContact O-SG 3.34Å; S150-C153 WeakPolarHBondContact O-CB 3.43Å; S150-C153 PolarHBondContact O-N 3.24Å; I151-C153 VanDerWaalsContact C-N 3.33Å; I151-C153 PolarHBondContact O-N 2.8Å; C153-L156 PolarHBondContact O-N 3.28Å; C153-S157 WeakPolarHBondContact O-CB 3.23Å; C153-S157 PolarHBondContact O-N 3.27Å; C153-S157 PolarHBondContact O-OG 2.66Å
154I85.4Confident85.5Confident94 Ų9479.6 Ų79.648%0.48247%0.465SS..Hα-helixtrans-62.9-51.3177.2-69.2163.9000109.8S150 I151 L156 S157 M158S150-I154 VanDerWaalsContact O-CG1 3.29Å; S150-I154 WeakPolarHBondContact O-CG1 3.34Å; S150-I154 PolarHBondContact O-N 3.32Å; I151-I154 PolarHBondContact O-N 3.29Å; I151-I154 VanDerWaalsContact O-N 3.16Å; I154-L156 VanDerWaalsContact C-N 3.31Å; I154-L156 PolarHBondContact O-N 3.48Å; I154-S157 WeakPolarHBondContact CA-OG 3.33Å; I154-S157 CarbonylContact O-C 3.55Å; I154-S157 WeakPolarHBondContact O-CA 3.38Å; I154-S157 PolarHBondContact O-N 3.28Å; I154-S157 PolarHBondContact O-OG 2.93Å; I154-M158 HydrophobicContact CG2-SD 4.45Å; I154-M158 WeakPolarHBondContact O-CG 3.26Å; I154-M158 PolarHBondContact O-N 3.18Å
155V86.7Confident85.3Confident67 Ų6778.6 Ų78.641%0.40646%0.46SS..Hα-helixtrans-57.3-46.1177.91730000110.3I151 S157 M158 Y159I151-V155 HydrophobicContact CG2-CG2 4.25Å; I151-V155 WeakPolarHBondContact O-CB 3.25Å; I151-V155 VanDerWaalsContact O-CG2 3.31Å; I151-V155 WeakPolarHBondContact O-CG2 3.4Å; I151-V155 PolarHBondContact O-N 2.87Å; V155-S157 VanDerWaalsContact C-N 3.3Å; V155-S157 PolarHBondContact O-N 3.45Å; V155-M158 WeakPolarHBondContact O-CB 3.29Å; V155-M158 PolarHBondContact O-N 2.73Å; V155-M158 VanDerWaalsContact O-N 3.14Å; V155-Y159 HydrophobicContact CG1-CD2 3.93Å; V155-Y159 HydrophobicContact CG1-CE2 3.59Å; V155-Y159 WeakPolarHBondContact O-CD2 3.37Å; V155-Y159 PolarHBondContact O-N 2.9Å
156L84.6Confident85.2Confident88 Ų8876.1 Ų76.146%0.46145%0.454SS..Hα-helixtrans-58.7-41.4175.3-176.862.5000112.1G152 C153 I154 M158 Y159 V160G152-L156 VanDerWaalsContact O-CB 3.29Å; G152-L156 WeakPolarHBondContact O-CB 3.38Å; G152-L156 PolarHBondContact O-N 2.7Å; C153-L156 PolarHBondContact O-N 3.28Å; I154-L156 VanDerWaalsContact C-N 3.31Å; I154-L156 PolarHBondContact O-N 3.48Å; L156-M158 VanDerWaalsContact C-N 3.33Å; L156-M158 PolarHBondContact O-N 2.93Å; L156-Y159 PolarHBondContact O-N 2.84Å; L156-V160 HydrophobicContact CD1-CG2 4.28Å; L156-V160 WeakPolarHBondContact O-CB 3.26Å; L156-V160 PolarHBondContact O-N 3.14Å
157S79.8Confident85.3Confident65 Ų6578.3 Ų78.346%0.45546%0.456SS..Hα-helixtrans-70.7-24177.776.80000114.1C153 I154 V155 V160C153-S157 WeakPolarHBondContact O-CB 3.23Å; C153-S157 PolarHBondContact O-N 3.27Å; C153-S157 PolarHBondContact O-OG 2.66Å; I154-S157 WeakPolarHBondContact CA-OG 3.33Å; I154-S157 CarbonylContact O-C 3.55Å; I154-S157 WeakPolarHBondContact O-CA 3.38Å; I154-S157 PolarHBondContact O-N 3.28Å; I154-S157 PolarHBondContact O-OG 2.93Å; V155-S157 VanDerWaalsContact C-N 3.3Å; V155-S157 PolarHBondContact O-N 3.45Å; S157-V160 CarbonylContact C-O 3.46Å; S157-V160 CarbonylContact O-C 3.56Å
158M81.9Confident85.2Confident153 Ų15380.2 Ų80.275%0.75446%0.463SS*.Hα-helixtrans-73.3-37.5173.5-71.7-176.668.300111.9I154 V155 L156I154-M158 HydrophobicContact CG2-SD 4.45Å; I154-M158 WeakPolarHBondContact O-CG 3.26Å; I154-M158 PolarHBondContact O-N 3.18Å; V155-M158 WeakPolarHBondContact O-CB 3.29Å; V155-M158 PolarHBondContact O-N 2.73Å; V155-M158 VanDerWaalsContact O-N 3.14Å; L156-M158 VanDerWaalsContact C-N 3.33Å; L156-M158 PolarHBondContact O-N 2.93Å
159Y83.7Confident85Confident199 Ų19979 Ų7978%0.7846%0.457SS*.Hα-helixtrans-78.8-32.3176.6-72.1-70.9000112.8V155 L156V155-Y159 HydrophobicContact CG1-CD2 3.93Å; V155-Y159 HydrophobicContact CG1-CE2 3.59Å; V155-Y159 WeakPolarHBondContact O-CD2 3.37Å; V155-Y159 PolarHBondContact O-N 2.9Å; L156-Y159 PolarHBondContact O-N 2.84Å
160V83.3Confident84.9Confident35 Ų3575.2 Ų75.221%0.21244%0.438CS..SBendtrans-120.7113.4-174-175.80000109L156 S157 G162 T164 L165L156-V160 HydrophobicContact CD1-CG2 4.28Å; L156-V160 WeakPolarHBondContact O-CB 3.26Å; L156-V160 PolarHBondContact O-N 3.14Å; S157-V160 CarbonylContact C-O 3.46Å; S157-V160 CarbonylContact O-C 3.56Å; V160-G162 PolarHBondContact O-N 3.34Å; V160-T164 HydrophobicContact CG1-CG2 3.68Å; V160-L165 HydrophobicContact CG1-CB 4.23Å
161S83.9Confident85.1Confident70 Ų7074.4 Ų74.449%0.4943%0.429SS..  trans-48.6135.1171174.80000110V163 T164 L165S161-V163 PolarHBondContact O-N 3.34Å; S161-T164 WeakPolarHBondContact O-CA 3.41Å; S161-T164 VanDerWaalsContact O-CB 3.27Å; S161-T164 WeakPolarHBondContact O-CB 3.47Å; S161-T164 PolarHBondContact O-N 2.94Å; S161-L165 PolarHBondContact O-N 2.87Å
162G79.9Confident84.8Confident52 Ų5274.7 Ų74.754%0.53643%0.431SS..Hα-helixtrans-53.7-29.2-179.500000113.1V160 L165 A166V160-G162 PolarHBondContact O-N 3.34Å; G162-L165 PolarHBondContact O-N 2.9Å; G162-A166 WeakPolarHBondContact O-CB 3.24Å; G162-A166 PolarHBondContact O-N 3.48Å
163V81.6Confident84.7Confident62 Ų6277 Ų7738%0.37644%0.439SS..Hα-helixtrans-61.5-45.7171.3173.80000112I53 S161 A166 Y167I53-V163 HydrophobicContact CB-CG1 4.34Å; I53-V163 HydrophobicContact CD1-CG1 3.36Å; I53-V163 HydrophobicContact CG1-CG1 3.68Å; I53-V163 HydrophobicContact CG2-CG1 3.69Å; I53-V163 HydrophobicContact CG2-CG2 4.33Å; S161-V163 PolarHBondContact O-N 3.34Å; V163-A166 PolarHBondContact O-N 2.87Å; V163-Y167 WeakPolarHBondContact O-CB 3.44Å; V163-Y167 PolarHBondContact O-N 3.26Å
164T82.4Confident84.8Confident67 Ų6774.4 Ų74.441%0.41142%0.421SS..Hα-helixtrans-65.2-40.6177-55.40000110.9V160 S161 Y167 I168V160-T164 HydrophobicContact CG1-CG2 3.68Å; S161-T164 WeakPolarHBondContact O-CA 3.41Å; S161-T164 VanDerWaalsContact O-CB 3.27Å; S161-T164 WeakPolarHBondContact O-CB 3.47Å; S161-T164 PolarHBondContact O-N 2.94Å; T164-Y167 WeakPolarHBondContact O-CB 3.48Å; T164-Y167 PolarHBondContact O-N 2.96Å; T164-I168 HydrophobicContact CG2-CD1 3.99Å; T164-I168 HydrophobicContact CG2-CG1 4.48Å; T164-I168 VanDerWaalsContact O-CG1 3.28Å; T164-I168 WeakPolarHBondContact O-CG1 3.01Å; T164-I168 PolarHBondContact O-N 3.47Å
165L84.8Confident84.8Confident84 Ų8473.6 Ų73.644%0.4442%0.417SS..Hα-helixtrans-63.1-46.8176.6-175.166.7000111.5V160 S161 G162 Y167 I168 A169V160-L165 HydrophobicContact CG1-CB 4.23Å; S161-L165 PolarHBondContact O-N 2.87Å; G162-L165 PolarHBondContact O-N 2.9Å; L165-Y167 VanDerWaalsContact C-N 3.28Å; L165-Y167 PolarHBondContact O-N 3.32Å; L165-I168 PolarHBondContact O-N 2.91Å; L165-A169 WeakPolarHBondContact O-CB 3.08Å; L165-A169 PolarHBondContact O-N 3.3Å
166A85.5Confident84.6Confident45 Ų4574 Ų7437%0.37242%0.416SS..Hα-helixtrans-61.5-37.1175.500000112F49 G162 V163 A169 L170F49-A166 HydrophobicContact CE2-CB 4.07Å; F49-A166 HydrophobicContact CZ-CB 3.82Å; G162-A166 WeakPolarHBondContact O-CB 3.24Å; G162-A166 PolarHBondContact O-N 3.48Å; V163-A166 PolarHBondContact O-N 2.87Å; A166-A169 PolarHBondContact O-N 2.92Å; A166-L170 WeakPolarHBondContact O-CB 3.28Å; A166-L170 PolarHBondContact O-N 2.92Å
167Y87.3Confident84.3Confident89 Ų8971.6 Ų71.635%0.34941%0.406SS..Hα-helixtrans-65.5-45174.3-172.3-111.3000112.1H46 F49 V163 T164 L165 A169 L170 N171H46-Y167 AromaticContact CE1-CE2 3.75Å; H46-Y167 AromaticContact CE1-CZ 3.85Å; H46-Y167 PolarHBondContact CE1-OH 2.87Å; H46-Y167 AromaticContact ND1-CE2 3.34Å; H46-Y167 VanDerWaalsContact ND1-CE2 3.34Å; H46-Y167 WeakPolarHBondContact ND1-CE2 3.44Å; H46-Y167 AromaticContact ND1-CZ 3.79Å; H46-Y167 PolarHBondContact ND1-OH 3.42Å; F49-Y167 AromaticContact CD1-CD2 3.65Å; F49-Y167 HydrophobicContact CD1-CD2 3.65Å; F49-Y167 HydrophobicContact CD1-CE2 4.38Å; F49-Y167 AromaticContact CE1-CD2 3.47Å; F49-Y167 HydrophobicContact CE1-CD2 3.47Å; F49-Y167 VanDerWaalsContact CE1-CD2 3.47Å; F49-Y167 HydrophobicContact CE1-CG 4.04Å; V163-Y167 WeakPolarHBondContact O-CB 3.44Å; V163-Y167 PolarHBondContact O-N 3.26Å; T164-Y167 WeakPolarHBondContact O-CB 3.48Å; T164-Y167 PolarHBondContact O-N 2.96Å; L165-Y167 VanDerWaalsContact C-N 3.28Å; L165-Y167 PolarHBondContact O-N 3.32Å; Y167-A169 VanDerWaalsContact C-N 3.33Å; Y167-A169 PolarHBondContact O-N 3.42Å; Y167-L170 WeakPolarHBondContact O-CB 3.49Å; Y167-L170 PolarHBondContact O-N 3.26Å; Y167-N171 VanDerWaalsContact CD1-ND2 3.34Å; Y167-N171 WeakPolarHBondContact CD1-ND2 3.37Å; Y167-N171 WeakPolarHBondContact CE1-ND2 3.18Å; Y167-N171 VanDerWaalsContact CZ-ND2 3.34Å; Y167-N171 PolarHBondContact O-N 2.94Å; Y167-N171 PolarHBondContact O-ND2 3.49Å
168I87.3Confident84.4Confident76 Ų7669.5 Ų69.539%0.3939%0.39SS..Hα-helixtrans-60.2-46.5176-70.5166000109.7T164 L165 L170 N171 I172T164-I168 HydrophobicContact CG2-CD1 3.99Å; T164-I168 HydrophobicContact CG2-CG1 4.48Å; T164-I168 VanDerWaalsContact O-CG1 3.28Å; T164-I168 WeakPolarHBondContact O-CG1 3.01Å; T164-I168 PolarHBondContact O-N 3.47Å; L165-I168 PolarHBondContact O-N 2.91Å; I168-L170 VanDerWaalsContact C-N 3.34Å; I168-L170 PolarHBondContact O-N 3.5Å; I168-N171 PolarHBondContact O-N 3.41Å; I168-N171 VanDerWaalsContact O-N 3.16Å; I168-I172 HydrophobicContact CG2-CD1 3.77Å; I168-I172 HydrophobicContact CG2-CG1 4.35Å; I168-I172 VanDerWaalsContact O-CG1 3.31Å; I168-I172 WeakPolarHBondContact O-CG1 3.11Å; I168-I172 PolarHBondContact O-N 3.16Å
169A86.9Confident84.3Confident47 Ų4764.9 Ų64.939%0.38837%0.368SS..Hα-helixtrans-58.9-43.9176.400000112L165 A166 Y167 N171 I172 C173L165-A169 WeakPolarHBondContact O-CB 3.08Å; L165-A169 PolarHBondContact O-N 3.3Å; A166-A169 PolarHBondContact O-N 2.92Å; Y167-A169 VanDerWaalsContact C-N 3.33Å; Y167-A169 PolarHBondContact O-N 3.42Å; A169-N171 PolarHBondContact O-N 3.44Å; A169-I172 PolarHBondContact O-N 3.28Å; A169-C173 PolarHBondContact O-N 3.27Å; A169-C173 PolarHBondContact O-SG 2.86Å
