G4LZ54_SCHMA Loading...

Syntaxin-12, putative

AlphaFold DB , UniProt , Accession G4LZ54, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 240 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
1M59.6Low82.4Confident150 Ų15064.5 Ų64.574%0.73937%0.372SS*.  01370-70173125.100106.9V6 V64 V68M1-V6 HydrophobicContact CB-CG2 3.81Å; M1-V6 HydrophobicContact SD-CG2 4.32Å; M1-V64 HydrophobicContact CE-CG1 4.18Å; M1-V68 HydrophobicContact SD-CG2 4.12Å
2D77.3Confident83.1Confident100 Ų10062.1 Ų62.154%0.53537%0.366SS..  trans-68.4143.9170.2-17710.5000109.5S4 N5 V6D2-S4 PolarHBondContact O-N 3.38Å; D2-S4 PolarHBondContact OD2-OG 3.41Å; D2-N5 PolarHBondContact O-N 3.18Å; D2-V6 PolarHBondContact O-N 3.42Å; D2-V6 VanDerWaalsContact O-N 3.15Å
3A77.7Confident83.6Confident37 Ų3757.3 Ų57.331%0.30634%0.337SS..Hα-helixtrans-58.1-35.5179.200000111.6V6 I7 I75A3-V6 PolarHBondContact O-N 2.95Å; A3-I7 VanDerWaalsContact O-CG1 3.29Å; A3-I7 WeakPolarHBondContact O-CG1 3.38Å; A3-I7 PolarHBondContact O-N 3.05Å; A3-I75 HydrophobicContact CB-CD1 3.88Å
4S83.3Confident84Confident62 Ų6255.7 Ų55.743%0.43433%0.325SS..Hα-helixtrans-58.2-48.2175.868.10000112.2D2 V6 I7 A8D2-S4 PolarHBondContact O-N 3.38Å; D2-S4 PolarHBondContact OD2-OG 3.41Å; S4-V6 PolarHBondContact O-N 3.34Å; S4-I7 PolarHBondContact O-N 3.48Å; S4-A8 PolarHBondContact O-N 2.87Å
5N85Confident84.5Confident101 Ų10159.4 Ų59.454%0.5434%0.338SS..Hα-helixtrans-65.2-39.3178.3-70.2-15.4000111.6D2 A8 E9D2-N5 PolarHBondContact O-N 3.18Å; N5-A8 PolarHBondContact O-N 2.74Å; N5-E9 WeakPolarHBondContact O-CG 3.45Å; N5-E9 PolarHBondContact O-N 2.9Å
6V84Confident84.9Confident6 Ų660.2 Ų60.24%0.03633%0.334CS..Hα-helixtrans-62.3-45.3175.3175.60000110.6M1 D2 A3 S4 A8 E9 L10 V68 L78M1-V6 HydrophobicContact CB-CG2 3.81Å; M1-V6 HydrophobicContact SD-CG2 4.32Å; D2-V6 PolarHBondContact O-N 3.42Å; D2-V6 VanDerWaalsContact O-N 3.15Å; A3-V6 PolarHBondContact O-N 2.95Å; S4-V6 PolarHBondContact O-N 3.34Å; V6-A8 VanDerWaalsContact C-N 3.33Å; V6-A8 PolarHBondContact O-N 3.34Å; V6-E9 PolarHBondContact O-N 3.49Å; V6-L10 HydrophobicContact CG1-CD1 4.03Å; V6-L10 HydrophobicContact CG1-CG 4.28Å; V6-L10 VanDerWaalsContact O-CG 3.29Å; V6-L10 WeakPolarHBondContact O-CG 3.33Å; V6-L10 PolarHBondContact O-N 3Å; V6-V68 HydrophobicContact CG1-CG1 3.72Å; V6-V68 HydrophobicContact CG1-CG2 4.1Å; V6-V68 HydrophobicContact CG2-CG2 4.29Å; V6-L78 HydrophobicContact CB-CD1 4.24Å; V6-L78 HydrophobicContact CG1-CB 4.45Å; V6-L78 HydrophobicContact CG1-CD1 3.89Å
7I86.5Confident85.2Confident75 Ų7556.8 Ų56.839%0.38532%0.315SS..Hα-helixtrans-62.4-40.9178.4-69.6164.8000111.4A3 S4 L10 T11 L78A3-I7 VanDerWaalsContact O-CG1 3.29Å; A3-I7 WeakPolarHBondContact O-CG1 3.38Å; A3-I7 PolarHBondContact O-N 3.05Å; S4-I7 PolarHBondContact O-N 3.48Å; I7-L10 PolarHBondContact O-N 3.33Å; I7-T11 WeakPolarHBondContact O-CB 3.3Å; I7-T11 PolarHBondContact O-N 2.93Å; I7-T11 PolarHBondContact O-OG1 2.93Å; I7-L78 HydrophobicContact CD1-CD2 4.28Å; I7-L78 HydrophobicContact CG1-CD1 4.34Å; I7-L78 HydrophobicContact CG1-CD2 3.58Å
8A88.6Confident85.5Confident58 Ų5857.9 Ų57.948%0.47932%0.319SS..Hα-helixtrans-62-45.6176.700000111.6S4 N5 V6 T11 A12S4-A8 PolarHBondContact O-N 2.87Å; N5-A8 PolarHBondContact O-N 2.74Å; V6-A8 VanDerWaalsContact C-N 3.33Å; V6-A8 PolarHBondContact O-N 3.34Å; A8-T11 PolarHBondContact O-N 2.98Å; A8-A12 WeakPolarHBondContact O-CB 3.28Å; A8-A12 PolarHBondContact O-N 3.47Å
9E86.5Confident85.8Confident66 Ų6660.1 Ų60.131%0.30833%0.325SS..Hα-helixtrans-64.2-42.6177-73.1-64.116000112.9N5 V6 T11 A12 T13 H61 V64N5-E9 WeakPolarHBondContact O-CG 3.45Å; N5-E9 PolarHBondContact O-N 2.9Å; V6-E9 PolarHBondContact O-N 3.49Å; E9-T11 VanDerWaalsContact C-N 3.31Å; E9-T11 PolarHBondContact O-N 3.3Å; E9-A12 PolarHBondContact O-N 3.41Å; E9-T13 PolarHBondContact O-N 3.04Å; E9-T13 PolarHBondContact O-OG1 3Å; E9-H61 IonicContact OE2-CE1 2.64Å; E9-H61 PolarHBondContact OE2-CE1 3.06Å; E9-H61 IonicContact OE2-ND1 2.82Å; E9-H61 PolarHBondContact OE2-ND1 3.41Å; E9-V64 HydrophobicContact CB-CG1 4.35Å; E9-V64 HydrophobicContact CG-CG1 4.13Å
10L87.3Confident86.1Confident2 Ų257.2 Ų57.21%0.0131%0.309CS..Hα-helixtrans-62.3-41.5175.8-68177000110.9V6 I7 T13 E14 I65 L78 R81 A82 L85V6-L10 HydrophobicContact CG1-CD1 4.03Å; V6-L10 HydrophobicContact CG1-CG 4.28Å; V6-L10 VanDerWaalsContact O-CG 3.29Å; V6-L10 WeakPolarHBondContact O-CG 3.33Å; V6-L10 PolarHBondContact O-N 3Å; I7-L10 PolarHBondContact O-N 3.33Å; L10-T13 PolarHBondContact O-N 3.39Å; L10-E14 WeakPolarHBondContact O-CB 3.39Å; L10-E14 PolarHBondContact O-N 3.38Å; L10-I65 HydrophobicContact CD2-CD1 4.22Å; L10-I65 HydrophobicContact CD2-CG1 4.09Å; L10-L78 HydrophobicContact CD1-CB 4.4Å; L10-L78 HydrophobicContact CD1-CD2 4.09Å; L10-R81 HydrophobicContact CD1-CB 4.33Å; L10-R81 HydrophobicContact CD1-CG 4.28Å; L10-A82 HydrophobicContact CD2-CB 3.73Å; L10-L85 HydrophobicContact CB-CD1 3.88Å; L10-L85 HydrophobicContact CD2-CD1 3.9Å; L10-L85 HydrophobicContact CG-CD1 4.46Å; L10-L85 VanDerWaalsContact O-CD1 3.22Å; L10-L85 WeakPolarHBondContact O-CD1 3.33Å
11T90.3Very high86.3Confident53 Ų5355.9 Ų55.933%0.32530%0.301SS..Hα-helixtrans-67.7-41.4178.1-54.30000111.5I7 A8 E9 T13 E14 Q15 R81I7-T11 WeakPolarHBondContact O-CB 3.3Å; I7-T11 PolarHBondContact O-N 2.93Å; I7-T11 PolarHBondContact O-OG1 2.93Å; A8-T11 PolarHBondContact O-N 2.98Å; E9-T11 VanDerWaalsContact C-N 3.31Å; E9-T11 PolarHBondContact O-N 3.3Å; T11-T13 VanDerWaalsContact C-N 3.32Å; T11-T13 PolarHBondContact O-N 3.31Å; T11-E14 WeakPolarHBondContact O-CB 3.48Å; T11-E14 PolarHBondContact O-N 2.9Å; T11-Q15 WeakPolarHBondContact O-CG 3.39Å; T11-Q15 PolarHBondContact O-N 2.99Å; T11-Q15 VanDerWaalsContact O-N 3.13Å; T11-R81 PolarHBondContact OG1-NH2 3.47Å
12A91.3Very high87.8Confident35 Ų3551.2 Ų51.229%0.28928%0.283SS..Hα-helixtrans-61.3-42.1174.400000111.7A8 E9 Q15 R16A8-A12 WeakPolarHBondContact O-CB 3.28Å; A8-A12 PolarHBondContact O-N 3.47Å; E9-A12 PolarHBondContact O-N 3.41Å; A12-Q15 PolarHBondContact O-N 2.96Å; A12-R16 WeakPolarHBondContact O-CG 3.36Å; A12-R16 PolarHBondContact O-N 3.19Å
13T89.6Confident88.5Confident0 Ų047.9 Ų47.90%027%0.265CS..Hα-helixtrans-63.9-42.7176.9-51.40000111.8E9 L10 T11 Q15 R16 I17 L58 H61 I65E9-T13 PolarHBondContact O-N 3.04Å; E9-T13 PolarHBondContact O-OG1 3Å; L10-T13 PolarHBondContact O-N 3.39Å; T11-T13 VanDerWaalsContact C-N 3.32Å; T11-T13 PolarHBondContact O-N 3.31Å; T13-Q15 VanDerWaalsContact C-N 3.32Å; T13-Q15 PolarHBondContact O-N 3.3Å; T13-R16 PolarHBondContact O-N 3.27Å; T13-R16 VanDerWaalsContact O-N 3.12Å; T13-I17 HydrophobicContact CG2-CD1 4.02Å; T13-I17 HydrophobicContact CG2-CG1 4.43Å; T13-I17 WeakPolarHBondContact O-CG1 3.42Å; T13-I17 PolarHBondContact O-N 2.99Å; T13-L58 HydrophobicContact CG2-CD1 3.83Å; T13-H61 HydrophobicContact CG2-CB 4.45Å; T13-I65 HydrophobicContact CG2-CD1 3.23Å; T13-I65 HydrophobicContact CG2-CG1 4.33Å
14E88.8Confident89.2Confident35 Ų3546.1 Ų46.116%0.16425%0.251CS..Hα-helixtrans-56.1-45.5175.5-171.3175.6175.100112L10 T11 R16 I17 I18 R81 L85L10-E14 WeakPolarHBondContact O-CB 3.39Å; L10-E14 PolarHBondContact O-N 3.38Å; T11-E14 WeakPolarHBondContact O-CB 3.48Å; T11-E14 PolarHBondContact O-N 2.9Å; E14-R16 VanDerWaalsContact C-N 3.32Å; E14-R16 PolarHBondContact O-N 3.45Å; E14-I17 PolarHBondContact O-N 3.28Å; E14-I18 HydrophobicContact CG-CD1 4.26Å; E14-I18 WeakPolarHBondContact O-CG1 3.34Å; E14-I18 PolarHBondContact O-N 3.28Å; E14-R81 IonicContact OE2-CZ 3.87Å; E14-R81 IonicContact OE2-NE 3.04Å; E14-R81 IonicContact OE2-NH2 3.32Å; E14-R81 PolarHBondContact OE2-NH2 3.41Å; E14-L85 HydrophobicContact CB-CD1 4.49Å; E14-L85 HydrophobicContact CB-CD2 3.62Å; E14-L85 HydrophobicContact CG-CD2 3.84Å
15Q91.5Very high89.6Confident111 Ų11145.8 Ų45.852%0.51924%0.244SC..Hα-helixtrans-62.5-38.3176.8-64.2-54.6-45.700112.6T11 A12 T13 I18 K19T11-Q15 WeakPolarHBondContact O-CG 3.39Å; T11-Q15 PolarHBondContact O-N 2.99Å; T11-Q15 VanDerWaalsContact O-N 3.13Å; A12-Q15 PolarHBondContact O-N 2.96Å; T13-Q15 VanDerWaalsContact C-N 3.32Å; T13-Q15 PolarHBondContact O-N 3.3Å; Q15-I18 PolarHBondContact O-N 3.02Å; Q15-K19 WeakPolarHBondContact O-CB 3.43Å; Q15-K19 PolarHBondContact O-N 3.3Å
16R91.5Very high89.9Confident72 Ų7245 Ų4527%0.27224%0.237SC..Hα-helixtrans-68.6-38.6176.9-67.4174.3-161.6-72.810.7112.1A12 T13 E14 I18 K19 I20 D57 L58 H61A12-R16 WeakPolarHBondContact O-CG 3.36Å; A12-R16 PolarHBondContact O-N 3.19Å; T13-R16 PolarHBondContact O-N 3.27Å; T13-R16 VanDerWaalsContact O-N 3.12Å; E14-R16 VanDerWaalsContact C-N 3.32Å; E14-R16 PolarHBondContact O-N 3.45Å; R16-I18 VanDerWaalsContact C-N 3.35Å; R16-K19 PolarHBondContact O-N 2.83Å; R16-I20 WeakPolarHBondContact O-CB 3.48Å; R16-I20 WeakPolarHBondContact O-CG1 3.34Å; R16-I20 PolarHBondContact O-N 2.93Å; R16-D57 WeakPolarHBondContact CD-OD2 3.27Å; R16-D57 IonicContact CZ-OD1 3.85Å; R16-D57 IonicContact CZ-OD2 2.74Å; R16-D57 IonicContact NE-OD2 2.78Å; R16-D57 IonicContact NH1-OD1 2.62Å; R16-D57 PolarHBondContact NH1-OD1 3.48Å; R16-D57 IonicContact NH1-OD2 3.73Å; R16-D57 PolarHBondContact NH1-OD2 3.02Å; R16-D57 IonicContact NH2-OD1 3.55Å; R16-L58 HydrophobicContact CB-CD1 4.11Å; R16-H61 VanDerWaalsContact CZ-NE2 3.25Å; R16-H61 PolarHBondContact NE-CD2 2.99Å; R16-H61 PolarHBondContact NE-NE2 3.44Å; R16-H61 PolarHBondContact NH2-NE2 3.47Å
17I89.8Confident90.4Very high2 Ų244.8 Ų44.81%0.0124%0.236CC..Hα-helixtrans-61-45.8173.6-68.6165.9000110.2T13 E14 K19 I20 K21 L58 L85 Q88 A89 Q92T13-I17 HydrophobicContact CG2-CD1 4.02Å; T13-I17 HydrophobicContact CG2-CG1 4.43Å; T13-I17 WeakPolarHBondContact O-CG1 3.42Å; T13-I17 PolarHBondContact O-N 2.99Å; E14-I17 PolarHBondContact O-N 3.28Å; I17-K19 VanDerWaalsContact C-N 3.34Å; I17-K19 PolarHBondContact O-N 3.17Å; I17-I20 PolarHBondContact O-N 3.29Å; I17-K21 VanDerWaalsContact O-CB 3.3Å; I17-K21 WeakPolarHBondContact O-CB 3.46Å; I17-K21 PolarHBondContact O-N 3.17Å; I17-L58 HydrophobicContact CG1-CD1 3.93Å; I17-L58 HydrophobicContact CG1-CD2 4.32Å; I17-L85 HydrophobicContact CD1-CB 4.08Å; I17-L85 HydrophobicContact CD1-CD2 3.94Å; I17-L85 WeakPolarHBondContact CD1-O 3.35Å; I17-Q88 HydrophobicContact CD1-CB 4.29Å; I17-Q88 HydrophobicContact CG2-CB 3.98Å; I17-A89 HydrophobicContact CD1-CB 4.08Å; I17-A89 HydrophobicContact CG1-CB 4.15Å; I17-Q92 HydrophobicContact CG2-CG 4.24Å
18I90.9Very high90.7Very high77 Ų7743 Ų4340%0.39523%0.227SC..Hα-helixtrans-61.3-43.6176.6-67.5165.8000110.9E14 Q15 R16 K21 S22E14-I18 HydrophobicContact CG-CD1 4.26Å; E14-I18 WeakPolarHBondContact O-CG1 3.34Å; E14-I18 PolarHBondContact O-N 3.28Å; Q15-I18 PolarHBondContact O-N 3.02Å; R16-I18 VanDerWaalsContact C-N 3.35Å; I18-K21 PolarHBondContact O-N 3.43Å; I18-S22 PolarHBondContact O-N 3.05Å
19K91.5Very high90.8Very high99 Ų9946.5 Ų46.543%0.4323%0.234SC..Hα-helixtrans-61.7-52.5177-175-176.3-178.8-63.30111.3Q15 R16 I17 K21 S22 D23 S54Q15-K19 WeakPolarHBondContact O-CB 3.43Å; Q15-K19 PolarHBondContact O-N 3.3Å; R16-K19 PolarHBondContact O-N 2.83Å; I17-K19 VanDerWaalsContact C-N 3.34Å; I17-K19 PolarHBondContact O-N 3.17Å; K19-K21 VanDerWaalsContact C-N 3.28Å; K19-K21 PolarHBondContact O-N 3.19Å; K19-S22 WeakPolarHBondContact O-CA 3.41Å; K19-S22 WeakPolarHBondContact O-CB 3.35Å; K19-S22 PolarHBondContact O-N 3.24Å; K19-D23 IonicContact NZ-OD2 3.79Å; K19-D23 PolarHBondContact NZ-OD2 3.2Å; K19-D23 PolarHBondContact O-N 3.07Å; K19-S54 PolarHBondContact NZ-OG 2.93Å
20I91.4Very high91Very high2 Ų244.6 Ų44.61%0.0123%0.225CC..Hα-helixtrans-58.5-43178.3-76164000110.8R16 I17 S22 D23 I24 L51 S54 L58 Q92R16-I20 WeakPolarHBondContact O-CB 3.48Å; R16-I20 WeakPolarHBondContact O-CG1 3.34Å; R16-I20 PolarHBondContact O-N 2.93Å; I17-I20 PolarHBondContact O-N 3.29Å; I20-S22 VanDerWaalsContact C-N 3.3Å; I20-S22 PolarHBondContact O-N 3.13Å; I20-D23 PolarHBondContact O-N 2.77Å; I20-D23 VanDerWaalsContact O-N 3.17Å; I20-I24 HydrophobicContact CG2-CD1 3.61Å; I20-I24 HydrophobicContact CG2-CG1 4.1Å; I20-I24 WeakPolarHBondContact O-CB 3.37Å; I20-I24 VanDerWaalsContact O-CG1 3.23Å; I20-I24 WeakPolarHBondContact O-CG1 3.42Å; I20-I24 PolarHBondContact O-N 2.97Å; I20-L51 HydrophobicContact CG2-CD1 4.37Å; I20-S54 WeakPolarHBondContact CD1-O 3.43Å; I20-L58 HydrophobicContact CD1-CB 3.26Å; I20-L58 HydrophobicContact CD1-CD2 3.3Å; I20-L58 HydrophobicContact CD1-CG 3.82Å; I20-Q92 HydrophobicContact CG2-CB 4.06Å
21K90.6Very high91.2Very high31 Ų3144.7 Ų44.714%0.13523%0.226CC..Hα-helixtrans-55.2-48.4175.2-179-173.9178.5-59.40111I17 I18 K19 I24 D25 Q92 E200I17-K21 VanDerWaalsContact O-CB 3.3Å; I17-K21 WeakPolarHBondContact O-CB 3.46Å; I17-K21 PolarHBondContact O-N 3.17Å; I18-K21 PolarHBondContact O-N 3.43Å; K19-K21 VanDerWaalsContact C-N 3.28Å; K19-K21 PolarHBondContact O-N 3.19Å; K21-I24 PolarHBondContact O-N 3.42Å; K21-D25 IonicContact NZ-OD2 2.6Å; K21-D25 PolarHBondContact NZ-OD2 3.34Å; K21-D25 WeakPolarHBondContact O-CB 3.34Å; K21-D25 PolarHBondContact O-N 2.93Å; K21-Q92 HydrophobicContact CB-CG 4.27Å; K21-E200 WeakPolarHBondContact CE-OE2 3.08Å