170L88.2Confident84Confident28 Ų2860.4 Ų60.415%0.14736%0.357CS..Hα-helixtrans-59.3-45.7174.2178.7155.5000111.8V45 F49 A166 Y167 I168 I172 C173 L174V45-L170 HydrophobicContact CG1-CD1 3.96Å; V45-L170 HydrophobicContact CG1-CD2 4.19Å; V45-L170 HydrophobicContact CG1-CG 4.23Å; F49-L170 HydrophobicContact CB-CD1 3.59Å; F49-L170 HydrophobicContact CD1-CD1 4.2Å; F49-L170 HydrophobicContact CD2-CD1 3.53Å; F49-L170 HydrophobicContact CE2-CD1 4.25Å; F49-L170 HydrophobicContact CG-CD1 3.51Å; A166-L170 WeakPolarHBondContact O-CB 3.28Å; A166-L170 PolarHBondContact O-N 2.92Å; Y167-L170 WeakPolarHBondContact O-CB 3.49Å; Y167-L170 PolarHBondContact O-N 3.26Å; I168-L170 VanDerWaalsContact C-N 3.34Å; I168-L170 PolarHBondContact O-N 3.5Å; L170-I172 VanDerWaalsContact C-N 3.34Å; L170-I172 PolarHBondContact O-N 3.47Å; L170-C173 PolarHBondContact O-N 2.91Å; L170-L174 HydrophobicContact CD2-CD1 3.57Å; L170-L174 HydrophobicContact CD2-CG 4.24Å; L170-L174 HydrophobicContact CG-CD1 4.49Å; L170-L174 WeakPolarHBondContact O-CG 3.47Å; L170-L174 PolarHBondContact O-N 2.84Å
171N89.9Confident83.4Confident38 Ų3862 Ų6220%0.20336%0.363CS..Hα-helixtrans-62.6-42.7177-80.3-88.9000111.3Y167 I168 A169 C173 L174 I175Y167-N171 VanDerWaalsContact CD1-ND2 3.34Å; Y167-N171 WeakPolarHBondContact CD1-ND2 3.37Å; Y167-N171 WeakPolarHBondContact CE1-ND2 3.18Å; Y167-N171 VanDerWaalsContact CZ-ND2 3.34Å; Y167-N171 PolarHBondContact O-N 2.94Å; Y167-N171 PolarHBondContact O-ND2 3.49Å; I168-N171 PolarHBondContact O-N 3.41Å; I168-N171 VanDerWaalsContact O-N 3.16Å; A169-N171 PolarHBondContact O-N 3.44Å; N171-C173 VanDerWaalsContact C-N 3.34Å; N171-C173 PolarHBondContact O-N 2.78Å; N171-L174 PolarHBondContact O-N 3.4Å; N171-I175 HydrophobicContact CB-CD1 4.29Å; N171-I175 VanDerWaalsContact O-CB 3.24Å; N171-I175 WeakPolarHBondContact O-CB 3.2Å; N171-I175 WeakPolarHBondContact O-CD1 3.47Å; N171-I175 WeakPolarHBondContact O-CG1 3.03Å; N171-I175 PolarHBondContact O-N 3.48Å
172I86.8Confident83.1Confident97 Ų9762.9 Ų62.950%0.49736%0.358SS..Hα-helixtrans-58.6-48.2174.8-68.2167000109.6I168 A169 L170 L174 I175 L176I168-I172 HydrophobicContact CG2-CD1 3.77Å; I168-I172 HydrophobicContact CG2-CG1 4.35Å; I168-I172 VanDerWaalsContact O-CG1 3.31Å; I168-I172 WeakPolarHBondContact O-CG1 3.11Å; I168-I172 PolarHBondContact O-N 3.16Å; A169-I172 PolarHBondContact O-N 3.28Å; L170-I172 VanDerWaalsContact C-N 3.34Å; L170-I172 PolarHBondContact O-N 3.47Å; I172-L174 VanDerWaalsContact C-N 3.32Å; I172-L174 PolarHBondContact O-N 3.42Å; I172-I175 PolarHBondContact O-N 2.94Å; I172-L176 WeakPolarHBondContact O-CA 3.11Å; I172-L176 WeakPolarHBondContact O-CB 3.3Å; I172-L176 PolarHBondContact O-N 3.29Å
173C85.4Confident83Confident85 Ų8568.9 Ų68.957%0.57437%0.365SS*.Hα-helixtrans-60.4-37.6178.2-70.70000113.2A169 L170 N171 P177A169-C173 PolarHBondContact O-N 3.27Å; A169-C173 PolarHBondContact O-SG 2.86Å; L170-C173 PolarHBondContact O-N 2.91Å; N171-C173 VanDerWaalsContact C-N 3.34Å; N171-C173 PolarHBondContact O-N 2.78Å; C173-P177 WeakPolarHBondContact O-CD 3.31Å
174L86.2Confident82.9Confident21 Ų2167.9 Ų67.911%0.1136%0.359CS..Hα-helixtrans-73.5-38.8177.6-71.3179.3000112.8L30 F41 T42 V45 L170 N171 I172L30-L174 HydrophobicContact CD2-CD2 4.44Å; F41-L174 HydrophobicContact CE1-CD2 4.19Å; T42-L174 HydrophobicContact CG2-CD1 4.17Å; V45-L174 HydrophobicContact CB-CD1 4.44Å; V45-L174 HydrophobicContact CG1-CD1 4.08Å; V45-L174 HydrophobicContact CG1-CD2 4.38Å; L170-L174 HydrophobicContact CD2-CD1 3.57Å; L170-L174 HydrophobicContact CD2-CG 4.24Å; L170-L174 HydrophobicContact CG-CD1 4.49Å; L170-L174 WeakPolarHBondContact O-CG 3.47Å; L170-L174 PolarHBondContact O-N 2.84Å; N171-L174 PolarHBondContact O-N 3.4Å; I172-L174 VanDerWaalsContact C-N 3.32Å; I172-L174 PolarHBondContact O-N 3.42Å
175I85Confident82.7Confident78 Ų7868.3 Ų68.340%0.436%0.358SS..Hα-helixtrans-85.6-29.9-173.9-66.4167.7000111.4N171 I172 T178 L179N171-I175 HydrophobicContact CB-CD1 4.29Å; N171-I175 VanDerWaalsContact O-CB 3.24Å; N171-I175 WeakPolarHBondContact O-CB 3.2Å; N171-I175 WeakPolarHBondContact O-CD1 3.47Å; N171-I175 WeakPolarHBondContact O-CG1 3.03Å; N171-I175 PolarHBondContact O-N 3.48Å; I172-I175 PolarHBondContact O-N 2.94Å; I175-T178 CarbonylContact O-C 3.31Å; I175-T178 WeakPolarHBondContact O-CA 3.46Å; I175-T178 VanDerWaalsContact O-CB 3.28Å; I175-T178 WeakPolarHBondContact O-CB 3.2Å; I175-T178 PolarHBondContact O-N 3.23Å; I175-T178 VanDerWaalsContact O-N 3.09Å; I175-L179 HydrophobicContact CG2-CD1 3.55Å; I175-L179 HydrophobicContact CG2-CD2 4.11Å; I175-L179 HydrophobicContact CG2-CG 3.5Å; I175-L179 VanDerWaalsContact CG2-CG 3.5Å; I175-L179 WeakPolarHBondContact O-CG 3.17Å; I175-L179 PolarHBondContact O-N 2.77Å
176L82.7Confident82.6Confident74 Ų7466.8 Ų66.839%0.38735%0.354SS..Hα-helixtrans-57.2-47.2-173.6178.367.1000113.3I172 T178 L179 L180 I185I172-L176 WeakPolarHBondContact O-CA 3.11Å; I172-L176 WeakPolarHBondContact O-CB 3.3Å; I172-L176 PolarHBondContact O-N 3.29Å; L176-T178 VanDerWaalsContact C-N 3.3Å; L176-T178 PolarHBondContact O-N 2.82Å; L176-L179 PolarHBondContact O-N 2.73Å; L176-L180 HydrophobicContact CD1-CD1 4.27Å; L176-L180 HydrophobicContact CD1-CG 4.29Å; L176-L180 HydrophobicContact CG-CD1 4.17Å; L176-L180 WeakPolarHBondContact O-CG 3.24Å; L176-L180 PolarHBondContact O-N 2.9Å; L176-I185 HydrophobicContact CD1-CD1 4.12Å
177P78.6Confident82.6Confident38 Ų3871.9 Ų71.925%0.24736%0.364CS..Hα-helixtrans-61.3-39.1175.8-25.638000112.5L30 C173 L180 H181L30-P177 HydrophobicContact CB-CB 4.21Å; L30-P177 HydrophobicContact CB-CG 4.42Å; L30-P177 HydrophobicContact CD2-CB 4.45Å; L30-P177 HydrophobicContact CD2-CG 3.77Å; C173-P177 WeakPolarHBondContact O-CD 3.31Å; P177-L180 PolarHBondContact O-N 2.59Å; P177-H181 VanDerWaalsContact O-CB 3.32Å; P177-H181 WeakPolarHBondContact O-CB 3.26Å; P177-H181 PolarHBondContact O-N 2.92Å
178T80.6Confident82.5Confident22 Ų2270.9 Ų70.914%0.13537%0.367CS..Hα-helixtrans-63.4-44.1175.5-39.60000111.6L30 W32 I175 L176 H181 H182L30-T178 PolarHBondContact O-OG1 3.34Å; W32-T178 HydrophobicContact CB-CG2 4.38Å; W32-T178 HydrophobicContact CG-CG2 4.37Å; I175-T178 CarbonylContact O-C 3.31Å; I175-T178 WeakPolarHBondContact O-CA 3.46Å; I175-T178 VanDerWaalsContact O-CB 3.28Å; I175-T178 WeakPolarHBondContact O-CB 3.2Å; I175-T178 PolarHBondContact O-N 3.23Å; I175-T178 VanDerWaalsContact O-N 3.09Å; L176-T178 VanDerWaalsContact C-N 3.3Å; L176-T178 PolarHBondContact O-N 2.82Å; T178-H181 PolarHBondContact O-N 2.78Å; T178-H182 PolarHBondContact O-N 2.62Å
179L79.8Confident82.5Confident56 Ų5674.3 Ų74.329%0.29338%0.375SS..Hα-helixtrans-65-40.7179.4-73.1176000112.3I175 L176 R183 V184 I185I175-L179 HydrophobicContact CG2-CD1 3.55Å; I175-L179 HydrophobicContact CG2-CD2 4.11Å; I175-L179 HydrophobicContact CG2-CG 3.5Å; I175-L179 VanDerWaalsContact CG2-CG 3.5Å; I175-L179 WeakPolarHBondContact O-CG 3.17Å; I175-L179 PolarHBondContact O-N 2.77Å; L176-L179 PolarHBondContact O-N 2.73Å; L179-R183 PolarHBondContact O-N 3.35Å; L179-V184 HydrophobicContact CD2-CB 3.64Å; L179-V184 HydrophobicContact CD2-CG1 3.62Å; L179-V184 HydrophobicContact CD2-CG2 4.2Å; L179-V184 PolarHBondContact O-N 3.31Å; L179-I185 HydrophobicContact CB-CD1 3.87Å; L179-I185 HydrophobicContact CB-CG1 4.01Å; L179-I185 HydrophobicContact CD1-CG1 4.47Å
180L77.2Confident82.5Confident104 Ų10476.4 Ų76.455%0.54538%0.38SS..Hα-helixtrans-65.2-48.1175.6-71.8171000110.5L176 P177 H182 R183 I185L176-L180 HydrophobicContact CD1-CD1 4.27Å; L176-L180 HydrophobicContact CD1-CG 4.29Å; L176-L180 HydrophobicContact CG-CD1 4.17Å; L176-L180 WeakPolarHBondContact O-CG 3.24Å; L176-L180 PolarHBondContact O-N 2.9Å; P177-L180 PolarHBondContact O-N 2.59Å; L180-H182 PolarHBondContact O-N 3.21Å; L180-R183 PolarHBondContact O-N 2.84Å; L180-R183 VanDerWaalsContact O-N 3.1Å; L180-I185 HydrophobicContact CD2-CD1 3.72Å; L180-I185 HydrophobicContact CG-CD1 4.07Å
181H72.5Confident82.6Confident70 Ų7080.9 Ų80.932%0.32440%0.403SS..Hα-helixtrans-60-49-179.3179.661.2000112.4L31 S106 P177 T178 R183L31-H181 HydrophobicContact CD2-CB 4.09Å; L31-H181 VanDerWaalsContact CD2-CG 3.47Å; L31-H181 WeakPolarHBondContact CD2-ND1 3.3Å; L31-H181 HydrophobicContact CG-CB 4.03Å; S106-H181 PolarHBondContact OG-CE1 3.35Å; S106-H181 PolarHBondContact OG-ND1 2.78Å; S106-H181 VanDerWaalsContact OG-ND1 3.13Å; P177-H181 VanDerWaalsContact O-CB 3.32Å; P177-H181 WeakPolarHBondContact O-CB 3.26Å; P177-H181 PolarHBondContact O-N 2.92Å; T178-H181 PolarHBondContact O-N 2.78Å; H181-R183 PolarHBondContact O-N 3.4Å
182H77.5Confident82.7Confident87 Ų8782.6 Ų82.640%0.40341%0.412SS..THydrogen-bonded Turntrans-79.56.4178.6-71.2-54.7000114.2T178 L180 V184 R187T178-H182 PolarHBondContact O-N 2.62Å; L180-H182 PolarHBondContact O-N 3.21Å; H182-V184 HydrophobicContact CB-CG2 3.72Å; H182-V184 PolarHBondContact O-N 3.08Å; H182-V184 VanDerWaalsContact O-N 3.09Å; H182-R187 PolarHBondContact O-NH2 3.1Å
183R77.3Confident82.9Confident179 Ų17983 Ų8368%0.67541%0.409SS*.THydrogen-bonded Turntrans52.128.6-176.9-55.217874.1164.43.6112.9L179 L180 H181 I185 S186 R187L179-R183 PolarHBondContact O-N 3.35Å; L180-R183 PolarHBondContact O-N 2.84Å; L180-R183 VanDerWaalsContact O-N 3.1Å; H181-R183 PolarHBondContact O-N 3.4Å; R183-I185 VanDerWaalsContact C-N 3.28Å; R183-I185 PolarHBondContact O-N 3.04Å; R183-S186 WeakPolarHBondContact O-CB 3.47Å; R183-S186 PolarHBondContact O-N 2.98Å; R183-S186 VanDerWaalsContact O-N 3.16Å; R183-R187 PolarHBondContact O-N 3.49Å; R183-R187 VanDerWaalsContact O-N 3.15Å