22S90.8Very high91.3Very high52 Ų5247.3 Ų47.336%0.36423%0.232SC..Hα-helixtrans-61.5-42.1177168.70000112.4I18 K19 I20 D25 Q26I18-S22 PolarHBondContact O-N 3.05Å; K19-S22 WeakPolarHBondContact O-CA 3.41Å; K19-S22 WeakPolarHBondContact O-CB 3.35Å; K19-S22 PolarHBondContact O-N 3.24Å; I20-S22 VanDerWaalsContact C-N 3.3Å; I20-S22 PolarHBondContact O-N 3.13Å; S22-D25 PolarHBondContact O-N 3.42Å; S22-Q26 WeakPolarHBondContact O-CG 3.31Å; S22-Q26 PolarHBondContact O-N 3.48Å; S22-Q26 PolarHBondContact OG-NE2 2.91Å
23D92.2Very high91.2Very high29 Ų2947.4 Ų47.416%0.15523%0.231CC..Hα-helixtrans-68.1-39.6179.7-65.5-17.8000111.2K19 I20 Q26 F27 L51 S54K19-D23 IonicContact NZ-OD2 3.79Å; K19-D23 PolarHBondContact NZ-OD2 3.2Å; K19-D23 PolarHBondContact O-N 3.07Å; I20-D23 PolarHBondContact O-N 2.77Å; I20-D23 VanDerWaalsContact O-N 3.17Å; D23-Q26 PolarHBondContact O-N 3.31Å; D23-F27 VanDerWaalsContact O-CB 3.28Å; D23-F27 WeakPolarHBondContact O-CB 3.42Å; D23-F27 PolarHBondContact O-N 3.36Å; D23-L51 HydrophobicContact CB-CD1 4Å; D23-S54 PolarHBondContact OD2-OG 3.28Å
24I92.2Very high91.1Very high1 Ų147.8 Ų47.81%0.00523%0.233CC..Hα-helixtrans-60.4-46.7170.8-69.3172.3000110.6I20 K21 Q26 F27 D28 L51 Q92 R95 L96 L99I20-I24 HydrophobicContact CG2-CD1 3.61Å; I20-I24 HydrophobicContact CG2-CG1 4.1Å; I20-I24 WeakPolarHBondContact O-CB 3.37Å; I20-I24 VanDerWaalsContact O-CG1 3.23Å; I20-I24 WeakPolarHBondContact O-CG1 3.42Å; I20-I24 PolarHBondContact O-N 2.97Å; K21-I24 PolarHBondContact O-N 3.42Å; I24-Q26 VanDerWaalsContact C-N 3.3Å; I24-Q26 PolarHBondContact O-N 3.33Å; I24-F27 PolarHBondContact O-N 3.48Å; I24-D28 WeakPolarHBondContact O-CB 3.43Å; I24-D28 PolarHBondContact O-N 2.98Å; I24-L51 HydrophobicContact CD1-CD1 4.5Å; I24-L51 HydrophobicContact CG1-CD1 3.54Å; I24-L51 HydrophobicContact CG1-CD2 4.04Å; I24-L51 HydrophobicContact CG1-CG 4.41Å; I24-Q92 HydrophobicContact CD1-CB 3.88Å; I24-Q92 WeakPolarHBondContact CD1-O 3.16Å; I24-R95 HydrophobicContact CD1-CB 4.39Å; I24-R95 HydrophobicContact CG2-CB 4.06Å; I24-L96 HydrophobicContact CD1-CB 4.15Å; I24-L96 HydrophobicContact CG1-CB 4.46Å; I24-L99 HydrophobicContact CG2-CD1 3.74Å
25D91.6Very high91Very high55 Ų5549.6 Ų49.629%0.29425%0.247SC..Hα-helixtrans-60.5-41.8-179.5-68.4-16000110.9K21 S22 E29 R95K21-D25 IonicContact NZ-OD2 2.6Å; K21-D25 PolarHBondContact NZ-OD2 3.34Å; K21-D25 WeakPolarHBondContact O-CB 3.34Å; K21-D25 PolarHBondContact O-N 2.93Å; S22-D25 PolarHBondContact O-N 3.42Å; D25-E29 PolarHBondContact O-N 3.41Å; D25-R95 IonicContact OD1-CZ 3.6Å; D25-R95 VanDerWaalsContact OD1-CZ 3.28Å; D25-R95 IonicContact OD1-NH1 2.77Å; D25-R95 PolarHBondContact OD1-NH1 3.2Å; D25-R95 IonicContact OD1-NH2 3.35Å; D25-R95 PolarHBondContact OD1-NH2 3.41Å
26Q91.9Very high90.8Very high85 Ų8547.8 Ų47.840%0.39725%0.247SC..Hα-helixtrans-70.7-40.6177-71.6177.65800112.9S22 D23 I24 L30 K47S22-Q26 WeakPolarHBondContact O-CG 3.31Å; S22-Q26 PolarHBondContact O-N 3.48Å; S22-Q26 PolarHBondContact OG-NE2 2.91Å; D23-Q26 PolarHBondContact O-N 3.31Å; I24-Q26 VanDerWaalsContact C-N 3.3Å; I24-Q26 PolarHBondContact O-N 3.33Å; Q26-L30 PolarHBondContact O-N 3.26Å; Q26-L30 VanDerWaalsContact O-N 3.11Å; Q26-K47 HydrophobicContact CB-CD 4.33Å
27F93.1Very high90.3Very high0 Ų047.6 Ų47.60%027%0.267CS..Hα-helixtrans-65.9-43.1178.4179.8-108000111.5D23 I24 E29 L30 L31 L44 K47 Y48 L51 L99 V103D23-F27 VanDerWaalsContact O-CB 3.28Å; D23-F27 WeakPolarHBondContact O-CB 3.42Å; D23-F27 PolarHBondContact O-N 3.36Å; I24-F27 PolarHBondContact O-N 3.48Å; F27-E29 VanDerWaalsContact C-N 3.34Å; F27-E29 PolarHBondContact O-N 3.14Å; F27-L30 PolarHBondContact O-N 3.34Å; F27-L31 HydrophobicContact CE1-CD2 4.13Å; F27-L31 VanDerWaalsContact O-CB 3.28Å; F27-L31 WeakPolarHBondContact O-CB 3.31Å; F27-L31 PolarHBondContact O-N 3.27Å; F27-L44 HydrophobicContact CD2-CD1 3.98Å; F27-L44 HydrophobicContact CE2-CD1 3.34Å; F27-L44 HydrophobicContact CE2-CG 3.87Å; F27-L44 WeakPolarHBondContact CE2-O 3.32Å; F27-L44 HydrophobicContact CZ-CD1 3.93Å; F27-L44 HydrophobicContact CZ-CG 4.44Å; F27-K47 HydrophobicContact CD2-CB 3.93Å; F27-Y48 HydrophobicContact CD1-CD2 4.08Å; F27-Y48 HydrophobicContact CD2-CD2 4.21Å; F27-Y48 AromaticContact CE1-CD2 3.45Å; F27-Y48 HydrophobicContact CE1-CD2 3.45Å; F27-Y48 VanDerWaalsContact CE1-CD2 3.45Å; F27-Y48 AromaticContact CE1-CE2 3.79Å; F27-Y48 HydrophobicContact CE1-CE2 3.79Å; F27-Y48 HydrophobicContact CE1-CG 4.37Å; F27-Y48 VanDerWaalsContact CE2-CB 3.45Å; F27-Y48 AromaticContact CE2-CD2 3.61Å; F27-Y48 HydrophobicContact CE2-CD2 3.61Å; F27-Y48 AromaticContact CE2-CG 3.79Å; F27-Y48 HydrophobicContact CE2-CG 3.79Å; F27-Y48 HydrophobicContact CG-CD2 4.44Å; F27-Y48 AromaticContact CZ-CD2 3.18Å; F27-Y48 HydrophobicContact CZ-CD2 3.18Å; F27-Y48 AromaticContact CZ-CE2 3.84Å; F27-Y48 HydrophobicContact CZ-CE2 3.84Å; F27-Y48 AromaticContact CZ-CG 3.66Å; F27-Y48 HydrophobicContact CZ-CG 3.66Å; F27-L51 HydrophobicContact CB-CD2 4.01Å; F27-L51 HydrophobicContact CD1-CD2 3.94Å; F27-L51 HydrophobicContact CG-CD2 4.05Å; F27-L99 HydrophobicContact CD1-CB 4.29Å; F27-L99 HydrophobicContact CD1-CD1 3.93Å; F27-L99 HydrophobicContact CE1-CB 4.09Å; F27-V103 HydrophobicContact CE1-CG2 3.78Å; F27-V103 HydrophobicContact CZ-CG2 3.54Å
28D92.9Very high89.8Confident39 Ų3957.7 Ų57.721%0.20931%0.306CS..Hα-helixtrans-58.6-43.9176.3178.741.4000111.9I24 L31 K32 L99I24-D28 WeakPolarHBondContact O-CB 3.43Å; I24-D28 PolarHBondContact O-N 2.98Å; D28-L31 PolarHBondContact O-N 2.96Å; D28-K32 VanDerWaalsContact CG-NZ 3.35Å; D28-K32 VanDerWaalsContact O-CG 3.31Å; D28-K32 WeakPolarHBondContact O-CG 3.4Å; D28-K32 PolarHBondContact O-N 3.47Å; D28-K32 VanDerWaalsContact OD1-CE 3.25Å; D28-K32 WeakPolarHBondContact OD1-CE 3.45Å; D28-K32 IonicContact OD1-NZ 3.28Å; D28-K32 PolarHBondContact OD1-NZ 2.98Å; D28-K32 IonicContact OD2-NZ 3.04Å; D28-K32 PolarHBondContact OD2-NZ 3.18Å; D28-L99 HydrophobicContact CB-CD1 3.96Å; D28-L99 HydrophobicContact CB-CD2 3.93Å; D28-L99 WeakPolarHBondContact OD1-CD2 3.46Å
29E91.3Very high89.1Confident131 Ų13155.1 Ų55.161%0.61230%0.299SS*.Hα-helixtrans-64.3-43.1177.2-169.467.7-177.100111.8D25 F27 K32 S33D25-E29 PolarHBondContact O-N 3.41Å; F27-E29 VanDerWaalsContact C-N 3.34Å; F27-E29 PolarHBondContact O-N 3.14Å; E29-K32 PolarHBondContact O-N 3.31Å; E29-S33 PolarHBondContact O-N 3.09Å; E29-S33 VanDerWaalsContact O-N 3.14Å