184V78.9Confident83.1Confident41 Ų4182.5 Ų82.525%0.24841%0.405CS..Hα-helixtrans-64.9-37.8-177.1178.50000110L179 H182 S186 R187 V188L179-V184 HydrophobicContact CD2-CB 3.64Å; L179-V184 HydrophobicContact CD2-CG1 3.62Å; L179-V184 HydrophobicContact CD2-CG2 4.2Å; L179-V184 PolarHBondContact O-N 3.31Å; H182-V184 HydrophobicContact CB-CG2 3.72Å; H182-V184 PolarHBondContact O-N 3.08Å; H182-V184 VanDerWaalsContact O-N 3.09Å; V184-S186 VanDerWaalsContact C-N 3.29Å; V184-S186 PolarHBondContact O-N 2.82Å; V184-R187 PolarHBondContact O-N 2.9Å; V184-R187 VanDerWaalsContact O-N 3.12Å; V184-V188 HydrophobicContact CG1-CG2 4.03Å; V184-V188 WeakPolarHBondContact O-CB 3.26Å; V184-V188 VanDerWaalsContact O-CG2 3.31Å; V184-V188 WeakPolarHBondContact O-CG2 3.12Å; V184-V188 PolarHBondContact O-N 2.96Å
185I78.3Confident83.4Confident76 Ų7686.3 Ų86.339%0.3943%0.425SS..Hα-helixtrans-58.6-42.5175.6-67.3156.9000110.8L176 L179 L180 R183 V188 W189L176-I185 HydrophobicContact CD1-CD1 4.12Å; L179-I185 HydrophobicContact CB-CD1 3.87Å; L179-I185 HydrophobicContact CB-CG1 4.01Å; L179-I185 HydrophobicContact CD1-CG1 4.47Å; L180-I185 HydrophobicContact CD2-CD1 3.72Å; L180-I185 HydrophobicContact CG-CD1 4.07Å; R183-I185 VanDerWaalsContact C-N 3.28Å; R183-I185 PolarHBondContact O-N 3.04Å; I185-V188 PolarHBondContact O-N 3.43Å; I185-W189 VanDerWaalsContact O-CB 3.23Å; I185-W189 WeakPolarHBondContact O-CB 3.29Å; I185-W189 PolarHBondContact O-N 3.25Å
186S83.4Confident83.8Confident51 Ų5187.2 Ų87.236%0.35743%0.43SS..Hα-helixtrans-62-45.6175.8-168.40000111.1R183 V184 V188 W189 D190R183-S186 WeakPolarHBondContact O-CB 3.47Å; R183-S186 PolarHBondContact O-N 2.98Å; R183-S186 VanDerWaalsContact O-N 3.16Å; V184-S186 VanDerWaalsContact C-N 3.29Å; V184-S186 PolarHBondContact O-N 2.82Å; S186-V188 PolarHBondContact O-N 2.96Å; S186-W189 WeakPolarHBondContact O-CB 3.41Å; S186-W189 PolarHBondContact O-N 3.17Å; S186-D190 WeakPolarHBondContact O-CB 3.44Å; S186-D190 PolarHBondContact O-N 3.18Å; S186-D190 VanDerWaalsContact O-OD2 3.09Å
187R85Confident84.2Confident152 Ų15289.8 Ų89.857%0.57444%0.438SS*.Hα-helixtrans-63.5-43178.3-63.1-175.8-163.8133.66.3112H182 R183 V184 W189 D190 L191H182-R187 PolarHBondContact O-NH2 3.1Å; R183-R187 PolarHBondContact O-N 3.49Å; R183-R187 VanDerWaalsContact O-N 3.15Å; V184-R187 PolarHBondContact O-N 2.9Å; V184-R187 VanDerWaalsContact O-N 3.12Å; R187-W189 VanDerWaalsContact C-N 3.33Å; R187-D190 PolarHBondContact O-N 2.76Å; R187-L191 VanDerWaalsContact O-CG 3.28Å; R187-L191 WeakPolarHBondContact O-CG 3.24Å; R187-L191 PolarHBondContact O-N 2.92Å
188V84.4Confident84.7Confident69 Ų6996.5 Ų96.542%0.41846%0.459SS..Hα-helixtrans-64-41.8176.5171.50000110.1V184 I185 S186 L191 I192V184-V188 HydrophobicContact CG1-CG2 4.03Å; V184-V188 WeakPolarHBondContact O-CB 3.26Å; V184-V188 VanDerWaalsContact O-CG2 3.31Å; V184-V188 WeakPolarHBondContact O-CG2 3.12Å; V184-V188 PolarHBondContact O-N 2.96Å; I185-V188 PolarHBondContact O-N 3.43Å; S186-V188 PolarHBondContact O-N 2.96Å; V188-L191 WeakPolarHBondContact O-CB 3.33Å; V188-L191 PolarHBondContact O-N 2.64Å; V188-I192 HydrophobicContact CG1-CD1 3.64Å; V188-I192 HydrophobicContact CG1-CG1 4.31Å; V188-I192 VanDerWaalsContact O-CG1 3.29Å; V188-I192 WeakPolarHBondContact O-CG1 3.13Å; V188-I192 PolarHBondContact O-N 3.48Å
189W88Confident85.2Confident147 Ų14799.3 Ų99.356%0.55747%0.472SS*.Hα-helixtrans-62-43.4174.8-175.3-105.9000112.1I185 S186 R187 L191 I192 K193I185-W189 VanDerWaalsContact O-CB 3.23Å; I185-W189 WeakPolarHBondContact O-CB 3.29Å; I185-W189 PolarHBondContact O-N 3.25Å; S186-W189 WeakPolarHBondContact O-CB 3.41Å; S186-W189 PolarHBondContact O-N 3.17Å; R187-W189 VanDerWaalsContact C-N 3.33Å; W189-L191 PolarHBondContact O-N 2.85Å; W189-I192 PolarHBondContact O-N 3.27Å; W189-I192 VanDerWaalsContact O-N 3.17Å; W189-K193 VanDerWaalsContact O-CB 3.3Å; W189-K193 WeakPolarHBondContact O-CB 3.34Å; W189-K193 PolarHBondContact O-N 3.25Å
190D87.7Confident85.6Confident91 Ų91102.2 Ų102.249%0.48748%0.484SS..Hα-helixtrans-64.3-28.1176.2-67.7-34.1000112.3S186 R187 P194S186-D190 WeakPolarHBondContact O-CB 3.44Å; S186-D190 PolarHBondContact O-N 3.18Å; S186-D190 VanDerWaalsContact O-OD2 3.09Å; R187-D190 PolarHBondContact O-N 2.76Å; D190-P194 WeakPolarHBondContact O-CD 3.15Å
191L89.5Confident86.1Confident122 Ų12299.9 Ų99.964%0.63948%0.48SS*.Hα-helixtrans-78.5-36.3172.2-69.3171000113R187 V188 W189 P194R187-L191 VanDerWaalsContact O-CG 3.28Å; R187-L191 WeakPolarHBondContact O-CG 3.24Å; R187-L191 PolarHBondContact O-N 2.92Å; V188-L191 WeakPolarHBondContact O-CB 3.33Å; V188-L191 PolarHBondContact O-N 2.64Å; W189-L191 PolarHBondContact O-N 2.85Å; L191-P194 VanDerWaalsContact O-CD 3.3Å; L191-P194 WeakPolarHBondContact O-CD 3.3Å; L191-P194 VanDerWaalsContact O-CG 3.27Å; L191-P194 WeakPolarHBondContact O-CG 3.22Å
192I91.2Very high86.7Confident75 Ų75101 Ų10139%0.38549%0.485SS..Hα-helixtrans-74.3-36.7178.5-69.9169.3000110.9V188 W189 I195 L196V188-I192 HydrophobicContact CG1-CD1 3.64Å; V188-I192 HydrophobicContact CG1-CG1 4.31Å; V188-I192 VanDerWaalsContact O-CG1 3.29Å; V188-I192 WeakPolarHBondContact O-CG1 3.13Å; V188-I192 PolarHBondContact O-N 3.48Å; W189-I192 PolarHBondContact O-N 3.27Å; W189-I192 VanDerWaalsContact O-N 3.17Å; I192-I195 CarbonylContact O-C 3.32Å; I192-I195 WeakPolarHBondContact O-CA 3.41Å; I192-I195 WeakPolarHBondContact O-CB 3.2Å; I192-I195 PolarHBondContact O-N 3.46Å; I192-L196 PolarHBondContact O-N 2.89Å
193K91.6Very high86.9Confident104 Ų104103.5 Ų103.545%0.45250%0.495SS..Hα-helixtrans-50.5-47.9-178.3-169.6174.1-171.7177.30114.3W189 I195 L196 K197W189-K193 VanDerWaalsContact O-CB 3.3Å; W189-K193 WeakPolarHBondContact O-CB 3.34Å; W189-K193 PolarHBondContact O-N 3.25Å; K193-I195 VanDerWaalsContact C-N 3.34Å; K193-L196 PolarHBondContact O-N 3.47Å; K193-K197 WeakPolarHBondContact O-CG 3.24Å; K193-K197 PolarHBondContact O-N 3.13Å
194P91Very high87Confident75 Ų75100.7 Ų100.749%0.48749%0.493SS..Hα-helixtrans-68.6-30.9175.626.8-35.8000113D190 L191 R198D190-P194 WeakPolarHBondContact O-CD 3.15Å; L191-P194 VanDerWaalsContact O-CD 3.3Å; L191-P194 WeakPolarHBondContact O-CD 3.3Å; L191-P194 VanDerWaalsContact O-CG 3.27Å; L191-P194 WeakPolarHBondContact O-CG 3.22Å; P194-R198 WeakPolarHBondContact O-CB 3.26Å; P194-R198 PolarHBondContact O-N 2.79Å
195I91.3Very high87.1Confident102 Ų102105.8 Ų105.852%0.52351%0.512SS..Hα-helixtrans-66.4-45.9175.5-59.7172.3000109.5I192 K193 K197 R198 I199I192-I195 CarbonylContact O-C 3.32Å; I192-I195 WeakPolarHBondContact O-CA 3.41Å; I192-I195 WeakPolarHBondContact O-CB 3.2Å; I192-I195 PolarHBondContact O-N 3.46Å; K193-I195 VanDerWaalsContact C-N 3.34Å; I195-K197 VanDerWaalsContact C-N 3.35Å; I195-K197 PolarHBondContact O-N 3.05Å; I195-R198 WeakPolarHBondContact O-CB 3.28Å; I195-R198 PolarHBondContact O-N 3.3Å; I195-R198 VanDerWaalsContact O-N 3.12Å; I195-I199 HydrophobicContact CG2-CD1 4.08Å; I195-I199 WeakPolarHBondContact O-CG1 3.43Å; I195-I199 PolarHBondContact O-N 2.87Å
196L92.5Very high87Confident97 Ų97107.7 Ų107.751%0.50852%0.523SS..Hα-helixtrans-61.9-43.2177.6-171.661.6000111.4I192 K193 R198 I199 E200I192-L196 PolarHBondContact O-N 2.89Å; K193-L196 PolarHBondContact O-N 3.47Å; L196-R198 VanDerWaalsContact C-N 3.29Å; L196-R198 PolarHBondContact O-N 3.35Å; L196-I199 WeakPolarHBondContact O-CB 3.21Å; L196-I199 PolarHBondContact O-N 3.46Å; L196-I199 VanDerWaalsContact O-N 3.16Å; L196-E200 WeakPolarHBondContact O-CB 3.06Å; L196-E200 PolarHBondContact O-N 3.47Å
197K91.7Very high86.5Confident127 Ų127109.2 Ų109.255%0.55253%0.532SS*.Hα-helixtrans-61.1-36173.3-76.6-175.7173.2-163.30113.3K193 I195 A201K193-K197 WeakPolarHBondContact O-CG 3.24Å; K193-K197 PolarHBondContact O-N 3.13Å; I195-K197 VanDerWaalsContact C-N 3.35Å; I195-K197 PolarHBondContact O-N 3.05Å; K197-A201 WeakPolarHBondContact O-CB 3.48Å; K197-A201 PolarHBondContact O-N 3.36Å
198R90.5Very high85.8Confident180 Ų180110.2 Ų110.268%0.67955%0.548SS*.Hα-helixtrans-68.1-40.3175.5-176.6177.6178.2-176.6-0.6110.9P194 I195 L196 A201 E202P194-R198 WeakPolarHBondContact O-CB 3.26Å; P194-R198 PolarHBondContact O-N 2.79Å; I195-R198 WeakPolarHBondContact O-CB 3.28Å; I195-R198 PolarHBondContact O-N 3.3Å; I195-R198 VanDerWaalsContact O-N 3.12Å; L196-R198 VanDerWaalsContact C-N 3.29Å; L196-R198 PolarHBondContact O-N 3.35Å; R198-A201 PolarHBondContact O-N 3.46Å; R198-E202 WeakPolarHBondContact O-CG 3Å; R198-E202 PolarHBondContact O-N 2.85Å
199I89.6Confident85.1Confident80 Ų80111.2 Ų111.241%0.4155%0.548SS..Hα-helixtrans-62.9-48.1175.4-67.9166.6000109.9I195 L196 A201 E202 F203I195-I199 HydrophobicContact CG2-CD1 4.08Å; I195-I199 WeakPolarHBondContact O-CG1 3.43Å; I195-I199 PolarHBondContact O-N 2.87Å; L196-I199 WeakPolarHBondContact O-CB 3.21Å; L196-I199 PolarHBondContact O-N 3.46Å; L196-I199 VanDerWaalsContact O-N 3.16Å; I199-A201 VanDerWaalsContact C-N 3.33Å; I199-A201 PolarHBondContact O-N 2.88Å; I199-E202 PolarHBondContact O-N 3.26Å; I199-E202 VanDerWaalsContact O-N 3.09Å; I199-F203 HydrophobicContact CG2-CD2 3.68Å; I199-F203 HydrophobicContact CG2-CE2 3.57Å; I199-F203 VanDerWaalsContact O-CD2 3.28Å; I199-F203 WeakPolarHBondContact O-CD2 2.93Å; I199-F203 PolarHBondContact O-N 2.68Å
200E88.4Confident84.5Confident117 Ų117106.4 Ų106.455%0.54754%0.537SS..Hα-helixtrans-55-47174.5-174.3176.3-163.700111.5L196 E202 F203 D204L196-E200 WeakPolarHBondContact O-CB 3.06Å; L196-E200 PolarHBondContact O-N 3.47Å; E200-E202 VanDerWaalsContact C-N 3.31Å; E200-E202 PolarHBondContact O-N 3.35Å; E200-F203 PolarHBondContact O-N 3.46Å; E200-F203 VanDerWaalsContact O-N 3.16Å; E200-D204 PolarHBondContact O-N 3.48Å
201A87Confident83.8Confident56 Ų56107.1 Ų107.146%0.46355%0.546SS..Hα-helixtrans-64.3-30.6176.900000114.1K197 R198 I199 K205K197-A201 WeakPolarHBondContact O-CB 3.48Å; K197-A201 PolarHBondContact O-N 3.36Å; R198-A201 PolarHBondContact O-N 3.46Å; I199-A201 VanDerWaalsContact C-N 3.33Å; I199-A201 PolarHBondContact O-N 2.88Å; A201-K205 VanDerWaalsContact O-CB 3.29Å; A201-K205 WeakPolarHBondContact O-CB 3.36Å; A201-K205 PolarHBondContact O-N 3.48Å; A201-K205 VanDerWaalsContact O-N 3.11Å
202E86.9Confident83.3Confident94 Ų94109 Ų10944%0.43955%0.552SS.*Hα-helixtrans-73.9-36.6174.1-68.8-75.1-177.400111.4R198 I199 E200 K205 N206R198-E202 WeakPolarHBondContact O-CG 3Å; R198-E202 PolarHBondContact O-N 2.85Å; I199-E202 PolarHBondContact O-N 3.26Å; I199-E202 VanDerWaalsContact O-N 3.09Å; E200-E202 VanDerWaalsContact C-N 3.31Å; E200-E202 PolarHBondContact O-N 3.35Å; E202-K205 PolarHBondContact O-N 2.82Å; E202-N206 PolarHBondContact O-N 3.46Å
203F80.4Confident82.8Confident138 Ų138110.6 Ų110.661%0.60556%0.558SS**Hα-helixtrans-66.5-41.4172.1-83.4-75.6000111.8I199 E200 K205 N206I199-F203 HydrophobicContact CG2-CD2 3.68Å; I199-F203 HydrophobicContact CG2-CE2 3.57Å; I199-F203 VanDerWaalsContact O-CD2 3.28Å; I199-F203 WeakPolarHBondContact O-CD2 2.93Å; I199-F203 PolarHBondContact O-N 2.68Å; E200-F203 PolarHBondContact O-N 3.46Å; E200-F203 VanDerWaalsContact O-N 3.16Å; F203-K205 VanDerWaalsContact C-N 3.27Å; F203-K205 PolarHBondContact O-N 3.42Å; F203-N206 CarbonylContact O-C 3.57Å; F203-N206 VanDerWaalsContact O-C 3.31Å; F203-N206 PolarHBondContact O-N 2.87Å
204D79.9Confident82.1Confident120 Ų120113.3 Ų113.364%0.64257%0.565SS**Hα-helixtrans-67.1-27.8176.4-75-15.2000112.9E200E200-D204 PolarHBondContact O-N 3.48Å
205K80Confident81.7Confident149 Ų149112.9 Ų112.965%0.64856%0.558SS**Hα-helixtrans-74.9-35.2179.6-177.8-178.3172.9-167.30112.7A201 E202 F203 P207A201-K205 VanDerWaalsContact O-CB 3.29Å; A201-K205 WeakPolarHBondContact O-CB 3.36Å; A201-K205 PolarHBondContact O-N 3.48Å; A201-K205 VanDerWaalsContact O-N 3.11Å; E202-K205 PolarHBondContact O-N 2.82Å; F203-K205 VanDerWaalsContact C-N 3.27Å; F203-K205 PolarHBondContact O-N 3.42Å; K205-P207 VanDerWaalsContact O-CD 3.24Å; K205-P207 WeakPolarHBondContact O-CD 3.32Å
206N76.8Confident81.3Confident116 Ų116110 Ų11062%0.6255%0.55SS**SBendtrans-114.870.5175.4-72.8-18.9000108.9E202 F203 L208E202-N206 PolarHBondContact O-N 3.46Å; F203-N206 CarbonylContact O-C 3.57Å; F203-N206 VanDerWaalsContact O-C 3.31Å; F203-N206 PolarHBondContact O-N 2.87Å; N206-L208 PolarHBondContact O-N 3.07Å
207P72.2Confident80.7Confident82 Ų82107 Ų10753%0.53254%0.542SS..  trans-56.7127.8174.426.7-33.1000108K205 E209K205-P207 VanDerWaalsContact O-CD 3.24Å; K205-P207 WeakPolarHBondContact O-CD 3.32Å; P207-E209 PolarHBondContact O-N 3.31Å; P207-E209 VanDerWaalsContact O-N 3.17Å
208L70.2Confident80.3Confident174 Ų174105.6 Ų105.691%0.91154%0.538SS*.SBendtrans-63.9-17.7-179-67.5172.6000112.3N206N206-L208 PolarHBondContact O-N 3.07Å
209E70.6Confident79.9Confident89 Ų89103.8 Ų103.842%0.41653%0.531SS..SBendtrans-135.8135.1-173.2-172.8174-154.900108.3P207 E213 R214P207-E209 PolarHBondContact O-N 3.31Å; P207-E209 VanDerWaalsContact O-N 3.17Å; E209-E213 HydrophobicContact CG-CB 3.35Å; E209-R214 VanDerWaalsContact CD-CA 3.44Å; E209-R214 HydrophobicContact CG-CB 4.14Å; E209-R214 WeakPolarHBondContact OE1-CA 3.16Å; E209-R214 PolarHBondContact OE1-N 2.9Å
210S75.8Confident79.6Confident46 Ų46107.1 Ų107.132%0.32255%0.545SS..  trans-64.3151.3173.865.40000110.2E212 E213 R214S210-E212 PolarHBondContact O-N 3.2Å; S210-E213 WeakPolarHBondContact CB-OE2 3.38Å; S210-E213 PolarHBondContact N-OE2 2.84Å; S210-E213 PolarHBondContact O-N 3.45Å; S210-E213 VanDerWaalsContact O-N 3.08Å; S210-E213 WeakPolarHBondContact OG-CB 3.46Å; S210-E213 VanDerWaalsContact OG-CD 3.25Å; S210-E213 VanDerWaalsContact OG-CG 3.26Å; S210-E213 WeakPolarHBondContact OG-CG 2.99Å; S210-E213 PolarHBondContact OG-N 3.1Å; S210-E213 PolarHBondContact OG-OE2 3.47Å; S210-R214 PolarHBondContact O-N 2.8Å
211P73.6Confident79.1Confident106 Ų106106.2 Ų106.269%0.68854%0.543SS*.Hα-helixtrans-54.8-27.9177.7-26.634.6000113.8D215P211-D215 WeakPolarHBondContact O-CB 3.39Å; P211-D215 PolarHBondContact O-N 2.85Å; P211-D215 VanDerWaalsContact O-N 3.1Å
212E78.1Confident78.6Confident161 Ų161109.7 Ų109.775%0.75255%0.545SS*.Hα-helixtrans-74.5-44.3176.9-64.3-179.8-175.400112.1S210 R214 D215 A216S210-E212 PolarHBondContact O-N 3.2Å; E212-R214 VanDerWaalsContact C-N 3.31Å; E212-R214 PolarHBondContact O-N 3.35Å; E212-D215 PolarHBondContact O-N 3.1Å; E212-A216 WeakPolarHBondContact O-CB 3.46Å; E212-A216 PolarHBondContact O-N 3.33Å
213E80.5Confident78.4Confident110 Ų110110.2 Ų110.251%0.51455%0.548SS..Hα-helixtrans-62.6-40.4173.9-74.2162.2153.900110.8E209 S210 A216 G217E209-E213 HydrophobicContact CG-CB 3.35Å; S210-E213 WeakPolarHBondContact CB-OE2 3.38Å; S210-E213 PolarHBondContact N-OE2 2.84Å; S210-E213 PolarHBondContact O-N 3.45Å; S210-E213 VanDerWaalsContact O-N 3.08Å; S210-E213 WeakPolarHBondContact OG-CB 3.46Å; S210-E213 VanDerWaalsContact OG-CD 3.25Å; S210-E213 VanDerWaalsContact OG-CG 3.26Å; S210-E213 WeakPolarHBondContact OG-CG 2.99Å; S210-E213 PolarHBondContact OG-N 3.1Å; S210-E213 PolarHBondContact OG-OE2 3.47Å; E213-A216 WeakPolarHBondContact O-CB 3.28Å; E213-A216 PolarHBondContact O-N 3.16Å; E213-G217 PolarHBondContact O-N 3.4Å
214R77.7Confident78.5Confident161 Ų161105.2 Ų105.261%0.60853%0.529SS*.Hα-helixtrans-65.1-43.1177.5-164.7-174.880.81785112.4E209 S210 E212 A216 G217 E218E209-R214 VanDerWaalsContact CD-CA 3.44Å; E209-R214 HydrophobicContact CG-CB 4.14Å; E209-R214 WeakPolarHBondContact OE1-CA 3.16Å; E209-R214 PolarHBondContact OE1-N 2.9Å; S210-R214 PolarHBondContact O-N 2.8Å; E212-R214 VanDerWaalsContact C-N 3.31Å; E212-R214 PolarHBondContact O-N 3.35Å; R214-A216 VanDerWaalsContact C-N 3.32Å; R214-G217 PolarHBondContact O-N 2.98Å; R214-E218 WeakPolarHBondContact O-CB 3.48Å; R214-E218 PolarHBondContact O-N 3.44Å
215D82.2Confident78.5Confident65 Ų65103.7 Ų103.735%0.34852%0.52SS..Hα-helixtrans-68.2-33.5175.7-17947.4000111.3P211 E212 R219P211-D215 WeakPolarHBondContact O-CB 3.39Å; P211-D215 PolarHBondContact O-N 2.85Å; P211-D215 VanDerWaalsContact O-N 3.1Å; E212-D215 PolarHBondContact O-N 3.1Å; D215-R219 WeakPolarHBondContact O-CB 3.4Å; D215-R219 VanDerWaalsContact O-CG 3.25Å; D215-R219 WeakPolarHBondContact O-CG 3.22Å; D215-R219 PolarHBondContact O-N 3.38Å; D215-R219 IonicContact OD1-CZ 3.97Å; D215-R219 IonicContact OD1-NE 3.32Å; D215-R219 PolarHBondContact OD1-NE 3.11Å; D215-R219 IonicContact OD1-NH2 3.71Å; D215-R219 IonicContact OD2-CZ 3.21Å; D215-R219 IonicContact OD2-NE 3.24Å; D215-R219 PolarHBondContact OD2-NE 3.23Å; D215-R219 IonicContact OD2-NH2 2.62Å; D215-R219 PolarHBondContact OD2-NH2 3.09Å
216A81.9Confident78.5Confident43 Ų43100.2 Ų100.236%0.35551%0.511SS..Hα-helixtrans-65.9-47.9172.100000111.5E212 E213 R214 E218 R219 E220E212-A216 WeakPolarHBondContact O-CB 3.46Å; E212-A216 PolarHBondContact O-N 3.33Å; E213-A216 WeakPolarHBondContact O-CB 3.28Å; E213-A216 PolarHBondContact O-N 3.16Å; R214-A216 VanDerWaalsContact C-N 3.32Å; A216-E218 PolarHBondContact O-N 2.87Å; A216-R219 PolarHBondContact O-N 3.09Å; A216-E220 WeakPolarHBondContact O-CB 3.45Å; A216-E220 WeakPolarHBondContact O-CG 3.34Å; A216-E220 PolarHBondContact O-N 3.49Å
217G80.8Confident78.8Confident33 Ų33100.2 Ų100.234%0.3451%0.508SS..Hα-helixtrans-66-36.6176.800000113E213 R214 L221E213-G217 PolarHBondContact O-N 3.4Å; R214-G217 PolarHBondContact O-N 2.98Å; G217-L221 WeakPolarHBondContact O-CB 3.2Å; G217-L221 PolarHBondContact O-N 3.44Å; G217-L221 VanDerWaalsContact O-N 3.09Å
218E82.4Confident79.1Confident97 Ų9799.2 Ų99.245%0.45351%0.506SS..Hα-helixtrans-65.4-43.7172.5-168.3172175.400110.6R214 A216 L221 Y222R214-E218 WeakPolarHBondContact O-CB 3.48Å; R214-E218 PolarHBondContact O-N 3.44Å; A216-E218 PolarHBondContact O-N 2.87Å; E218-L221 PolarHBondContact O-N 2.92Å; E218-Y222 HydrophobicContact CB-CD2 4.48Å; E218-Y222 HydrophobicContact CG-CD2 3.45Å; E218-Y222 VanDerWaalsContact CG-CD2 3.45Å; E218-Y222 HydrophobicContact CG-CE2 3.69Å; E218-Y222 WeakPolarHBondContact O-CB 3.33Å; E218-Y222 VanDerWaalsContact O-CD2 3.23Å; E218-Y222 WeakPolarHBondContact O-CD2 3.24Å; E218-Y222 PolarHBondContact O-N 3.41Å
219R83.1Confident79.4Confident143 Ų14393.2 Ų93.254%0.5448%0.481SS..Hα-helixtrans-63.6-48.8174.2-77.2179.3-152-170.74.7112.2D215 A216 L221 Y222 E223D215-R219 WeakPolarHBondContact O-CB 3.4Å; D215-R219 VanDerWaalsContact O-CG 3.25Å; D215-R219 WeakPolarHBondContact O-CG 3.22Å; D215-R219 PolarHBondContact O-N 3.38Å; D215-R219 IonicContact OD1-CZ 3.97Å; D215-R219 IonicContact OD1-NE 3.32Å; D215-R219 PolarHBondContact OD1-NE 3.11Å; D215-R219 IonicContact OD1-NH2 3.71Å; D215-R219 IonicContact OD2-CZ 3.21Å; D215-R219 IonicContact OD2-NE 3.24Å; D215-R219 PolarHBondContact OD2-NE 3.23Å; D215-R219 IonicContact OD2-NH2 2.62Å; D215-R219 PolarHBondContact OD2-NH2 3.09Å; A216-R219 PolarHBondContact O-N 3.09Å; R219-L221 PolarHBondContact O-N 2.94Å; R219-L221 VanDerWaalsContact O-N 3.16Å; R219-Y222 PolarHBondContact O-N 3.1Å; R219-E223 WeakPolarHBondContact O-CA 3.43Å; R219-E223 WeakPolarHBondContact O-CB 3.4Å; R219-E223 PolarHBondContact O-N 3.49Å
220E82.2Confident79.8Confident149 Ų14993.5 Ų93.570%0.69649%0.486SS*.Hα-helixtrans-57.4-34.4178.9-75.2178.1-173.600112.3A216 P224A216-E220 WeakPolarHBondContact O-CB 3.45Å; A216-E220 WeakPolarHBondContact O-CG 3.34Å; A216-E220 PolarHBondContact O-N 3.49Å; E220-P224 WeakPolarHBondContact O-CD 3.32Å; E220-P224 WeakPolarHBondContact O-CG 3.06Å