30L91.5Very high88.7Confident26 Ų2654 Ų5414%0.13630%0.298CS..Hα-helixtrans-66.1-42.9177.2-174.559000111.4Q26 F27 K32 S33 V34 S43 L44 K47Q26-L30 PolarHBondContact O-N 3.26Å; Q26-L30 VanDerWaalsContact O-N 3.11Å; F27-L30 PolarHBondContact O-N 3.34Å; L30-K32 VanDerWaalsContact C-N 3.31Å; L30-K32 PolarHBondContact O-N 3.02Å; L30-S33 WeakPolarHBondContact O-CB 3.39Å; L30-S33 PolarHBondContact O-N 3.28Å; L30-S33 PolarHBondContact O-OG 3.07Å; L30-V34 WeakPolarHBondContact O-CG2 3.48Å; L30-V34 PolarHBondContact O-N 3.19Å; L30-S43 VanDerWaalsContact CD2-O 3.27Å; L30-S43 WeakPolarHBondContact CD2-O 3.1Å; L30-L44 HydrophobicContact CB-CD1 4.31Å; L30-L44 VanDerWaalsContact CD2-CA 3.5Å; L30-L44 HydrophobicContact CD2-CB 4.23Å; L30-L44 HydrophobicContact CD2-CD1 4.34Å; L30-L44 HydrophobicContact CG-CB 4.34Å; L30-L44 HydrophobicContact CG-CD1 3.98Å; L30-K47 HydrophobicContact CB-CD 4.3Å; L30-K47 HydrophobicContact CD2-CB 4.27Å; L30-K47 HydrophobicContact CD2-CD 3.56Å; L30-K47 HydrophobicContact CD2-CG 3.99Å
31L91.6Very high88.3Confident3 Ų356.3 Ų56.32%0.01631%0.308CS..Hα-helixtrans-59.5-41.3176.9-178.859.6000111.7F27 D28 S33 V34 T35 L44 L99 V102 V103F27-L31 HydrophobicContact CE1-CD2 4.13Å; F27-L31 VanDerWaalsContact O-CB 3.28Å; F27-L31 WeakPolarHBondContact O-CB 3.31Å; F27-L31 PolarHBondContact O-N 3.27Å; D28-L31 PolarHBondContact O-N 2.96Å; L31-S33 VanDerWaalsContact C-N 3.33Å; L31-S33 PolarHBondContact O-N 3.04Å; L31-V34 PolarHBondContact O-N 3.4Å; L31-T35 VanDerWaalsContact O-CB 3.25Å; L31-T35 WeakPolarHBondContact O-CB 3.49Å; L31-T35 PolarHBondContact O-N 3.29Å; L31-T35 PolarHBondContact O-OG1 3.05Å; L31-L44 HydrophobicContact CB-CD1 3.93Å; L31-L44 HydrophobicContact CD1-CD1 4.12Å; L31-L44 HydrophobicContact CD1-CD2 4.04Å; L31-L99 HydrophobicContact CD2-CB 4.43Å; L31-L99 HydrophobicContact CD2-CD2 4Å; L31-V102 HydrophobicContact CD2-CB 4Å; L31-V102 HydrophobicContact CD2-CG1 3.79Å; L31-V102 HydrophobicContact CG-CG1 4.24Å; L31-V103 HydrophobicContact CD1-CG2 3.79Å; L31-V103 HydrophobicContact CD2-CG2 3.7Å; L31-V103 HydrophobicContact CG-CG2 4.39Å
32K91.8Very high88.1Confident108 Ų10860.7 Ų60.747%0.4733%0.329SS..Hα-helixtrans-62-40.6173.9-75164.4177.8159.90112D28 E29 L30 S36D28-K32 VanDerWaalsContact CG-NZ 3.35Å; D28-K32 VanDerWaalsContact O-CG 3.31Å; D28-K32 WeakPolarHBondContact O-CG 3.4Å; D28-K32 PolarHBondContact O-N 3.47Å; D28-K32 VanDerWaalsContact OD1-CE 3.25Å; D28-K32 WeakPolarHBondContact OD1-CE 3.45Å; D28-K32 IonicContact OD1-NZ 3.28Å; D28-K32 PolarHBondContact OD1-NZ 2.98Å; D28-K32 IonicContact OD2-NZ 3.04Å; D28-K32 PolarHBondContact OD2-NZ 3.18Å; E29-K32 PolarHBondContact O-N 3.31Å; L30-K32 VanDerWaalsContact C-N 3.31Å; L30-K32 PolarHBondContact O-N 3.02Å; K32-S36 WeakPolarHBondContact O-CB 3.47Å; K32-S36 PolarHBondContact O-N 3.46Å; K32-S36 PolarHBondContact O-OG 3.49Å
33S88.8Confident88Confident37 Ų3760 Ų6026%0.25933%0.325SS..Hα-helixtrans-66.3-42.4176.877.60000112.2E29 L30 L31 S36 G37 Y38 G39E29-S33 PolarHBondContact O-N 3.09Å; E29-S33 VanDerWaalsContact O-N 3.14Å; L30-S33 WeakPolarHBondContact O-CB 3.39Å; L30-S33 PolarHBondContact O-N 3.28Å; L30-S33 PolarHBondContact O-OG 3.07Å; L31-S33 VanDerWaalsContact C-N 3.33Å; L31-S33 PolarHBondContact O-N 3.04Å; S33-S36 WeakPolarHBondContact CA-OG 3.28Å; S33-S36 PolarHBondContact O-N 3.34Å; S33-S36 PolarHBondContact O-OG 3.06Å; S33-G37 PolarHBondContact O-N 3.35Å; S33-Y38 PolarHBondContact O-N 3.46Å; S33-G39 PolarHBondContact O-N 2.95Å; S33-G39 WeakPolarHBondContact OG-CA 3.31Å
34V88.1Confident87.9Confident8 Ų858.7 Ų58.75%0.04832%0.317CS..Hα-helixtrans-67.6-45.5177.8175.50000110.7L30 L31 S36 G37 D40 K41 L44L30-V34 WeakPolarHBondContact O-CG2 3.48Å; L30-V34 PolarHBondContact O-N 3.19Å; L31-V34 PolarHBondContact O-N 3.4Å; V34-S36 PolarHBondContact O-N 2.87Å; V34-G37 PolarHBondContact O-N 3.4Å; V34-D40 WeakPolarHBondContact CG2-O 3.19Å; V34-K41 HydrophobicContact CG1-CG 3.95Å; V34-L44 HydrophobicContact CB-CD2 4.14Å; V34-L44 HydrophobicContact CG1-CD2 3.98Å; V34-L44 HydrophobicContact CG2-CB 4.05Å; V34-L44 HydrophobicContact CG2-CD1 4.38Å; V34-L44 HydrophobicContact CG2-CD2 4.11Å; V34-L44 HydrophobicContact CG2-CG 4.41Å
35T86.7Confident87.8Confident74 Ų7459 Ų5945%0.45432%0.319SS..Hα-helixtrans-64.3-25.4179-540000112.4L31 G37L31-T35 VanDerWaalsContact O-CB 3.25Å; L31-T35 WeakPolarHBondContact O-CB 3.49Å; L31-T35 PolarHBondContact O-N 3.29Å; L31-T35 PolarHBondContact O-OG1 3.05Å; T35-G37 VanDerWaalsContact C-N 3.34Å
36S86.8Confident87.7Confident73 Ų7362.2 Ų62.251%0.5133%0.332SS..THydrogen-bonded Turntrans-86.70.1173.456.10000114.2K32 S33 V34 Y38K32-S36 WeakPolarHBondContact O-CB 3.47Å; K32-S36 PolarHBondContact O-N 3.46Å; K32-S36 PolarHBondContact O-OG 3.49Å; S33-S36 WeakPolarHBondContact CA-OG 3.28Å; S33-S36 PolarHBondContact O-N 3.34Å; S33-S36 PolarHBondContact O-OG 3.06Å; V34-S36 PolarHBondContact O-N 2.87Å; S36-Y38 VanDerWaalsContact O-CD2 3.31Å; S36-Y38 WeakPolarHBondContact O-CD2 3.39Å
37G81.6Confident87.7Confident68 Ų6861.6 Ų61.670%0.70133%0.328SS*.THydrogen-bonded Turntrans87.25.3175.700000115.6S33 V34 T35S33-G37 PolarHBondContact O-N 3.35Å; V34-G37 PolarHBondContact O-N 3.4Å; T35-G37 VanDerWaalsContact C-N 3.34Å
38Y78.6Confident87.7Confident213 Ų21361.6 Ų61.684%0.83533%0.328SS*.  trans-111.3-4.2-178.2-63.7-82.1000114S33 S36S33-Y38 PolarHBondContact O-N 3.46Å; S36-Y38 VanDerWaalsContact O-CD2 3.31Å; S36-Y38 WeakPolarHBondContact O-CD2 3.39Å
39G77.1Confident87.5Confident24 Ų2463.4 Ų63.425%0.24734%0.335CS..SBendtrans-92.7159-173.800000113.9S33S33-G39 PolarHBondContact O-N 2.95Å; S33-G39 WeakPolarHBondContact OG-CA 3.31Å
40D82Confident87.5Confident75 Ų7560.5 Ų60.540%0.40132%0.324SS..  trans-85.2121172.9176.719.7000111.1V34 E42 S43 L44V34-D40 WeakPolarHBondContact CG2-O 3.19Å; D40-E42 PolarHBondContact OD1-N 2.97Å; D40-S43 WeakPolarHBondContact OD2-CB 3.4Å; D40-S43 PolarHBondContact OD2-N 2.91Å; D40-S43 VanDerWaalsContact OD2-N 3.15Å; D40-S43 PolarHBondContact OD2-OG 3.38Å; D40-L44 PolarHBondContact O-N 3.48Å; D40-L44 VanDerWaalsContact O-N 3.14Å
41K83.6Confident87.5Confident50 Ų5059.3 Ų59.322%0.21732%0.318CS..Hα-helixtrans-72.8-33.4179.1-69.7-179.2176.9-1800112V34 L44 N45 E110 E152V34-K41 HydrophobicContact CG1-CG 3.95Å; K41-L44 WeakPolarHBondContact O-CB 3.25Å; K41-L44 PolarHBondContact O-N 3.4Å; K41-L44 VanDerWaalsContact O-N 3.17Å; K41-N45 PolarHBondContact O-N 3.25Å; K41-N45 PolarHBondContact O-OD1 3.47Å; K41-E110 IonicContact NZ-OE1 4Å; K41-E110 IonicContact NZ-OE2 3.07Å; K41-E110 PolarHBondContact NZ-OE2 3.14Å; K41-E152 WeakPolarHBondContact CB-OE2 3.49Å
42E86.3Confident87.4Confident123 Ų12359.1 Ų59.158%0.57532%0.317SS*.Hα-helixtrans-64.7-50.1177.3-174.3176.9-174.900110D40 L44 N45 E46D40-E42 PolarHBondContact OD1-N 2.97Å; E42-L44 PolarHBondContact O-N 3.39Å; E42-N45 PolarHBondContact O-N 2.93Å; E42-E46 PolarHBondContact O-N 2.91Å