221L78.9Confident79.7Confident99 Ų9994 Ų9452%0.51849%0.493SS..Hα-helixtrans-80-43.9178.1-172.964.2000113.3G217 E218 R219 I225G217-L221 WeakPolarHBondContact O-CB 3.2Å; G217-L221 PolarHBondContact O-N 3.44Å; G217-L221 VanDerWaalsContact O-N 3.09Å; E218-L221 PolarHBondContact O-N 2.92Å; R219-L221 PolarHBondContact O-N 2.94Å; R219-L221 VanDerWaalsContact O-N 3.16Å; L221-I225 WeakPolarHBondContact O-CD1 3.17Å
222Y77.1Confident79.5Confident128 Ų12891.3 Ų91.350%0.50248%0.48SS..Hα-helixtrans-92.3-29.4-173.3-74.5-77.6000114E218 R219 I225 V226E218-Y222 HydrophobicContact CB-CD2 4.48Å; E218-Y222 HydrophobicContact CG-CD2 3.45Å; E218-Y222 VanDerWaalsContact CG-CD2 3.45Å; E218-Y222 HydrophobicContact CG-CE2 3.69Å; E218-Y222 WeakPolarHBondContact O-CB 3.33Å; E218-Y222 VanDerWaalsContact O-CD2 3.23Å; E218-Y222 WeakPolarHBondContact O-CD2 3.24Å; E218-Y222 PolarHBondContact O-N 3.41Å; R219-Y222 PolarHBondContact O-N 3.1Å; Y222-I225 WeakPolarHBondContact O-CB 3.28Å; Y222-I225 PolarHBondContact O-N 3.48Å; Y222-V226 WeakPolarHBondContact O-CB 3.39Å; Y222-V226 VanDerWaalsContact O-CG2 3.32Å; Y222-V226 WeakPolarHBondContact O-CG2 3.35Å; Y222-V226 PolarHBondContact O-N 3.23Å
223E81.7Confident78.6Confident105 Ų10587.8 Ų87.849%0.49147%0.466SS..Hα-helixtrans-57.8-47.1-178.6-174.5169.7-148.400111.2R219 I225 V226 E227R219-E223 WeakPolarHBondContact O-CA 3.43Å; R219-E223 WeakPolarHBondContact O-CB 3.4Å; R219-E223 PolarHBondContact O-N 3.49Å; E223-I225 VanDerWaalsContact C-N 3.31Å; E223-I225 PolarHBondContact O-N 2.96Å; E223-V226 PolarHBondContact O-N 3.39Å; E223-E227 HydrophobicContact CG-CG 4.38Å; E223-E227 VanDerWaalsContact O-CB 3.3Å; E223-E227 WeakPolarHBondContact O-CB 3.22Å; E223-E227 VanDerWaalsContact O-CG 3.26Å; E223-E227 WeakPolarHBondContact O-CG 3.34Å; E223-E227 PolarHBondContact O-N 2.92Å
224P83Confident77.4Confident34 Ų3486.6 Ų86.622%0.22147%0.47CS..Hα-helixtrans-57.5-39.3171.8-29.739.1000114.5E220 A228E220-P224 WeakPolarHBondContact O-CD 3.32Å; E220-P224 WeakPolarHBondContact O-CG 3.06Å; P224-A228 WeakPolarHBondContact O-CB 3.49Å; P224-A228 PolarHBondContact O-N 3.23Å
225I79.6Confident76.3Confident87 Ų8783.4 Ų83.445%0.44647%0.472SS..Hα-helixtrans-70.3-42.4-178.3-59.5173.2000109.9L221 Y222 E223 A229L221-I225 WeakPolarHBondContact O-CD1 3.17Å; Y222-I225 WeakPolarHBondContact O-CB 3.28Å; Y222-I225 PolarHBondContact O-N 3.48Å; E223-I225 VanDerWaalsContact C-N 3.31Å; E223-I225 PolarHBondContact O-N 2.96Å; I225-A229 VanDerWaalsContact O-CB 3.26Å; I225-A229 WeakPolarHBondContact O-CB 3.41Å; I225-A229 PolarHBondContact O-N 3.4Å
226V80.4Confident74.8Confident76 Ų7684.7 Ų84.746%0.46148%0.482SS..Hα-helixtrans-69.2-40.2178173.30000110.6Y222 E223 A229 N230Y222-V226 WeakPolarHBondContact O-CB 3.39Å; Y222-V226 VanDerWaalsContact O-CG2 3.32Å; Y222-V226 WeakPolarHBondContact O-CG2 3.35Å; Y222-V226 PolarHBondContact O-N 3.23Å; E223-V226 PolarHBondContact O-N 3.39Å; V226-A229 PolarHBondContact O-N 3.37Å; V226-N230 VanDerWaalsContact O-CB 3.26Å; V226-N230 WeakPolarHBondContact O-CB 3.48Å; V226-N230 PolarHBondContact O-N 2.71Å; V226-N230 PolarHBondContact O-ND2 3.36Å
227E83.6Confident72.6Confident117 Ų11787.8 Ų87.855%0.54749%0.488SS..Hα-helixtrans-65.3-44.5174.6-74.8-174.5166.300111.9E223 A229 N230 A231E223-E227 HydrophobicContact CG-CG 4.38Å; E223-E227 VanDerWaalsContact O-CB 3.3Å; E223-E227 WeakPolarHBondContact O-CB 3.22Å; E223-E227 VanDerWaalsContact O-CG 3.26Å; E223-E227 WeakPolarHBondContact O-CG 3.34Å; E223-E227 PolarHBondContact O-N 2.92Å; E227-A229 PolarHBondContact O-N 3.16Å; E227-N230 PolarHBondContact O-N 3.31Å; E227-A231 VanDerWaalsContact O-CB 3.29Å; E227-A231 WeakPolarHBondContact O-CB 3.23Å; E227-A231 PolarHBondContact O-N 3.21Å
228A78.1Confident70.7Confident61 Ų6190.7 Ų90.750%0.50450%0.5SS..Hα-helixtrans-62.8-42.4175.200000111.5P224 A231 A232P224-A228 WeakPolarHBondContact O-CB 3.49Å; P224-A228 PolarHBondContact O-N 3.23Å; A228-A231 PolarHBondContact O-N 3.35Å; A228-A232 WeakPolarHBondContact O-CB 3.46Å; A228-A232 PolarHBondContact O-N 3.34Å
229A76.1Confident68.6Low47 Ų4793.8 Ų93.839%0.38853%0.526SS..Hα-helixtrans-63.8-40.6174.500000111.8I225 V226 E227 N233I225-A229 VanDerWaalsContact O-CB 3.26Å; I225-A229 WeakPolarHBondContact O-CB 3.41Å; I225-A229 PolarHBondContact O-N 3.4Å; V226-A229 PolarHBondContact O-N 3.37Å; E227-A229 PolarHBondContact O-N 3.16Å; A229-N233 WeakPolarHBondContact O-CB 3.3Å; A229-N233 PolarHBondContact O-N 3Å; A229-N233 PolarHBondContact O-ND2 3.03Å
230N78.5Confident66.6Low96 Ų9689 Ų8951%0.51352%0.521SS..Hα-helixtrans-69.7-38.8176.9-75.5-21.4000112.2V226 E227 N233 S234V226-N230 VanDerWaalsContact O-CB 3.26Å; V226-N230 WeakPolarHBondContact O-CB 3.48Å; V226-N230 PolarHBondContact O-N 2.71Å; V226-N230 PolarHBondContact O-ND2 3.36Å; E227-N230 PolarHBondContact O-N 3.31Å; N230-N233 PolarHBondContact O-N 3.37Å; N230-S234 WeakPolarHBondContact O-CB 3.45Å; N230-S234 PolarHBondContact O-N 2.84Å
231A75.2Confident64.7Low57 Ų5789 Ų8947%0.47152%0.519SS..Hα-helixtrans-61.9-46.7174.400000110.7E227 A228 N233 S234 S235E227-A231 VanDerWaalsContact O-CB 3.29Å; E227-A231 WeakPolarHBondContact O-CB 3.23Å; E227-A231 PolarHBondContact O-N 3.21Å; A228-A231 PolarHBondContact O-N 3.35Å; A231-N233 VanDerWaalsContact C-N 3.33Å; A231-N233 PolarHBondContact O-N 2.68Å; A231-S234 PolarHBondContact O-N 3.09Å; A231-S234 PolarHBondContact O-OG 3.29Å; A231-S235 PolarHBondContact O-N 3.14Å; A231-S235 PolarHBondContact O-OG 2.65Å
232A67.9Low62.8Low49 Ų4992 Ų9241%0.40554%0.535SS..Hα-helixtrans-61.6-38.2173.700000112.5A228 S235 V236A228-A232 WeakPolarHBondContact O-CB 3.46Å; A228-A232 PolarHBondContact O-N 3.34Å; A232-S235 PolarHBondContact O-OG 2.63Å; A232-V236 VanDerWaalsContact O-CG2 3.25Å; A232-V236 WeakPolarHBondContact O-CG2 3.44Å; A232-V236 PolarHBondContact O-N 2.88Å
233N59.4Low61Low87 Ų8790.8 Ų90.847%0.46554%0.54SS..Hα-helixtrans-72.7-30.1177.4-71.5-29.5000112.7A229 N230 A231 F237A229-N233 WeakPolarHBondContact O-CB 3.3Å; A229-N233 PolarHBondContact O-N 3Å; A229-N233 PolarHBondContact O-ND2 3.03Å; N230-N233 PolarHBondContact O-N 3.37Å; A231-N233 VanDerWaalsContact C-N 3.33Å; A231-N233 PolarHBondContact O-N 2.68Å; N233-F237 PolarHBondContact O-N 2.85Å; N233-F237 VanDerWaalsContact O-N 3.1Å
234S56Low59.1Low85 Ų8593.9 Ų93.959%0.59456%0.56SS**Hα-helixtrans-72.1-30.4176.5750000113.3N230 A231N230-S234 WeakPolarHBondContact O-CB 3.45Å; N230-S234 PolarHBondContact O-N 2.84Å; A231-S234 PolarHBondContact O-N 3.09Å; A231-S234 PolarHBondContact O-OG 3.29Å
235S53.5Low56.9Low93 Ų9397.5 Ų97.565%0.6558%0.581SS**Hα-helixtrans-81.1-22.2176.3600000113.1A231 A232A231-S235 PolarHBondContact O-N 3.14Å; A231-S235 PolarHBondContact O-OG 2.65Å; A232-S235 PolarHBondContact O-OG 2.63Å
236V50.6Low54.8Low92 Ų9299.5 Ų99.556%0.55860%0.6SS**Hα-helixtrans-92.6-25.9179.4177.60000112.7A232A232-V236 VanDerWaalsContact O-CG2 3.25Å; A232-V236 WeakPolarHBondContact O-CG2 3.44Å; A232-V236 PolarHBondContact O-N 2.88Å
237F36.6Very low52.5Low108 Ų108104.2 Ų104.247%0.47462%0.619SS.*  trans-12880.4-179.4-60.5-75.7000112.4N233 V239 F241N233-F237 PolarHBondContact O-N 2.85Å; N233-F237 VanDerWaalsContact O-N 3.1Å; F237-V239 PolarHBondContact O-N 3.26Å; F237-F241 HydrophobicContact CD1-CB 4.27Å; F237-F241 AromaticContact CD1-CD1 3.97Å; F237-F241 HydrophobicContact CD1-CD1 3.97Å; F237-F241 HydrophobicContact CD1-CG 4.02Å; F237-F241 HydrophobicContact CE1-CD1 4.05Å; F237-F241 HydrophobicContact CE1-CE1 4.13Å; F237-F241 HydrophobicContact CE1-CG 4.43Å
238P39.9Very low49.9Very low94 Ų94107.3 Ų107.361%0.6163%0.631SS**  trans-57.9136.4165.523.6-30.2000109.3G240 F241P238-G240 PolarHBondContact O-N 2.97Å; P238-F241 PolarHBondContact O-N 2.94Å
239V39.2Very low47.8Very low163 Ų163111.9 Ų111.999%0.98865%0.646SS**THydrogen-bonded Turntrans-50.993.9179.1-178.30000109.3F237F237-V239 PolarHBondContact O-N 3.26Å
240G41.8Very low45.7Very low42 Ų42117.3 Ų117.343%0.43366%0.664SS.*THydrogen-bonded Turntrans149.9-9.3-171.800000116.3P238 L242 T243P238-G240 PolarHBondContact O-N 2.97Å; G240-L242 PolarHBondContact O-N 2.68Å; G240-T243 PolarHBondContact O-N 3.38Å; G240-T243 PolarHBondContact O-OG1 3.34Å
241F41.5Very low43.8Very low150 Ų150117.5 Ų117.566%0.65867%0.672SS**THydrogen-bonded Turntrans-54.5-18.7178.2-174.9-106.4000114.9F237 P238 T243F237-F241 HydrophobicContact CD1-CB 4.27Å; F237-F241 AromaticContact CD1-CD1 3.97Å; F237-F241 HydrophobicContact CD1-CD1 3.97Å; F237-F241 HydrophobicContact CD1-CG 4.02Å; F237-F241 HydrophobicContact CE1-CD1 4.05Å; F237-F241 HydrophobicContact CE1-CE1 4.13Å; F237-F241 HydrophobicContact CE1-CG 4.43Å; P238-F241 PolarHBondContact O-N 2.94Å; F241-T243 VanDerWaalsContact C-N 3.3Å; F241-T243 PolarHBondContact O-N 3.41Å
242L40Very low41.9Very low162 Ų162120.6 Ų120.685%0.84868%0.681SS**THydrogen-bonded Turntrans-8714.8174.7-61-176.2000114.6G240G240-L242 PolarHBondContact O-N 2.68Å
243T38.9Very low40.4Very low101 Ų101126.6 Ų126.662%0.6270%0.701SS**SBendtrans-108115172.952.80000110.9G240 F241 V245G240-T243 PolarHBondContact O-N 3.38Å; G240-T243 PolarHBondContact O-OG1 3.34Å; F241-T243 VanDerWaalsContact C-N 3.3Å; F241-T243 PolarHBondContact O-N 3.41Å; T243-V245 PolarHBondContact O-N 2.77Å
244D40.4Very low39.4Very low170 Ų170129.9 Ų129.991%0.90972%0.717SS**  trans-66.357.9-176.2-74.4-31.2000113.7
245V37.7Very low38.6Very low110 Ų110132 Ų13267%0.66772%0.718SS**  trans-112.8107.9169.1-174.40000108.6T243 M247T243-V245 PolarHBondContact O-N 2.77Å; V245-M247 PolarHBondContact O-N 2.85Å
246P34.5Very low38.2Very low130 Ų130132.6 Ų132.684%0.84472%0.722SS**  trans-75100.9179.428.4-29.9000108.7
247M33.2Very low38.2Very low175 Ų175135.3 Ų135.386%0.86273%0.729SS**  trans-103.7126.3169.2-149.6178.4-74.100110.9V245V245-M247 PolarHBondContact O-N 2.85Å
248K28.1Very low38.8Very low181 Ų181135.9 Ų135.979%0.78773%0.733SS**  trans-41.5124.3178.7-173.8179.9179-169.50112.8E250K248-E250 PolarHBondContact O-N 3.44Å
249L34.6Very low39.2Very low157 Ų157138.2 Ų138.282%0.82274%0.739SS**  trans-54.394.7169.2-166.488.2000109.9S251L249-S251 VanDerWaalsContact C-N 3.32Å; L249-S251 PolarHBondContact O-N 3.1Å
250E32.3Very low39.9Very low162 Ų162136.1 Ų136.176%0.75772%0.723SS**  trans-81.189.9163.2-80.2-169.812300108.1K248 N252K248-E250 PolarHBondContact O-N 3.44Å; E250-N252 PolarHBondContact O-N 3.11Å
251S38.6Very low40.9Very low99 Ų99138.5 Ų138.569%0.69273%0.725SS**  trans-62.784159.456.10000108.9L249L249-S251 VanDerWaalsContact C-N 3.32Å; L249-S251 PolarHBondContact O-N 3.1Å
252N34.8Very low41.8Very low123 Ų123134.9 Ų134.966%0.65872%0.719SS**  trans-141.1109.8165.6-83.8-37.5000108.8E250E250-N252 PolarHBondContact O-N 3.11Å
253Q36Very low42.8Very low175 Ų175133.6 Ų133.682%0.81871%0.708SS**  trans61.760.3150.5-55.3-174.8-18.300115.5
254L38.4Very low43.7Very low156 Ų156131.6 Ų131.682%0.81770%0.702SS**  trans-84.7102.8143.8-114.6165.3000105.7S256L254-S256 PolarHBondContact O-N 2.9Å
255E39.1Very low44.8Very low129 Ų129127.7 Ų127.760%0.60368%0.684SS**  trans-55121.2179.8-71.1171.4153.600109.3E257 E258E255-E257 PolarHBondContact O-N 3.38Å; E255-E258 PolarHBondContact O-N 3.38Å; E255-E258 VanDerWaalsContact O-N 3.17Å
256S47.1Very low46.1Very low106 Ų106128.4 Ų128.474%0.74168%0.679SS**THydrogen-bonded Turntrans-58.6-10.9174.239.90000113.5L254L254-S256 PolarHBondContact O-N 2.9Å
257E50.2Low47.2Very low149 Ų149126.5 Ų126.570%0.69666%0.66SS**Hα-helixtrans-75-24.5176.8-61.6-169.4176.600112.9E255 N261E255-E257 PolarHBondContact O-N 3.38Å; E257-N261 PolarHBondContact O-ND2 3.47Å; E257-N261 PolarHBondContact O-OD1 3.4Å
258E48.6Very low48.2Very low120 Ų120126 Ų12656%0.56165%0.654SS**Hα-helixtrans-79.2-23.6177.5-72.8-170.4157.400113.4E255E255-E258 PolarHBondContact O-N 3.38Å; E255-E258 VanDerWaalsContact O-N 3.17Å
259L49.2Very low49.9Very low142 Ų142122.4 Ų122.474%0.74364%0.639SS**Hα-helixtrans-74.8-36.2-178.9-144.378.4000112N261 S262L259-N261 VanDerWaalsContact C-N 3.25Å; L259-N261 PolarHBondContact O-N 2.95Å; L259-S262 WeakPolarHBondContact O-CB 3.48Å; L259-S262 PolarHBondContact O-N 3.31Å
260D54Low50.8Low120 Ų120120.4 Ų120.464%0.64262%0.624SS**Hα-helixtrans-69.4-27.4178.1-152.519.8000111.6S262D260-S262 VanDerWaalsContact C-N 3.25Å; D260-S262 PolarHBondContact O-N 3.2Å
261N61.9Low51.9Low91 Ų91115 Ų11549%0.48760%0.602SS.*Hα-helixtrans-69.1-24175.5-58.9-18.7000112.4E257 L259 A264 V265E257-N261 PolarHBondContact O-ND2 3.47Å; E257-N261 PolarHBondContact O-OD1 3.4Å; L259-N261 VanDerWaalsContact C-N 3.25Å; L259-N261 PolarHBondContact O-N 2.95Å; N261-A264 PolarHBondContact O-N 2.83Å; N261-V265 VanDerWaalsContact O-CB 3.26Å; N261-V265 WeakPolarHBondContact O-CB 3.34Å; N261-V265 WeakPolarHBondContact O-CG2 3.33Å; N261-V265 PolarHBondContact O-N 3.49Å
262S60.8Low52.6Low75 Ų75114.3 Ų114.352%0.52460%0.597SS.*Hα-helixtrans-69.8-37.1-177-63.60000112.2L259 D260 F266L259-S262 WeakPolarHBondContact O-CB 3.48Å; L259-S262 PolarHBondContact O-N 3.31Å; D260-S262 VanDerWaalsContact C-N 3.25Å; D260-S262 PolarHBondContact O-N 3.2Å; S262-F266 WeakPolarHBondContact O-CB 3.33Å; S262-F266 PolarHBondContact O-N 2.87Å
263E59.9Low53.5Low134 Ų134116.1 Ų116.163%0.62661%0.607SS**Hα-helixtrans-72.8-41.1175.5-172.3170.2-179.500111.2V265 F266 I267E263-V265 PolarHBondContact O-N 3.27Å; E263-F266 WeakPolarHBondContact O-CB 3.29Å; E263-F266 PolarHBondContact O-N 2.84Å; E263-I267 HydrophobicContact CG-CD1 4.29Å; E263-I267 WeakPolarHBondContact O-CG1 3.34Å; E263-I267 PolarHBondContact O-N 3.24Å
264A58.9Low54.5Low59 Ų59111.1 Ų111.149%0.48859%0.585SS.*Hα-helixtrans-64.4-39.4175.300000112.6N261 K268N261-A264 PolarHBondContact O-N 2.83Å; A264-K268 VanDerWaalsContact O-CB 3.25Å; A264-K268 WeakPolarHBondContact O-CB 3.48Å; A264-K268 PolarHBondContact O-N 3.35Å
265V62.5Low55.8Low89 Ų89106.7 Ų106.754%0.53957%0.568SS.*Hα-helixtrans-67.6-40.9174.91700000110.9N261 E263 K268 Q269N261-V265 VanDerWaalsContact O-CB 3.26Å; N261-V265 WeakPolarHBondContact O-CB 3.34Å; N261-V265 WeakPolarHBondContact O-CG2 3.33Å; N261-V265 PolarHBondContact O-N 3.49Å; E263-V265 PolarHBondContact O-N 3.27Å; V265-K268 PolarHBondContact O-N 3.17Å; V265-Q269 PolarHBondContact O-N 3.16Å
266F66.4Low56.9Low124 Ų124104.7 Ų104.754%0.54457%0.568SS.*Hα-helixtrans-57.9-51.2174.4-179.8-90.7000111.2S262 E263 K268 Q269 F270S262-F266 WeakPolarHBondContact O-CB 3.33Å; S262-F266 PolarHBondContact O-N 2.87Å; E263-F266 WeakPolarHBondContact O-CB 3.29Å; E263-F266 PolarHBondContact O-N 2.84Å; F266-K268 VanDerWaalsContact C-N 3.33Å; F266-K268 PolarHBondContact O-N 3.32Å; F266-Q269 PolarHBondContact O-N 2.94Å; F266-F270 HydrophobicContact CD1-CD2 4.09Å; F266-F270 HydrophobicContact CD1-CE2 4.13Å; F266-F270 AromaticContact CD2-CE2 3.88Å; F266-F270 HydrophobicContact CD2-CE2 3.88Å; F266-F270 AromaticContact CE1-CD2 3.86Å; F266-F270 HydrophobicContact CE1-CD2 3.86Å; F266-F270 AromaticContact CE1-CE2 3.69Å; F266-F270 HydrophobicContact CE1-CE2 3.69Å; F266-F270 HydrophobicContact CE2-CD2 4.33Å; F266-F270 AromaticContact CE2-CE2 3.44Å; F266-F270 HydrophobicContact CE2-CE2 3.44Å; F266-F270 VanDerWaalsContact CE2-CE2 3.44Å; F266-F270 HydrophobicContact CE2-CZ 4.22Å; F266-F270 HydrophobicContact CG-CD2 4.41Å; F266-F270 HydrophobicContact CG-CE2 4.21Å; F266-F270 AromaticContact CZ-CD2 3.99Å; F266-F270 HydrophobicContact CZ-CD2 3.99Å; F266-F270 AromaticContact CZ-CE2 3.33Å; F266-F270 HydrophobicContact CZ-CE2 3.33Å; F266-F270 HydrophobicContact CZ-CZ 4.1Å; F266-F270 VanDerWaalsContact O-CD2 3.23Å; F266-F270 WeakPolarHBondContact O-CD2 3.47Å; F266-F270 PolarHBondContact O-N 3.35Å
267I57.7Low58.1Low90 Ų90106.6 Ų106.646%0.46257%0.565SS.*Hα-helixtrans-61.5-43.3178-65.5170.4000110.7E263 Q269 F270 V271E263-I267 HydrophobicContact CG-CD1 4.29Å; E263-I267 WeakPolarHBondContact O-CG1 3.34Å; E263-I267 PolarHBondContact O-N 3.24Å; I267-Q269 VanDerWaalsContact C-N 3.27Å; I267-Q269 PolarHBondContact O-N 3.38Å; I267-F270 PolarHBondContact O-N 2.94Å; I267-V271 HydrophobicContact CG2-CG2 4.25Å; I267-V271 WeakPolarHBondContact O-CB 3.28Å; I267-V271 VanDerWaalsContact O-CG2 3.26Å; I267-V271 WeakPolarHBondContact O-CG2 3.31Å; I267-V271 PolarHBondContact O-N 3.47Å
268K54.3Low59.1Low165 Ų165104.6 Ų104.672%0.71756%0.555SS**Hα-helixtrans-64.4-30.4-178.6-158.4174.8-172.8179.70113A264 V265 F266 V271 S272A264-K268 VanDerWaalsContact O-CB 3.25Å; A264-K268 WeakPolarHBondContact O-CB 3.48Å; A264-K268 PolarHBondContact O-N 3.35Å; V265-K268 PolarHBondContact O-N 3.17Å; F266-K268 VanDerWaalsContact C-N 3.33Å; F266-K268 PolarHBondContact O-N 3.32Å; K268-V271 CarbonylContact O-C 3.39Å; K268-V271 PolarHBondContact O-N 2.81Å; K268-S272 PolarHBondContact O-N 3.03Å; K268-S272 PolarHBondContact O-OG 3.46Å
269Q62.5Low60Low105 Ų105101.6 Ų101.649%0.49154%0.543SS..Hα-helixtrans-71.5-41.7176.6-178.1163.8-18.400112.4V265 F266 I267 V271 S272V265-Q269 PolarHBondContact O-N 3.16Å; F266-Q269 PolarHBondContact O-N 2.94Å; I267-Q269 VanDerWaalsContact C-N 3.27Å; I267-Q269 PolarHBondContact O-N 3.38Å; Q269-V271 PolarHBondContact O-N 2.96Å; Q269-S272 PolarHBondContact O-OG 3.12Å
270F53.8Low61.2Low116 Ų11699.6 Ų99.651%0.50953%0.533SS..Hα-helixtrans-72.5-19.6175.1-73.2-75.5000113.4F266 I267F266-F270 HydrophobicContact CD1-CD2 4.09Å; F266-F270 HydrophobicContact CD1-CE2 4.13Å; F266-F270 AromaticContact CD2-CE2 3.88Å; F266-F270 HydrophobicContact CD2-CE2 3.88Å; F266-F270 AromaticContact CE1-CD2 3.86Å; F266-F270 HydrophobicContact CE1-CD2 3.86Å; F266-F270 AromaticContact CE1-CE2 3.69Å; F266-F270 HydrophobicContact CE1-CE2 3.69Å; F266-F270 HydrophobicContact CE2-CD2 4.33Å; F266-F270 AromaticContact CE2-CE2 3.44Å; F266-F270 HydrophobicContact CE2-CE2 3.44Å; F266-F270 VanDerWaalsContact CE2-CE2 3.44Å; F266-F270 HydrophobicContact CE2-CZ 4.22Å; F266-F270 HydrophobicContact CG-CD2 4.41Å; F266-F270 HydrophobicContact CG-CE2 4.21Å; F266-F270 AromaticContact CZ-CD2 3.99Å; F266-F270 HydrophobicContact CZ-CD2 3.99Å; F266-F270 AromaticContact CZ-CE2 3.33Å; F266-F270 HydrophobicContact CZ-CE2 3.33Å; F266-F270 HydrophobicContact CZ-CZ 4.1Å; F266-F270 VanDerWaalsContact O-CD2 3.23Å; F266-F270 WeakPolarHBondContact O-CD2 3.47Å; F266-F270 PolarHBondContact O-N 3.35Å; I267-F270 PolarHBondContact O-N 2.94Å
271V55Low62.2Low47 Ų47102.7 Ų102.729%0.28554%0.536SS..THydrogen-bonded Turntrans-114.842.6-177.4-167.30000109.9I267 K268 Q269 D273 I274 L279I267-V271 HydrophobicContact CG2-CG2 4.25Å; I267-V271 WeakPolarHBondContact O-CB 3.28Å; I267-V271 VanDerWaalsContact O-CG2 3.26Å; I267-V271 WeakPolarHBondContact O-CG2 3.31Å; I267-V271 PolarHBondContact O-N 3.47Å; K268-V271 CarbonylContact O-C 3.39Å; K268-V271 PolarHBondContact O-N 2.81Å; Q269-V271 PolarHBondContact O-N 2.96Å; V271-D273 VanDerWaalsContact C-N 3.29Å; V271-I274 HydrophobicContact CG1-CB 3.77Å; V271-I274 HydrophobicContact CG1-CD1 4.34Å; V271-I274 HydrophobicContact CG1-CG2 4.23Å; V271-L279 HydrophobicContact CG1-CD1 3.74Å
272S53.9Low62.8Low85 Ų85102.8 Ų102.859%0.59454%0.536SS*.SBendtrans-72.7-23.4178.1-61.40000112.8K268 Q269K268-S272 PolarHBondContact O-N 3.03Å; K268-S272 PolarHBondContact O-OG 3.46Å; Q269-S272 PolarHBondContact O-OG 3.12Å
273D53.5Low63.5Low162 Ų162105 Ų10587%0.86654%0.536SS*.SBendtrans-98-3.8-172.6-69.1-12.5000114.4V271V271-D273 VanDerWaalsContact C-N 3.29Å
274I57.7Low64.2Low69 Ų69101.2 Ų101.235%0.35453%0.525SS..SBendtrans-102.3118.2177.1-77.3169.4000108.6V271 E278 L279 L282V271-I274 HydrophobicContact CG1-CB 3.77Å; V271-I274 HydrophobicContact CG1-CD1 4.34Å; V271-I274 HydrophobicContact CG1-CG2 4.23Å; I274-E278 HydrophobicContact CG2-CB 4.14Å; I274-E278 HydrophobicContact CG2-CG 4.47Å; I274-L279 HydrophobicContact CG2-CB 3.82Å; I274-L279 HydrophobicContact CG2-CD1 4.14Å; I274-L282 HydrophobicContact CD1-CD1 4.31Å