43S88.8Confident87.3Confident39 Ų3957.9 Ų57.927%0.27332%0.315SS..Hα-helixtrans-57.2-34.9171.9-690000112.7L30 D40 K47L30-S43 VanDerWaalsContact CD2-O 3.27Å; L30-S43 WeakPolarHBondContact CD2-O 3.1Å; D40-S43 WeakPolarHBondContact OD2-CB 3.4Å; D40-S43 PolarHBondContact OD2-N 2.91Å; D40-S43 VanDerWaalsContact OD2-N 3.15Å; D40-S43 PolarHBondContact OD2-OG 3.38Å; S43-K47 WeakPolarHBondContact O-CB 3.38Å; S43-K47 WeakPolarHBondContact O-CG 3.45Å; S43-K47 PolarHBondContact O-N 3.37Å
44L89.6Confident87.3Confident0 Ų056.5 Ų56.50%031%0.305CS..Hα-helixtrans-65.3-47.8179.8-175.673.2000110.5F27 L30 L31 V34 D40 K41 E42 K47 Y48 L156F27-L44 HydrophobicContact CD2-CD1 3.98Å; F27-L44 HydrophobicContact CE2-CD1 3.34Å; F27-L44 HydrophobicContact CE2-CG 3.87Å; F27-L44 WeakPolarHBondContact CE2-O 3.32Å; F27-L44 HydrophobicContact CZ-CD1 3.93Å; F27-L44 HydrophobicContact CZ-CG 4.44Å; L30-L44 HydrophobicContact CB-CD1 4.31Å; L30-L44 VanDerWaalsContact CD2-CA 3.5Å; L30-L44 HydrophobicContact CD2-CB 4.23Å; L30-L44 HydrophobicContact CD2-CD1 4.34Å; L30-L44 HydrophobicContact CG-CB 4.34Å; L30-L44 HydrophobicContact CG-CD1 3.98Å; L31-L44 HydrophobicContact CB-CD1 3.93Å; L31-L44 HydrophobicContact CD1-CD1 4.12Å; L31-L44 HydrophobicContact CD1-CD2 4.04Å; V34-L44 HydrophobicContact CB-CD2 4.14Å; V34-L44 HydrophobicContact CG1-CD2 3.98Å; V34-L44 HydrophobicContact CG2-CB 4.05Å; V34-L44 HydrophobicContact CG2-CD1 4.38Å; V34-L44 HydrophobicContact CG2-CD2 4.11Å; V34-L44 HydrophobicContact CG2-CG 4.41Å; D40-L44 PolarHBondContact O-N 3.48Å; D40-L44 VanDerWaalsContact O-N 3.14Å; K41-L44 WeakPolarHBondContact O-CB 3.25Å; K41-L44 PolarHBondContact O-N 3.4Å; K41-L44 VanDerWaalsContact O-N 3.17Å; E42-L44 PolarHBondContact O-N 3.39Å; L44-K47 PolarHBondContact O-N 2.93Å; L44-Y48 WeakPolarHBondContact O-CB 3.29Å; L44-Y48 PolarHBondContact O-N 2.96Å; L44-L156 HydrophobicContact CD2-CD2 4.14Å
45N89.7Confident87.3Confident8 Ų856.2 Ų56.24%0.04330%0.304CS..Hα-helixtrans-60.2-48.6176.5-66.6-3.1000110.7K41 E42 K47 Y48 H49 E152 L156K41-N45 PolarHBondContact O-N 3.25Å; K41-N45 PolarHBondContact O-OD1 3.47Å; E42-N45 PolarHBondContact O-N 2.93Å; N45-K47 VanDerWaalsContact C-N 3.34Å; N45-K47 PolarHBondContact O-N 2.62Å; N45-Y48 PolarHBondContact O-N 3.23Å; N45-Y48 VanDerWaalsContact O-N 3.13Å; N45-H49 WeakPolarHBondContact O-CB 3.46Å; N45-H49 PolarHBondContact O-N 3.05Å; N45-E152 WeakPolarHBondContact ND2-CA 3.11Å; N45-E152 PolarHBondContact ND2-O 3.38Å; N45-L156 VanDerWaalsContact OD1-CB 3.3Å; N45-L156 WeakPolarHBondContact OD1-CB 3.47Å; N45-L156 WeakPolarHBondContact OD1-CD1 3.21Å
46E90.8Very high87.4Confident123 Ų12358.6 Ų58.658%0.57531%0.308SS*.Hα-helixtrans-58.1-45.8178.7-166.2-161.1161.600111.7E42 Y48 H49 N50E42-E46 PolarHBondContact O-N 2.91Å; E46-Y48 PolarHBondContact O-N 3.35Å; E46-H49 PolarHBondContact O-N 2.84Å; E46-N50 WeakPolarHBondContact O-CB 3.49Å; E46-N50 PolarHBondContact O-N 3.39Å; E46-N50 PolarHBondContact O-ND2 3.1Å
47K91.8Very high87.4Confident72 Ų7257.9 Ų57.931%0.31330%0.298SS..Hα-helixtrans-66.8-36.4177.3-75.9-163.2-171.9-71.60112.4Q26 F27 L30 S43 L44 N45 N50 L51Q26-K47 HydrophobicContact CB-CD 4.33Å; F27-K47 HydrophobicContact CD2-CB 3.93Å; L30-K47 HydrophobicContact CB-CD 4.3Å; L30-K47 HydrophobicContact CD2-CB 4.27Å; L30-K47 HydrophobicContact CD2-CD 3.56Å; L30-K47 HydrophobicContact CD2-CG 3.99Å; S43-K47 WeakPolarHBondContact O-CB 3.38Å; S43-K47 WeakPolarHBondContact O-CG 3.45Å; S43-K47 PolarHBondContact O-N 3.37Å; L44-K47 PolarHBondContact O-N 2.93Å; N45-K47 VanDerWaalsContact C-N 3.34Å; N45-K47 PolarHBondContact O-N 2.62Å; K47-N50 PolarHBondContact O-N 3.47Å; K47-L51 WeakPolarHBondContact O-CB 3.47Å; K47-L51 PolarHBondContact O-N 2.93Å
48Y91.7Very high87.7Confident0 Ų054.7 Ų54.70%027%0.265CS..Hα-helixtrans-67.7-44.6177.8-159.8-135.3000111.4F27 L44 N45 E46 N50 L51 I52 L96 L156 D159 I160 V163F27-Y48 HydrophobicContact CD1-CD2 4.08Å; F27-Y48 HydrophobicContact CD2-CD2 4.21Å; F27-Y48 AromaticContact CE1-CD2 3.45Å; F27-Y48 HydrophobicContact CE1-CD2 3.45Å; F27-Y48 VanDerWaalsContact CE1-CD2 3.45Å; F27-Y48 AromaticContact CE1-CE2 3.79Å; F27-Y48 HydrophobicContact CE1-CE2 3.79Å; F27-Y48 HydrophobicContact CE1-CG 4.37Å; F27-Y48 VanDerWaalsContact CE2-CB 3.45Å; F27-Y48 AromaticContact CE2-CD2 3.61Å; F27-Y48 HydrophobicContact CE2-CD2 3.61Å; F27-Y48 AromaticContact CE2-CG 3.79Å; F27-Y48 HydrophobicContact CE2-CG 3.79Å; F27-Y48 HydrophobicContact CG-CD2 4.44Å; F27-Y48 AromaticContact CZ-CD2 3.18Å; F27-Y48 HydrophobicContact CZ-CD2 3.18Å; F27-Y48 AromaticContact CZ-CE2 3.84Å; F27-Y48 HydrophobicContact CZ-CE2 3.84Å; F27-Y48 AromaticContact CZ-CG 3.66Å; F27-Y48 HydrophobicContact CZ-CG 3.66Å; L44-Y48 WeakPolarHBondContact O-CB 3.29Å; L44-Y48 PolarHBondContact O-N 2.96Å; N45-Y48 PolarHBondContact O-N 3.23Å; N45-Y48 VanDerWaalsContact O-N 3.13Å; E46-Y48 PolarHBondContact O-N 3.35Å; Y48-N50 PolarHBondContact O-N 3.3Å; Y48-L51 WeakPolarHBondContact O-CB 3.47Å; Y48-L51 PolarHBondContact O-N 2.79Å; Y48-L51 VanDerWaalsContact O-N 3.09Å; Y48-I52 HydrophobicContact CD1-CD1 4.28Å; Y48-I52 HydrophobicContact CE1-CD1 4.38Å; Y48-I52 WeakPolarHBondContact O-CG1 3.44Å; Y48-I52 PolarHBondContact O-N 2.83Å; Y48-L96 HydrophobicContact CE2-CD1 3.99Å; Y48-L156 HydrophobicContact CD1-CD1 3.68Å; Y48-L156 HydrophobicContact CE1-CD1 4.32Å; Y48-L156 HydrophobicContact CG-CD1 4.31Å; Y48-D159 HydrophobicContact CD1-CB 3.42Å; Y48-D159 VanDerWaalsContact CD1-CB 3.42Å; Y48-D159 HydrophobicContact CE1-CB 3.77Å; Y48-D159 HydrophobicContact CG-CB 4.48Å; Y48-I160 HydrophobicContact CE1-CG1 3.87Å; Y48-V163 HydrophobicContact CE1-CG2 4.18Å; Y48-V163 HydrophobicContact CE2-CG2 4.06Å; Y48-V163 WeakPolarHBondContact OH-CG2 3.43Å
49H90.2Very high88Confident77 Ų7745.1 Ų45.136%0.35623%0.229SC..Hα-helixtrans-56.7-47.6173.1-169.173000112.1N45 E46 L51 I52 L53 D159N45-H49 WeakPolarHBondContact O-CB 3.46Å; N45-H49 PolarHBondContact O-N 3.05Å; E46-H49 PolarHBondContact O-N 2.84Å; H49-L51 VanDerWaalsContact C-N 3.26Å; H49-L51 PolarHBondContact O-N 2.94Å; H49-I52 WeakPolarHBondContact O-CB 3.38Å; H49-I52 PolarHBondContact O-N 3Å; H49-I52 VanDerWaalsContact O-N 3.11Å; H49-L53 WeakPolarHBondContact O-CG 3.31Å; H49-L53 PolarHBondContact O-N 3.05Å; H49-D159 IonicContact CG-OD1 2.72Å; H49-D159 PolarHBondContact N-OD2 3.45Å; H49-D159 IonicContact ND1-OD1 3.36Å; H49-D159 PolarHBondContact ND1-OD1 2.6Å; H49-D159 VanDerWaalsContact ND1-OD1 3.11Å; H49-D159 IonicContact ND1-OD2 2.64Å
50N91.4Very high88.3Confident70 Ų7047.9 Ų47.937%0.37425%0.245SC..Hα-helixtrans-60.7-35.7175.8-80.3-55.3000113E46 K47 Y48 I52 L53 S54E46-N50 WeakPolarHBondContact O-CB 3.49Å; E46-N50 PolarHBondContact O-N 3.39Å; E46-N50 PolarHBondContact O-ND2 3.1Å; K47-N50 PolarHBondContact O-N 3.47Å; Y48-N50 PolarHBondContact O-N 3.3Å; N50-I52 VanDerWaalsContact C-N 3.33Å; N50-L53 PolarHBondContact O-N 3.08Å; N50-S54 WeakPolarHBondContact O-CB 3.37Å; N50-S54 PolarHBondContact O-N 3.28Å; N50-S54 PolarHBondContact O-OG 3.46Å
51L91.7Very high88.3Confident0 Ų045.8 Ų45.80%023%0.232CC..Hα-helixtrans-68.2-35.9176.6-177.553.4000111.5I20 D23 I24 F27 K47 Y48 H49 T55 L96I20-L51 HydrophobicContact CG2-CD1 4.37Å; D23-L51 HydrophobicContact CB-CD1 4Å; I24-L51 HydrophobicContact CD1-CD1 4.5Å; I24-L51 HydrophobicContact CG1-CD1 3.54Å; I24-L51 HydrophobicContact CG1-CD2 4.04Å; I24-L51 HydrophobicContact CG1-CG 4.41Å; F27-L51 HydrophobicContact CB-CD2 4.01Å; F27-L51 HydrophobicContact CD1-CD2 3.94Å; F27-L51 HydrophobicContact CG-CD2 4.05Å; K47-L51 WeakPolarHBondContact O-CB 3.47Å; K47-L51 PolarHBondContact O-N 2.93Å; Y48-L51 WeakPolarHBondContact O-CB 3.47Å; Y48-L51 PolarHBondContact O-N 2.79Å; Y48-L51 VanDerWaalsContact O-N 3.09Å; H49-L51 VanDerWaalsContact C-N 3.26Å; H49-L51 PolarHBondContact O-N 2.94Å; L51-T55 VanDerWaalsContact O-CB 3.31Å; L51-T55 WeakPolarHBondContact O-CB 3.18Å; L51-T55 PolarHBondContact O-N 3.45Å; L51-T55 PolarHBondContact O-OG1 2.99Å; L51-L96 HydrophobicContact CD1-CD2 4.46Å; L51-L96 HydrophobicContact CD2-CD1 3.39Å; L51-L96 HydrophobicContact CD2-CG 4.45Å; L51-L96 HydrophobicContact CG-CD1 3.81Å; L51-L96 HydrophobicContact CG-CD2 4.11Å
52I88.7Confident88.3Confident0 Ų043.6 Ų43.60%022%0.223CC..Hα-helixtrans-65.2-49.1173.3-67.8162.6000111.4Y48 H49 N50 S54 T55 K56 D159 Q162 V163 L166Y48-I52 HydrophobicContact CD1-CD1 4.28Å; Y48-I52 HydrophobicContact CE1-CD1 4.38Å; Y48-I52 WeakPolarHBondContact O-CG1 3.44Å; Y48-I52 PolarHBondContact O-N 2.83Å; H49-I52 WeakPolarHBondContact O-CB 3.38Å; H49-I52 PolarHBondContact O-N 3Å; H49-I52 VanDerWaalsContact O-N 3.11Å; N50-I52 VanDerWaalsContact C-N 3.33Å; I52-S54 VanDerWaalsContact C-N 3.28Å; I52-S54 PolarHBondContact O-N 2.57Å; I52-T55 PolarHBondContact O-N 2.93Å; I52-T55 VanDerWaalsContact O-N 3.11Å; I52-K56 WeakPolarHBondContact O-CB 3.49Å; I52-K56 PolarHBondContact O-N 3.14Å; I52-D159 HydrophobicContact CD1-CB 3.38Å; I52-D159 VanDerWaalsContact CD1-O 3.26Å; I52-D159 WeakPolarHBondContact CD1-O 3.19Å; I52-Q162 HydrophobicContact CD1-CB 4.46Å; I52-Q162 HydrophobicContact CG2-CB 4.35Å; I52-Q162 HydrophobicContact CG2-CG 3.72Å; I52-V163 HydrophobicContact CD1-CG2 3.71Å; I52-V163 HydrophobicContact CG1-CG2 3.3Å; I52-L166 HydrophobicContact CG2-CD1 3.77Å
53L90Very high88.1Confident81 Ų8139.5 Ų39.542%0.42421%0.211SC..Hα-helixtrans-57.5-44.5177.5-67.9177.5000111.3H49 N50 K56 D57H49-L53 WeakPolarHBondContact O-CG 3.31Å; H49-L53 PolarHBondContact O-N 3.05Å; N50-L53 PolarHBondContact O-N 3.08Å; L53-K56 PolarHBondContact O-N 3.49Å; L53-D57 WeakPolarHBondContact O-CB 3.44Å; L53-D57 PolarHBondContact O-N 3.05Å
54S89.2Confident87.7Confident9 Ų939.7 Ų39.76%0.06321%0.21CC..Hα-helixtrans-64.7-40.6177.1-55.90000111.6K19 I20 D23 N50 I52 D57 L58K19-S54 PolarHBondContact NZ-OG 2.93Å; I20-S54 WeakPolarHBondContact CD1-O 3.43Å; D23-S54 PolarHBondContact OD2-OG 3.28Å; N50-S54 WeakPolarHBondContact O-CB 3.37Å; N50-S54 PolarHBondContact O-N 3.28Å; N50-S54 PolarHBondContact O-OG 3.46Å; I52-S54 VanDerWaalsContact C-N 3.28Å; I52-S54 PolarHBondContact O-N 2.57Å; S54-D57 PolarHBondContact O-N 3.15Å; S54-L58 PolarHBondContact O-N 2.87Å
55T87.9Confident87.2Confident2 Ų239.8 Ų39.81%0.01221%0.21CC..Hα-helixtrans-65.3-43177.9-59.60000112.1L51 I52 D57 L58 S59 L93 L96 L166 L170L51-T55 VanDerWaalsContact O-CB 3.31Å; L51-T55 WeakPolarHBondContact O-CB 3.18Å; L51-T55 PolarHBondContact O-N 3.45Å; L51-T55 PolarHBondContact O-OG1 2.99Å; I52-T55 PolarHBondContact O-N 2.93Å; I52-T55 VanDerWaalsContact O-N 3.11Å; T55-D57 VanDerWaalsContact C-N 3.33Å; T55-L58 PolarHBondContact O-N 3.26Å; T55-S59 PolarHBondContact O-N 3.47Å; T55-L93 HydrophobicContact CG2-CD2 3.61Å; T55-L96 HydrophobicContact CG2-CD2 4.09Å; T55-L96 WeakPolarHBondContact OG1-CD2 3.42Å; T55-L166 HydrophobicContact CG2-CD1 4.01Å; T55-L170 HydrophobicContact CG2-CD1 3.99Å
56K88.1Confident86.6Confident124 Ų12440.2 Ų40.254%0.53921%0.212SC..Hα-helixtrans-60.6-44.3175-177.9176.2179.4173.50111.4I52 L53 S59 S60 L166I52-K56 WeakPolarHBondContact O-CB 3.49Å; I52-K56 PolarHBondContact O-N 3.14Å; L53-K56 PolarHBondContact O-N 3.49Å; K56-S59 VanDerWaalsContact O-CB 3.32Å; K56-S59 WeakPolarHBondContact O-CB 3.43Å; K56-S59 PolarHBondContact O-N 3.01Å; K56-S60 PolarHBondContact O-N 3.28Å; K56-L166 HydrophobicContact CB-CD1 4.26Å; K56-L166 HydrophobicContact CB-CD2 4.1Å; K56-L166 HydrophobicContact CG-CD2 4.32Å
57D87.9Confident85.9Confident58 Ų5840.2 Ų40.231%0.3121%0.21SC..Hα-helixtrans-62.1-42.2176.116980.6000112.3R16 L53 S54 T55 S59 S60R16-D57 WeakPolarHBondContact CD-OD2 3.27Å; R16-D57 IonicContact CZ-OD1 3.85Å; R16-D57 IonicContact CZ-OD2 2.74Å; R16-D57 IonicContact NE-OD2 2.78Å; R16-D57 IonicContact NH1-OD1 2.62Å; R16-D57 PolarHBondContact NH1-OD1 3.48Å; R16-D57 IonicContact NH1-OD2 3.73Å; R16-D57 PolarHBondContact NH1-OD2 3.02Å; R16-D57 IonicContact NH2-OD1 3.55Å; L53-D57 WeakPolarHBondContact O-CB 3.44Å; L53-D57 PolarHBondContact O-N 3.05Å; S54-D57 PolarHBondContact O-N 3.15Å; T55-D57 VanDerWaalsContact C-N 3.33Å; D57-S59 PolarHBondContact O-N 3.37Å; D57-S60 PolarHBondContact O-N 3.35Å
58L86.7Confident85.1Confident0 Ų037 Ų370%020%0.197CC..Hα-helixtrans-63.8-39.4171.717566.5000112.4T13 R16 I17 I20 S54 T55 S60 H61 L62 A89T13-L58 HydrophobicContact CG2-CD1 3.83Å; R16-L58 HydrophobicContact CB-CD1 4.11Å; I17-L58 HydrophobicContact CG1-CD1 3.93Å; I17-L58 HydrophobicContact CG1-CD2 4.32Å; I20-L58 HydrophobicContact CD1-CB 3.26Å; I20-L58 HydrophobicContact CD1-CD2 3.3Å; I20-L58 HydrophobicContact CD1-CG 3.82Å; S54-L58 PolarHBondContact O-N 2.87Å; T55-L58 PolarHBondContact O-N 3.26Å; L58-S60 PolarHBondContact O-N 3.04Å; L58-H61 PolarHBondContact O-N 2.65Å; L58-L62 HydrophobicContact CD1-CG 4.25Å; L58-L62 HydrophobicContact CD2-CD1 4.43Å; L58-L62 HydrophobicContact CG-CD1 4.13Å; L58-L62 HydrophobicContact CG-CG 4.15Å; L58-L62 PolarHBondContact O-N 3.17Å; L58-A89 HydrophobicContact CD2-CB 3.98Å
59S84.7Confident84.2Confident13 Ų1338.2 Ų38.29%0.09120%0.203CC..Hα-helixtrans-55.4-38.8179.6-173.30000112.5T55 K56 D57 H61 L62 A63 L170T55-S59 PolarHBondContact O-N 3.47Å; K56-S59 VanDerWaalsContact O-CB 3.32Å; K56-S59 WeakPolarHBondContact O-CB 3.43Å; K56-S59 PolarHBondContact O-N 3.01Å; D57-S59 PolarHBondContact O-N 3.37Å; S59-H61 VanDerWaalsContact C-N 3.35Å; S59-H61 PolarHBondContact O-N 2.79Å; S59-L62 PolarHBondContact O-N 3.29Å; S59-A63 PolarHBondContact O-N 2.92Å; S59-L170 WeakPolarHBondContact OG-CD2 3.42Å