275S64.6Low65.1Low64 Ų64106 Ų10645%0.44854%0.537SS..  trans-59.4144.6172.672.50000110.2E277 E278 L279S275-E277 PolarHBondContact O-N 3.02Å; S275-E278 PolarHBondContact O-N 2.86Å; S275-E278 WeakPolarHBondContact OG-CB 3.45Å; S275-E278 PolarHBondContact OG-N 3.41Å; S275-L279 PolarHBondContact O-N 3.34Å
276S62.6Low65.4Low87 Ų87106 Ų10661%0.60855%0.546SS*.Hα-helixtrans-52.5-33.5-179.249.40000113.2D280S276-D280 WeakPolarHBondContact O-CB 3.35Å; S276-D280 PolarHBondContact O-N 2.69Å
277E71.3Confident65.3Low146 Ų146106.1 Ų106.168%0.68255%0.552SS**Hα-helixtrans-69.9-33.8177.8-62.2178-174.600112.9S275 R281S275-E277 PolarHBondContact O-N 3.02Å; E277-R281 WeakPolarHBondContact O-CB 3.29Å; E277-R281 VanDerWaalsContact O-CG 3.23Å; E277-R281 WeakPolarHBondContact O-CG 3.23Å; E277-R281 PolarHBondContact O-N 3.43Å
278E72.6Confident64.9Low106 Ų106104.7 Ų104.750%0.49556%0.559SS.*Hα-helixtrans-78.4-33.9178.2-170.4163.9-160.100111.1I274 S275 R281 L282I274-E278 HydrophobicContact CG2-CB 4.14Å; I274-E278 HydrophobicContact CG2-CG 4.47Å; S275-E278 PolarHBondContact O-N 2.86Å; S275-E278 WeakPolarHBondContact OG-CB 3.45Å; S275-E278 PolarHBondContact OG-N 3.41Å; E278-R281 PolarHBondContact O-N 3.14Å; E278-L282 WeakPolarHBondContact O-CB 3.29Å; E278-L282 VanDerWaalsContact O-CG 3.29Å; E278-L282 WeakPolarHBondContact O-CG 3.32Å; E278-L282 PolarHBondContact O-N 2.95Å
279L67.9Low64.9Low57 Ų57104.3 Ų104.330%0.29856%0.56SS.*Hα-helixtrans-60.5-52.4168.7-166.4100.1000110.9V271 I274 S275 R281 L282 F283V271-L279 HydrophobicContact CG1-CD1 3.74Å; I274-L279 HydrophobicContact CG2-CB 3.82Å; I274-L279 HydrophobicContact CG2-CD1 4.14Å; S275-L279 PolarHBondContact O-N 3.34Å; L279-R281 VanDerWaalsContact C-N 3.27Å; L279-R281 PolarHBondContact O-N 2.82Å; L279-L282 PolarHBondContact O-N 2.86Å; L279-L282 VanDerWaalsContact O-N 3.14Å; L279-F283 HydrophobicContact CD1-CE2 4Å; L279-F283 HydrophobicContact CD2-CD2 3.97Å; L279-F283 HydrophobicContact CD2-CE2 3.7Å; L279-F283 HydrophobicContact CG-CD2 3.74Å; L279-F283 HydrophobicContact CG-CE2 3.57Å; L279-F283 WeakPolarHBondContact O-CD2 3.33Å; L279-F283 PolarHBondContact O-N 3.13Å
280D73.2Confident63.7Low100 Ų100107.9 Ų107.954%0.53558%0.576SS.*Hα-helixtrans-61.9-36.4179.8-74.2-18.1000111.5S276 S284S276-D280 WeakPolarHBondContact O-CB 3.35Å; S276-D280 PolarHBondContact O-N 2.69Å; D280-S284 VanDerWaalsContact O-CB 3.29Å; D280-S284 WeakPolarHBondContact O-CB 3.21Å; D280-S284 PolarHBondContact O-N 3.41Å; D280-S284 PolarHBondContact O-OG 3.15Å
281R74.7Confident62.8Low185 Ų185110.7 Ų110.770%0.69859%0.591SS**Hα-helixtrans-65-46.1172.2-81.2175.6172.4-139.9-0.6112.6E277 E278 L279 F283 S284 E285E277-R281 WeakPolarHBondContact O-CB 3.29Å; E277-R281 VanDerWaalsContact O-CG 3.23Å; E277-R281 WeakPolarHBondContact O-CG 3.23Å; E277-R281 PolarHBondContact O-N 3.43Å; E278-R281 PolarHBondContact O-N 3.14Å; L279-R281 VanDerWaalsContact C-N 3.27Å; L279-R281 PolarHBondContact O-N 2.82Å; R281-F283 VanDerWaalsContact C-N 3.29Å; R281-F283 PolarHBondContact O-N 3.04Å; R281-S284 PolarHBondContact O-N 3.09Å; R281-E285 VanDerWaalsContact O-CB 3.22Å; R281-E285 WeakPolarHBondContact O-CB 3.42Å; R281-E285 PolarHBondContact O-N 2.81Å
282L75Confident62Low94 Ų94115 Ų11549%0.49262%0.618SS.*Hα-helixtrans-61.2-40.1177-78.7166.5000111.2I274 E278 L279 A286I274-L282 HydrophobicContact CD1-CD1 4.31Å; E278-L282 WeakPolarHBondContact O-CB 3.29Å; E278-L282 VanDerWaalsContact O-CG 3.29Å; E278-L282 WeakPolarHBondContact O-CG 3.32Å; E278-L282 PolarHBondContact O-N 2.95Å; L279-L282 PolarHBondContact O-N 2.86Å; L279-L282 VanDerWaalsContact O-N 3.14Å; L282-A286 WeakPolarHBondContact O-CB 3.36Å; L282-A286 PolarHBondContact O-N 2.8Å
283F75.5Confident61.1Low120 Ų120115.9 Ų115.953%0.52663%0.63SS.*Hα-helixtrans-67.3-45.4174.7-82.7-68.2000112L279 R281 E285 A286 L287L279-F283 HydrophobicContact CD1-CE2 4Å; L279-F283 HydrophobicContact CD2-CD2 3.97Å; L279-F283 HydrophobicContact CD2-CE2 3.7Å; L279-F283 HydrophobicContact CG-CD2 3.74Å; L279-F283 HydrophobicContact CG-CE2 3.57Å; L279-F283 WeakPolarHBondContact O-CD2 3.33Å; L279-F283 PolarHBondContact O-N 3.13Å; R281-F283 VanDerWaalsContact C-N 3.29Å; R281-F283 PolarHBondContact O-N 3.04Å; F283-E285 VanDerWaalsContact C-N 3.32Å; F283-E285 PolarHBondContact O-N 3.2Å; F283-A286 PolarHBondContact O-N 2.98Å; F283-L287 VanDerWaalsContact O-CB 3.25Å; F283-L287 WeakPolarHBondContact O-CB 3Å; F283-L287 WeakPolarHBondContact O-CG 3.3Å; F283-L287 PolarHBondContact O-N 3.16Å
284S74.5Confident60.1Low56 Ų56113 Ų11339%0.39263%0.629SS.*Hα-helixtrans-64.1-37.3178.6-55.80000112.1D280 R281 G288 E289D280-S284 VanDerWaalsContact O-CB 3.29Å; D280-S284 WeakPolarHBondContact O-CB 3.21Å; D280-S284 PolarHBondContact O-N 3.41Å; D280-S284 PolarHBondContact O-OG 3.15Å; R281-S284 PolarHBondContact O-N 3.09Å; S284-G288 PolarHBondContact O-N 3.39Å; S284-E289 PolarHBondContact O-N 3.12Å
285E77.5Confident58.8Low160 Ų160119.4 Ų119.475%0.74865%0.654SS**Hα-helixtrans-74.1-41177.4-174.1158.8179.400111.8R281 F283 L287 G288R281-E285 VanDerWaalsContact O-CB 3.22Å; R281-E285 WeakPolarHBondContact O-CB 3.42Å; R281-E285 PolarHBondContact O-N 2.81Å; F283-E285 VanDerWaalsContact C-N 3.32Å; F283-E285 PolarHBondContact O-N 3.2Å; E285-L287 VanDerWaalsContact C-N 3.28Å; E285-L287 PolarHBondContact O-N 3.25Å; E285-G288 PolarHBondContact O-N 2.81Å
286A69.8Low57.2Low87 Ų87124.1 Ų124.172%0.71967%0.674SS**Hα-helixtrans-65.6-31.4174.100000112.7L282 F283 G288L282-A286 WeakPolarHBondContact O-CB 3.36Å; L282-A286 PolarHBondContact O-N 2.8Å; F283-A286 PolarHBondContact O-N 2.98Å; A286-G288 VanDerWaalsContact C-N 3.31Å
287L64.6Low55.6Low128 Ų128126.5 Ų126.567%0.6769%0.685SS**THydrogen-bonded Turntrans-85-0.5177.4-68.4171000113.5F283 E285 E289F283-L287 VanDerWaalsContact O-CB 3.25Å; F283-L287 WeakPolarHBondContact O-CB 3Å; F283-L287 WeakPolarHBondContact O-CG 3.3Å; F283-L287 PolarHBondContact O-N 3.16Å; E285-L287 VanDerWaalsContact C-N 3.28Å; E285-L287 PolarHBondContact O-N 3.25Å; L287-E289 VanDerWaalsContact C-N 3.28Å; L287-E289 PolarHBondContact O-N 3.37Å
288G48.4Very low53.5Low60 Ų60126.9 Ų126.962%0.61969%0.69SS**THydrogen-bonded Turntrans66.725171.800000114.5S284 E285 A286 H290S284-G288 PolarHBondContact O-N 3.39Å; E285-G288 PolarHBondContact O-N 2.81Å; A286-G288 VanDerWaalsContact C-N 3.31Å; G288-H290 PolarHBondContact O-N 3.02Å
289E53.7Low51.2Low156 Ų156131.4 Ų131.473%0.72970%0.703SS**  trans-75.172.5175.7-69.8-167.9173.700110.9S284 L287S284-E289 PolarHBondContact O-N 3.12Å; L287-E289 VanDerWaalsContact C-N 3.28Å; L287-E289 PolarHBondContact O-N 3.37Å
290H38.1Very low49.4Very low180 Ų180140.1 Ų140.183%0.83373%0.734SS**  trans-124.961.4168.2-162.9-75.1000110.6G288G288-H290 PolarHBondContact O-N 3.02Å
291E35.6Very low47.1Very low176 Ų176142.3 Ų142.382%0.82275%0.745SS**SBendtrans-153.6130158.7-127.4170.5171.100114.1
292T38.4Very low44.8Very low138 Ų138142.6 Ų142.685%0.84775%0.751SS**SBendtrans87.244.8162.175.90000120.7
293A33.4Very low42.5Very low102 Ų102142.2 Ų142.284%0.84376%0.757SS**SBendtrans-132.210.615800000116
294A34.1Very low40.4Very low102 Ų102143.4 Ų143.484%0.84377%0.769SS**SBendtrans-104.617.6-178.900000115.2
295K30.3Very low38.1Very low203 Ų203149.1 Ų149.188%0.88379%0.794SS**SBendtrans-124.459.5174.2-99.5-175.5179.8173.50111.7
296N29.4Very low35.7Very low164 Ų164148.8 Ų148.888%0.87780%0.798SS**SBendtrans-166.546.6150.4-106.3-8000113.4
297T29.2Very low33.7Very low137 Ų137152.4 Ų152.484%0.8480%0.8SS**  trans-12965.7165.1-460000109.6
298I28.1Very low31.9Very low153 Ų153152.5 Ų152.579%0.78580%0.801SS**  trans-124.2107.5160.4-64.3-178.2000107.9
299R23.9Very low30.9Very low202 Ų202155.8 Ų155.876%0.76280%0.804SS**  trans82.392.6140.2-164.3-171.6-73.4-172.7-3.4116.7
300Y29.4Very low29.7Very low240 Ų240155.4 Ų155.494%0.94181%0.807SS**  -140.8106.7116.8-100.3-80.3000110.4
301N26.6Very low29.1Very low145 Ų145152.3 Ų152.378%0.77581%0.806SS**  trans-73.1144.4165.7-90-32.3000109.9
302K25.8Very low29Very low192 Ų192149.3 Ų149.384%0.83580%0.804SS**  trans61.2112.3131-167.6176.6-173.7175.80118.1
303S27.1Very low28.4Very low86 Ų86151.3 Ų151.360%0.60180%0.804SS**  169.7140.595.8-130.90000111.8
304D30.8Very low28.2Very low145 Ų145155.8 Ų155.878%0.77581%0.805SS**  trans63.797.5146.4-55-39.5000120.6N306D304-N306 PolarHBondContact O-N 2.8Å
305N26.8Very low27.8Very low175 Ų175154.9 Ų154.994%0.93679%0.789SS**  trans-56.5114.4150.3-73.2-34.9000110.1
306N27.4Very low27.6Very low153 Ų153152.2 Ų152.282%0.81879%0.785SS**  trans-140.2137.9157.9-149.82.6000111.5D304D304-N306 PolarHBondContact O-N 2.8Å
307H25.8Very low27.6Very low164 Ų164150.3 Ų150.376%0.75978%0.779SS**  trans-48.1138.2177.4-82.2-48.8000114.5
308N28Very low27.8Very low130 Ų130151 Ų15170%0.69578%0.777SS**  158.5129.2109.4-88.6-38.4000112.3
309N26.3Very low27.5Very low128 Ų128153.7 Ų153.768%0.68478%0.779SS**  trans33.3115.3130.1-56.2-14.7000119
310N29.8Very low27.8Very low149 Ų149150 Ų15080%0.79778%0.781SS**  160.4122.7107.1-82.4-29.1000112.3
311S25.5Very low27.6Very low114 Ų114147 Ų14780%0.79777%0.769SS**  trans8.1124.3141-44.90000120.9
312S33.7Very low27.8Very low114 Ų114147.5 Ų147.580%0.79777%0.771SS**  trans172.1112.8132.140.30000106.9
313E24.6Very low27.8Very low180 Ų180143 Ų14384%0.84176%0.755SS**  6595.673.4-166.1170.4-168.300114.2
314F29.5Very low27.9Very low195 Ų195148.3 Ų148.386%0.85577%0.767SS**  trans-175.896.8144.7-140.3-104.8000108.7
315T26.6Very low27.6Very low84 Ų84149.6 Ų149.652%0.51577%0.768SS.*  59.711792.661.10000118
316D26.3Very low27.7Very low147 Ų147149.9 Ų149.979%0.78676%0.764SS**  trans78.3143.5135.4-76-25.3000123.7
317T29.1Very low27.5Very low124 Ų124148.6 Ų148.676%0.76176%0.762SS**  trans79.8128.2167.560.60000116.3
318D32.1Very low27.8Very low150 Ų150146.2 Ų146.280%0.80276%0.759SS**  cis-154.2142.915.1-101.2-35.3000110.6
319Y22.4Very low27.8Very low211 Ų211148.6 Ų148.683%0.82777%0.765SS**  trans-82.6152.5162.8-98.6-95.1000110.1
320P31.3Very low27.8Very low123 Ų123151.9 Ų151.980%0.79977%0.774SS**  trans-125.4116.9130.831.5-20.1000110.6
321Y24.9Very low27.8Very low177 Ų177150.1 Ų150.169%0.69477%0.773SS**  trans-101.5114.9169.5-178.1-116.2000107.8I323Y321-I323 HydrophobicContact CD1-CD1 4.13Å; Y321-I323 HydrophobicContact CD1-CG1 4.06Å; Y321-I323 HydrophobicContact CE1-CD1 3.15Å; Y321-I323 HydrophobicContact CE1-CG1 3.27Å; Y321-I323 HydrophobicContact CE2-CG1 4.22Å; Y321-I323 WeakPolarHBondContact OH-CD1 3.19Å; Y321-I323 VanDerWaalsContact OH-CG1 3.28Å; Y321-I323 WeakPolarHBondContact OH-CG1 3.27Å
322I30.4Very low28.1Very low157 Ų157153.3 Ų153.381%0.80578%0.775SS**  trans-113.2106.2166.9-64.6-172.5000107.8
323I26.2Very low28Very low98 Ų98152.8 Ų152.850%0.50377%0.771SS.*  trans-78.4130.9156.4-67.2161.2000107.4Y321Y321-I323 HydrophobicContact CD1-CD1 4.13Å; Y321-I323 HydrophobicContact CD1-CG1 4.06Å; Y321-I323 HydrophobicContact CE1-CD1 3.15Å; Y321-I323 HydrophobicContact CE1-CG1 3.27Å; Y321-I323 HydrophobicContact CE2-CG1 4.22Å; Y321-I323 WeakPolarHBondContact OH-CD1 3.19Å; Y321-I323 VanDerWaalsContact OH-CG1 3.28Å; Y321-I323 WeakPolarHBondContact OH-CG1 3.27Å
324K27.8Very low28.5Very low197 Ų197149.5 Ų149.586%0.85777%0.766SS**  -150.9111.8126.8-70.8-156.5-175.3176.90110.3
325Q24.3Very low28.8Very low171 Ų171146.3 Ų146.380%0.79976%0.764SS**  trans-59.3133.3151.7-85.2165.6-62.800109.1
326E29.4Very low29.3Very low181 Ų181149.2 Ų149.285%0.84678%0.775SS**  trans-139113.9146.2-159.7163.7-155.900108.5V328E326-V328 HydrophobicContact CG-CG2 4.44Å
327T23.3Very low29.6Very low126 Ų126149.8 Ų149.877%0.77378%0.777SS**  trans-95.1104.5174.2-550000106.8
328V33.3Very low29.8Very low115 Ų115154.9 Ų154.970%0.69778%0.783SS**  trans-141.9107.4162.4-178.90000109.8E326E326-V328 HydrophobicContact CG-CG2 4.44Å
329E26.7Very low30.1Very low179 Ų179151.5 Ų151.584%0.83678%0.775SS**  trans35.5119.3141.3-97.4173.416100122.3S331E329-S331 PolarHBondContact O-N 2.86Å
330K25.9Very low30.7Very low197 Ų197150.5 Ų150.586%0.85778%0.781SS**  trans-8.1116.4142.1-79.5174.5170.31760115.7
331S31.3Very low31.1Very low112 Ų112153.3 Ų153.378%0.78378%0.783SS**  trans-130.8125.4142.799.40000109.5E329E329-S331 PolarHBondContact O-N 2.86Å
332H30.9Very low31.7Very low182 Ų182149.7 Ų149.784%0.84378%0.784SS**  trans-66.4121.8178.2-83-106.8000111.5
333S32.4Very low32Very low102 Ų102151 Ų15171%0.71379%0.787SS**  trans-153.2130.9146.742.10000109.1
334P34Very low32.3Very low112 Ų112156.1 Ų156.173%0.72780%0.801SS**  trans-72.3155-165.329.7-34.5000112.5I336P334-I336 PolarHBondContact O-N 3.18Å
335P36.5Very low33Very low128 Ų128150.6 Ų150.683%0.83179%0.792SS**  trans-65.5121.4179.226.5-31.6000110L337P335-L337 PolarHBondContact O-N 2.94Å; P335-L337 VanDerWaalsContact O-N 3.15Å
336I36Very low33.6Very low145 Ų145147.7 Ų147.774%0.74479%0.786SS**  trans-66.6110.4170.6-67.3169.9000106.8P334 W338P334-I336 PolarHBondContact O-N 3.18Å; I336-W338 VanDerWaalsContact O-CD1 3.32Å; I336-W338 PolarHBondContact O-N 3.04Å; I336-W338 VanDerWaalsContact O-N 3.13Å
337L33.3Very low34Very low158 Ų158146.5 Ų146.583%0.82779%0.786SS**  trans-69.5102.1176.7-155.7152.7000106.9P335 A339P335-L337 PolarHBondContact O-N 2.94Å; P335-L337 VanDerWaalsContact O-N 3.15Å; L337-A339 PolarHBondContact O-N 2.93Å
338W32.6Very low34.9Very low232 Ų232146.8 Ų146.888%0.87978%0.782SS**  trans-65.587.3171.9-67.683.8000108.1I336 M340I336-W338 VanDerWaalsContact O-CD1 3.32Å; I336-W338 PolarHBondContact O-N 3.04Å; I336-W338 VanDerWaalsContact O-N 3.13Å; W338-M340 PolarHBondContact O-N 2.96Å
339A38.6Very low35.1Very low78 Ų78148.6 Ų148.665%0.64579%0.788SS**  trans-61.7117.6158.200000106.5L337 E341L337-A339 PolarHBondContact O-N 2.93Å; A339-E341 PolarHBondContact O-N 3.37Å
340M36.3Very low35.7Very low191 Ų191149.9 Ų149.994%0.94179%0.794SS**  trans-42.3102.8173.4-85.8156.756.400110.3W338 S342W338-M340 PolarHBondContact O-N 2.96Å; M340-S342 PolarHBondContact O-N 2.67Å
341E38.5Very low36.3Very low181 Ų181145.7 Ų145.785%0.84679%0.79SS**  trans-75.3121.2167.3-153.2152.5-158.500105.9A339 E343A339-E341 PolarHBondContact O-N 3.37Å; E341-E343 PolarHBondContact O-N 3.07Å
342S37.6Very low36.5Very low102 Ų102145.1 Ų145.171%0.71379%0.786SS**  trans-63.495.4-178.352.10000109.9M340 Y344M340-S342 PolarHBondContact O-N 2.67Å; S342-Y344 PolarHBondContact O-N 3.08Å
343E37.1Very low36.6Very low184 Ų184143.4 Ų143.486%0.8678%0.783SS**  trans-80.798.9170.7-156.9166.3-153.500108.3E341 A345E341-E343 PolarHBondContact O-N 3.07Å; E343-A345 VanDerWaalsContact C-N 3.25Å; E343-A345 PolarHBondContact O-N 3.5Å
344Y33.6Very low36.7Very low206 Ų206147 Ų14781%0.80879%0.793SS**  trans-59.791.6159.4-92.1-98.4000107.8S342 T346S342-Y344 PolarHBondContact O-N 3.08Å; Y344-T346 PolarHBondContact O-N 3.22Å; Y344-T346 VanDerWaalsContact O-N 3.12Å
345A40.8Very low36.5Very low81 Ų81150 Ų15067%0.66980%0.799SS**  trans-71100.4159.900000106.8E343 D347E343-A345 VanDerWaalsContact C-N 3.25Å; E343-A345 PolarHBondContact O-N 3.5Å; A345-D347 PolarHBondContact O-N 3.28Å
346T38Very low36.2Very low110 Ų110147.2 Ų147.268%0.67579%0.793SS**  trans-80.5108.5169.2-30.70000105.1Y344 D348Y344-T346 PolarHBondContact O-N 3.22Å; Y344-T346 VanDerWaalsContact O-N 3.12Å; T346-D348 PolarHBondContact O-N 3.14Å
347D38.3Very low35.9Very low156 Ų156149.6 Ų149.683%0.83480%0.801SS**  trans-7376176-66.3-30.9000110.3A345A345-D347 PolarHBondContact O-N 3.28Å
348D41.1Very low36Very low131 Ų131148.6 Ų148.670%0.70180%0.801SS**  trans-120.5103.2155.7-65-46.9000102.4T346T346-D348 PolarHBondContact O-N 3.14Å
349D37.1Very low35.9Very low154 Ų154147.8 Ų147.882%0.82480%0.8SS**  175.8109.975.142.1-0.6000112
350E40Very low35.6Very low205 Ų205149 Ų14996%0.95880%0.801SS**  trans-14962157.9-144.3179.6-160.900111.3
351S38.1Very low35.4Very low109 Ų109145.3 Ų145.376%0.76279%0.794SS**  trans-114.8109.2165.468.40000110.8
352S34.8Very low35.1Very low101 Ų101142 Ų14271%0.70679%0.788SS**SBendtrans87.5121.3141.6-37.90000118.5
353D33.2Very low34.5Very low145 Ų145145.4 Ų145.478%0.77580%0.795SS**  trans80.373.6144.3-54.1-16.6000117.1M355D353-M355 PolarHBondContact O-N 2.77Å
354I34.3Very low34.2Very low179 Ų179143.6 Ų143.692%0.91879%0.79SS**  trans-49.5110.8141.2-101.7170.7000108.2
355M31.6Very low33.7Very low175 Ų175142.6 Ų142.686%0.86279%0.794SS**  trans-60.3142.7-176.6-81.6-105.1-78.300113.3D353D353-M355 PolarHBondContact O-N 2.77Å
356G30.2Very low33.2Very low69 Ų69145.7 Ų145.771%0.71180%0.8SS**  trans-60.5160.2166.900000113.8
357E29.3Very low32.6Very low194 Ų194148.8 Ų148.891%0.90780%0.804SS**  trans-44132.1167.6-64174.1139.600112.4
358V34.9Very low32.5Very low138 Ų138148.3 Ų148.384%0.83680%0.802SS**  173.1123.1116.4164.90000109.3
359Y30.2Very low32Very low214 Ų214148 Ų14884%0.83980%0.804SS**  trans-68.7171.1169.7-89-96.2000112.6
360P33Very low31.7Very low105 Ų105150.1 Ų150.168%0.68281%0.809SS**  -137.7-169.7-5839.8-20.6000112.1
361S32.2Very low31.5Very low112 Ų112149.1 Ų149.178%0.78380%0.804SS**  trans95.5149.2152.8-108.70000118.2
362P31.3Very low31.4Very low113 Ų113152.2 Ų152.273%0.73481%0.806SS**  -133.6-177.6-97.933.2-12.9000114
363M25.5Very low31.2Very low172 Ų172151 Ų15185%0.84781%0.81SS**  trans110.3137.4138.8-137.9-178.4-153.100117.9
364I30.1Very low31.3Very low147 Ų147153.2 Ų153.275%0.75481%0.813SS**  trans95.396.5157.4-47.6175.3000115.4
365M23.7Very low31.1Very low184 Ų184150.6 Ų150.691%0.90681%0.805SS**  64103.880.9-94-171.7144.200116.9
366N30Very low31.2Very low146 Ų146151.6 Ų151.678%0.78181%0.805SS**  175.3119.6128.9-122.1-1.3000108.6
367K26.5Very low31.3Very low176 Ų176154.2 Ų154.277%0.76581%0.807SS**  56.5103.674.3-118.2-174-175.7179.30113.5
368D35.5Very low31.4Very low146 Ų146155.5 Ų155.578%0.78180%0.803SS**  179.3136.8103.6-79.3-26.8000111.4
369V30.9Very low32.1Very low125 Ų125158.9 Ų158.976%0.75881%0.807SS**  trans-115.8138.5-179164.20000105.7
370E31.6Very low32.1Very low198 Ų198156.7 Ų156.793%0.92581%0.805SS**  trans-164.4134.9147.6-110.3164.8-151.300112.8
371H34.3Very low32.5Very low184 Ų184164.7 Ų164.785%0.85283%0.833SS**  trans-95.8138.9177.9-88.4-70000110.1
372E37.1Very low32.5Very low174 Ų174167.3 Ų167.381%0.81384%0.835SS**  trans-113.7122.3166.4-73.4-167.4158.300111.2
373G30.9Very low32.6Very low76 Ų76170.2 Ų170.278%0.78484%0.84SS**  trans-100.4148.3168.600000111.3
374F33.6Very low33Very low191 Ų191170.1 Ų170.184%0.83884%0.84SS**  trans-113.9122177.9-80.5-89000111.6
375V31.4Very low33.1Very low124 Ų124171.4 Ų171.475%0.75285%0.845SS**  trans-132.9148.1166.6172.70000106.7
376F32.4Very low33.7Very low195 Ų195170.6 Ų170.686%0.85584%0.841SS**  trans157.4113.8147.6-91.7-78.9000107.7
377V33Very low34Very low125 Ų125172.3 Ų172.376%0.75885%0.845SS**  108.9134.863.2160.20000111.9
378R31.4Very low34.5Very low220 Ų220172 Ų17283%0.8385%0.851SS**  trans-57.1154.8177.9-81.8-176.7-172.4156.33.1114.4
379K50.4Low34.4Very low210 Ų210174 Ų17491%0.91386%0.856SS**  trans-119.9115.8157.9-154.6174.8-176-178.90109.5
380Q28.9Very low34.7Very low168 Ų168178.1 Ų178.179%0.78587%0.865SS**  trans-100.9129.1160.6-82.9-176.5-51.800107.3
381E41.9Very low35Very low272 Ų272176.3 Ų176.3100%1.27186%0.859SS**  -173.70125.9-100.2-179.9-177.200108.5

Retrieved 381 of 381 residues in 711.3 ms (Link to these results)

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