60S84.2Confident83.2Confident82 Ų8241.2 Ų41.257%0.57322%0.217SC*.Hα-helixtrans-65.4-36.6177.7-60.80000112.7K56 D57 L58K56-S60 PolarHBondContact O-N 3.28Å; D57-S60 PolarHBondContact O-N 3.35Å; L58-S60 PolarHBondContact O-N 3.04Å
61H82Confident82Confident30 Ų3042.6 Ų42.614%0.13923%0.228CC..Hα-helixtrans-77-30.8177.1-79.2-87.2000113E9 T13 R16 L58 S59 A63 V64 I65E9-H61 IonicContact OE2-CE1 2.64Å; E9-H61 PolarHBondContact OE2-CE1 3.06Å; E9-H61 IonicContact OE2-ND1 2.82Å; E9-H61 PolarHBondContact OE2-ND1 3.41Å; T13-H61 HydrophobicContact CG2-CB 4.45Å; R16-H61 VanDerWaalsContact CZ-NE2 3.25Å; R16-H61 PolarHBondContact NE-CD2 2.99Å; R16-H61 PolarHBondContact NE-NE2 3.44Å; R16-H61 PolarHBondContact NH2-NE2 3.47Å; L58-H61 PolarHBondContact O-N 2.65Å; S59-H61 VanDerWaalsContact C-N 3.35Å; S59-H61 PolarHBondContact O-N 2.79Å; H61-A63 PolarHBondContact O-N 3.25Å; H61-V64 WeakPolarHBondContact O-CB 3.3Å; H61-V64 PolarHBondContact O-N 3.14Å; H61-I65 PolarHBondContact O-N 3.38Å
62L83.4Confident80.6Confident4 Ų444.3 Ų44.32%0.02125%0.246CC..Hα-helixtrans-59.9-36.8173.9-73.4176.4000111.8L58 S59 V64 I65 Q66 A89 L93 L170L58-L62 HydrophobicContact CD1-CG 4.25Å; L58-L62 HydrophobicContact CD2-CD1 4.43Å; L58-L62 HydrophobicContact CG-CD1 4.13Å; L58-L62 HydrophobicContact CG-CG 4.15Å; L58-L62 PolarHBondContact O-N 3.17Å; S59-L62 PolarHBondContact O-N 3.29Å; L62-V64 VanDerWaalsContact C-N 3.28Å; L62-V64 PolarHBondContact O-N 3.42Å; L62-I65 PolarHBondContact O-N 2.79Å; L62-Q66 VanDerWaalsContact O-CG 3.28Å; L62-Q66 WeakPolarHBondContact O-CG 3.41Å; L62-Q66 PolarHBondContact O-N 3.38Å; L62-A89 HydrophobicContact CD1-CB 4.09Å; L62-A89 HydrophobicContact CD2-CB 3.69Å; L62-A89 HydrophobicContact CG-CB 4.42Å; L62-L93 HydrophobicContact CD1-CD1 4.31Å; L62-L170 HydrophobicContact CD1-CD2 3.77Å
63A81.8Confident79.4Confident38 Ų3845.5 Ų45.531%0.31425%0.254SS..Hα-helixtrans-59.5-38.6173.700000112.7S59 H61 K67S59-A63 PolarHBondContact O-N 2.92Å; H61-A63 PolarHBondContact O-N 3.25Å; A63-K67 PolarHBondContact O-N 3.11Å; A63-K67 VanDerWaalsContact O-N 3.11Å
64V79.9Confident78.3Confident42 Ų4250.8 Ų50.826%0.25528%0.276SS..Hα-helixtrans-68.8-44175.8-178.90000110.7M1 E9 H61 L62 Q66 K67 V68M1-V64 HydrophobicContact CE-CG1 4.18Å; E9-V64 HydrophobicContact CB-CG1 4.35Å; E9-V64 HydrophobicContact CG-CG1 4.13Å; H61-V64 WeakPolarHBondContact O-CB 3.3Å; H61-V64 PolarHBondContact O-N 3.14Å; L62-V64 VanDerWaalsContact C-N 3.28Å; L62-V64 PolarHBondContact O-N 3.42Å; V64-Q66 VanDerWaalsContact C-N 3.33Å; V64-Q66 PolarHBondContact O-N 2.95Å; V64-K67 WeakPolarHBondContact O-CB 3.48Å; V64-K67 PolarHBondContact O-N 3.37Å; V64-K67 VanDerWaalsContact O-N 3.16Å; V64-V68 WeakPolarHBondContact O-CG2 3.5Å; V64-V68 PolarHBondContact O-N 3.27Å
65I79.7Confident77.7Confident2 Ų253.6 Ų53.61%0.0129%0.29CS..Hα-helixtrans-58.3-45.6174.9-75.5-171.6000111.1L10 T13 H61 L62 K67 V68 I69 A82 L85 N86L10-I65 HydrophobicContact CD2-CD1 4.22Å; L10-I65 HydrophobicContact CD2-CG1 4.09Å; T13-I65 HydrophobicContact CG2-CD1 3.23Å; T13-I65 HydrophobicContact CG2-CG1 4.33Å; H61-I65 PolarHBondContact O-N 3.38Å; L62-I65 PolarHBondContact O-N 2.79Å; I65-K67 VanDerWaalsContact C-N 3.28Å; I65-K67 PolarHBondContact O-N 2.92Å; I65-V68 CarbonylContact O-C 3.57Å; I65-V68 WeakPolarHBondContact O-CA 3.37Å; I65-V68 WeakPolarHBondContact O-CB 3.28Å; I65-V68 PolarHBondContact O-N 3.46Å; I65-I69 HydrophobicContact CG2-CD1 3.63Å; I65-I69 HydrophobicContact CG2-CG1 4.23Å; I65-I69 WeakPolarHBondContact O-CG1 3.37Å; I65-I69 PolarHBondContact O-N 2.98Å; I65-A82 HydrophobicContact CG2-CB 4.24Å; I65-L85 HydrophobicContact CD1-CB 4.01Å; I65-L85 HydrophobicContact CD1-CD1 4.38Å; I65-N86 HydrophobicContact CG2-CB 4.38Å
66Q76.6Confident77.2Confident17 Ų1757.9 Ų57.98%0.07932%0.317CS..Hα-helixtrans-59.1-42.2176.9-72.4178.2-65.400111.5L62 V64 V68 I69 Q70 Y173L62-Q66 VanDerWaalsContact O-CG 3.28Å; L62-Q66 WeakPolarHBondContact O-CG 3.41Å; L62-Q66 PolarHBondContact O-N 3.38Å; V64-Q66 VanDerWaalsContact C-N 3.33Å; V64-Q66 PolarHBondContact O-N 2.95Å; Q66-V68 VanDerWaalsContact C-N 3.3Å; Q66-V68 PolarHBondContact O-N 3.49Å; Q66-I69 PolarHBondContact O-N 2.73Å; Q66-Q70 WeakPolarHBondContact O-CB 3.36Å; Q66-Q70 WeakPolarHBondContact O-CG 3.44Å; Q66-Q70 PolarHBondContact O-N 3.09Å; Q66-Y173 VanDerWaalsContact NE2-C 3.27Å; Q66-Y173 VanDerWaalsContact NE2-CB 3.31Å; Q66-Y173 PolarHBondContact NE2-O 3.47Å
67K77Confident76.9Confident123 Ų12357.3 Ų57.354%0.53532%0.321SS..Hα-helixtrans-61.8-38.4174.3-170.2175-177174.40111.8A63 V64 I65 V71A63-K67 PolarHBondContact O-N 3.11Å; A63-K67 VanDerWaalsContact O-N 3.11Å; V64-K67 WeakPolarHBondContact O-CB 3.48Å; V64-K67 PolarHBondContact O-N 3.37Å; V64-K67 VanDerWaalsContact O-N 3.16Å; I65-K67 VanDerWaalsContact C-N 3.28Å; I65-K67 PolarHBondContact O-N 2.92Å; K67-V71 HydrophobicContact CG-CG2 3.94Å; K67-V71 WeakPolarHBondContact O-CA 3.04Å; K67-V71 WeakPolarHBondContact O-CB 3.44Å; K67-V71 VanDerWaalsContact O-CG2 3.3Å; K67-V71 WeakPolarHBondContact O-CG2 3.3Å; K67-V71 PolarHBondContact O-N 2.92Å
68V73.8Confident76.5Confident6 Ų654.9 Ų54.94%0.03631%0.307CS..Hα-helixtrans-67.3-37174.7172.40000112.1M1 V6 V64 I65 Q66 A82M1-V68 HydrophobicContact SD-CG2 4.12Å; V6-V68 HydrophobicContact CG1-CG1 3.72Å; V6-V68 HydrophobicContact CG1-CG2 4.1Å; V6-V68 HydrophobicContact CG2-CG2 4.29Å; V64-V68 WeakPolarHBondContact O-CG2 3.5Å; V64-V68 PolarHBondContact O-N 3.27Å; I65-V68 CarbonylContact O-C 3.57Å; I65-V68 WeakPolarHBondContact O-CA 3.37Å; I65-V68 WeakPolarHBondContact O-CB 3.28Å; I65-V68 PolarHBondContact O-N 3.46Å; Q66-V68 VanDerWaalsContact C-N 3.3Å; Q66-V68 PolarHBondContact O-N 3.49Å; V68-A82 HydrophobicContact CG1-CB 4.32Å
69I73.8Confident76.1Confident25 Ų2558.6 Ų58.613%0.12832%0.321CS..Hα-helixtrans-69.4-45.8177-67.2169000110.7I65 Q66 A82 R83 N86I65-I69 HydrophobicContact CG2-CD1 3.63Å; I65-I69 HydrophobicContact CG2-CG1 4.23Å; I65-I69 WeakPolarHBondContact O-CG1 3.37Å; I65-I69 PolarHBondContact O-N 2.98Å; Q66-I69 PolarHBondContact O-N 2.73Å; I69-A82 HydrophobicContact CD1-CB 4.22Å; I69-A82 HydrophobicContact CG1-CB 3.7Å; I69-R83 HydrophobicContact CD1-CG 4.33Å; I69-N86 HydrophobicContact CD1-CB 4.33Å
70Q69.9Low75.9Confident139 Ų13959.1 Ų59.165%0.6533%0.326SS*.Hα-helixtrans-75.3-48.3-177.9-74.1-170.5-16.500112.9Q66 G72Q66-Q70 WeakPolarHBondContact O-CB 3.36Å; Q66-Q70 WeakPolarHBondContact O-CG 3.44Å; Q66-Q70 PolarHBondContact O-N 3.09Å; Q70-G72 PolarHBondContact O-N 3.16Å
71V66.1Low75.8Confident99 Ų9957.9 Ų57.960%0.631%0.309SS*.THydrogen-bonded Turntrans-79.576.2174.2-174.50000106.1K67 S73K67-V71 HydrophobicContact CG-CG2 3.94Å; K67-V71 WeakPolarHBondContact O-CA 3.04Å; K67-V71 WeakPolarHBondContact O-CB 3.44Å; K67-V71 VanDerWaalsContact O-CG2 3.3Å; K67-V71 WeakPolarHBondContact O-CG2 3.3Å; K67-V71 PolarHBondContact O-N 2.92Å; V71-S73 VanDerWaalsContact C-N 3.34Å; V71-S73 PolarHBondContact O-N 2.96Å
72G60.6Low75.9Confident37 Ų3756.5 Ų56.538%0.38130%0.303SS..THydrogen-bonded Turntrans-36.594.9-172.400000112Q70 H74Q70-G72 PolarHBondContact O-N 3.16Å; G72-H74 PolarHBondContact O-N 3.37Å; G72-H74 VanDerWaalsContact O-N 3.11Å
73S63.8Low75.7Confident25 Ų2558 Ų5818%0.17531%0.308CS..  trans-51.2127170.3176.30000105.5V71 I75V71-S73 VanDerWaalsContact C-N 3.34Å; V71-S73 PolarHBondContact O-N 2.96Å; S73-I75 PolarHBondContact O-N 3.03Å
74H66.9Low75.6Confident192 Ų19256.5 Ų56.589%0.88930%0.295SS*.SBendtrans-65.47.2-176.3-68.167.7000112.2G72G72-H74 PolarHBondContact O-N 3.37Å; G72-H74 VanDerWaalsContact O-N 3.11Å
75I76.1Confident75.8Confident68 Ų6854.6 Ų54.635%0.34928%0.284SS..  trans-116.1106-177.6-52.8177.7000107.8A3 S73 D77 L78 R79A3-I75 HydrophobicContact CB-CD1 3.88Å; S73-I75 PolarHBondContact O-N 3.03Å; I75-D77 HydrophobicContact CG2-CB 4.18Å; I75-D77 PolarHBondContact O-N 3.39Å; I75-L78 HydrophobicContact CB-CB 4.3Å; I75-L78 HydrophobicContact CB-CD1 4.11Å; I75-L78 HydrophobicContact CB-CG 4.04Å; I75-L78 HydrophobicContact CD1-CD1 3.76Å; I75-L78 HydrophobicContact CD1-CG 4.44Å; I75-L78 HydrophobicContact CG1-CD1 4.44Å; I75-L78 HydrophobicContact CG2-CB 4.42Å; I75-L78 HydrophobicContact CG2-CD1 4.36Å; I75-L78 HydrophobicContact CG2-CG 3.9Å; I75-L78 PolarHBondContact O-N 3.41Å; I75-R79 PolarHBondContact O-N 3.48Å
76P78.3Confident75.9Confident91 Ų9154.7 Ų54.759%0.59128%0.284SS*.Hα-helixtrans-59.2-32.4-177.722.2-32.7000113.1R79 A80P76-R79 PolarHBondContact O-N 2.87Å; P76-A80 PolarHBondContact O-N 3.37Å
77D81.1Confident76.2Confident113 Ų11355.6 Ų55.660%0.60429%0.291SS*.Hα-helixtrans-63.2-45.2177.4-176.866.3000112.8I75 R79 A80 R81I75-D77 HydrophobicContact CG2-CB 4.18Å; I75-D77 PolarHBondContact O-N 3.39Å; D77-R79 VanDerWaalsContact C-N 3.27Å; D77-R79 PolarHBondContact O-N 3Å; D77-A80 PolarHBondContact O-N 2.88Å; D77-R81 PolarHBondContact O-N 3.08Å
78L80.8Confident76.4Confident7 Ų750.4 Ų50.44%0.03727%0.268CS..Hα-helixtrans-65.3-33.9177.1-64.5-175.4000111.9V6 I7 L10 I75 A82V6-L78 HydrophobicContact CB-CD1 4.24Å; V6-L78 HydrophobicContact CG1-CB 4.45Å; V6-L78 HydrophobicContact CG1-CD1 3.89Å; I7-L78 HydrophobicContact CD1-CD2 4.28Å; I7-L78 HydrophobicContact CG1-CD1 4.34Å; I7-L78 HydrophobicContact CG1-CD2 3.58Å; L10-L78 HydrophobicContact CD1-CB 4.4Å; L10-L78 HydrophobicContact CD1-CD2 4.09Å; I75-L78 HydrophobicContact CB-CB 4.3Å; I75-L78 HydrophobicContact CB-CD1 4.11Å; I75-L78 HydrophobicContact CB-CG 4.04Å; I75-L78 HydrophobicContact CD1-CD1 3.76Å; I75-L78 HydrophobicContact CD1-CG 4.44Å; I75-L78 HydrophobicContact CG1-CD1 4.44Å; I75-L78 HydrophobicContact CG2-CB 4.42Å; I75-L78 HydrophobicContact CG2-CD1 4.36Å; I75-L78 HydrophobicContact CG2-CG 3.9Å; I75-L78 PolarHBondContact O-N 3.41Å; L78-A82 VanDerWaalsContact O-CB 3.23Å; L78-A82 WeakPolarHBondContact O-CB 3.33Å; L78-A82 PolarHBondContact O-N 2.95Å
79R78.7Confident76.9Confident77 Ų7750.1 Ų50.129%0.29127%0.267SS..Hα-helixtrans-68.1-42.8174.6-176174.363179.71111.5I75 P76 D77 A82 R83I75-R79 PolarHBondContact O-N 3.48Å; P76-R79 PolarHBondContact O-N 2.87Å; D77-R79 VanDerWaalsContact C-N 3.27Å; D77-R79 PolarHBondContact O-N 3Å; R79-A82 PolarHBondContact O-N 3.36Å; R79-R83 WeakPolarHBondContact O-CG 3.43Å; R79-R83 PolarHBondContact O-N 2.98Å
80A79.2Confident77.3Confident24 Ų2451.6 Ų51.620%0.19827%0.274CS..Hα-helixtrans-60.9-48.6175.200000111P76 D77 A82 R83 T84P76-A80 PolarHBondContact O-N 3.37Å; D77-A80 PolarHBondContact O-N 2.88Å; A80-A82 VanDerWaalsContact C-N 3.34Å; A80-A82 PolarHBondContact O-N 3.37Å; A80-R83 PolarHBondContact O-N 3.24Å; A80-T84 PolarHBondContact O-N 2.75Å; A80-T84 PolarHBondContact O-OG1 3.24Å; A80-T84 VanDerWaalsContact O-OG1 3.09Å
81R82.3Confident77.9Confident57 Ų5748.7 Ų48.722%0.21526%0.263CS..Hα-helixtrans-59.9-42.4175.9-173.1175.3178-157.3-2.7112.3L10 T11 E14 D77 R83 T84 L85L10-R81 HydrophobicContact CD1-CB 4.33Å; L10-R81 HydrophobicContact CD1-CG 4.28Å; T11-R81 PolarHBondContact OG1-NH2 3.47Å; E14-R81 IonicContact OE2-CZ 3.87Å; E14-R81 IonicContact OE2-NE 3.04Å; E14-R81 IonicContact OE2-NH2 3.32Å; E14-R81 PolarHBondContact OE2-NH2 3.41Å; D77-R81 PolarHBondContact O-N 3.08Å; R81-R83 VanDerWaalsContact C-N 3.34Å; R81-R83 PolarHBondContact O-N 3.24Å; R81-T84 PolarHBondContact O-N 3.05Å; R81-L85 HydrophobicContact CG-CD1 4.2Å; R81-L85 VanDerWaalsContact O-CG 3.32Å; R81-L85 WeakPolarHBondContact O-CG 3.25Å; R81-L85 PolarHBondContact O-N 3.01Å
82A83.3Confident78.8Confident0 Ų044.5 Ų44.50%024%0.237CC..Hα-helixtrans-60.4-42.6176.500000112.2L10 I65 V68 I69 L78 R79 A80 N86L10-A82 HydrophobicContact CD2-CB 3.73Å; I65-A82 HydrophobicContact CG2-CB 4.24Å; V68-A82 HydrophobicContact CG1-CB 4.32Å; I69-A82 HydrophobicContact CD1-CB 4.22Å; I69-A82 HydrophobicContact CG1-CB 3.7Å; L78-A82 VanDerWaalsContact O-CB 3.23Å; L78-A82 WeakPolarHBondContact O-CB 3.33Å; L78-A82 PolarHBondContact O-N 2.95Å; R79-A82 PolarHBondContact O-N 3.36Å; A80-A82 VanDerWaalsContact C-N 3.34Å; A80-A82 PolarHBondContact O-N 3.37Å; A82-N86 WeakPolarHBondContact O-CB 3.41Å; A82-N86 PolarHBondContact O-N 3.42Å
83R79.4Confident79.9Confident37 Ų3743 Ų4314%0.1422%0.22CC..Hα-helixtrans-64.5-46.9175.2-73.3-178.7176162.6-7.5112.3I69 R79 A80 R81 L85 N86 T87 L180 E189I69-R83 HydrophobicContact CD1-CG 4.33Å; R79-R83 WeakPolarHBondContact O-CG 3.43Å; R79-R83 PolarHBondContact O-N 2.98Å; A80-R83 PolarHBondContact O-N 3.24Å; R81-R83 VanDerWaalsContact C-N 3.34Å; R81-R83 PolarHBondContact O-N 3.24Å; R83-L85 VanDerWaalsContact C-N 3.32Å; R83-L85 PolarHBondContact O-N 3.39Å; R83-N86 WeakPolarHBondContact O-CA 3.29Å; R83-N86 VanDerWaalsContact O-CB 3.31Å; R83-N86 WeakPolarHBondContact O-CB 3.45Å; R83-N86 PolarHBondContact O-N 3.43Å; R83-T87 PolarHBondContact O-N 2.88Å; R83-T87 PolarHBondContact O-OG1 2.69Å; R83-L180 PolarHBondContact NH2-O 3.36Å; R83-E189 WeakPolarHBondContact CB-OE1 3.29Å; R83-E189 WeakPolarHBondContact CD-OE2 3.2Å
84T81Confident80.8Confident5 Ų543.3 Ų43.33%0.03123%0.228CC..Hα-helixtrans-59.5-43.8177.6-47.80000111.8A80 R81 N86 T87 Q88 Y192A80-T84 PolarHBondContact O-N 2.75Å; A80-T84 PolarHBondContact O-OG1 3.24Å; A80-T84 VanDerWaalsContact O-OG1 3.09Å; R81-T84 PolarHBondContact O-N 3.05Å; T84-N86 VanDerWaalsContact C-N 3.28Å; T84-N86 PolarHBondContact O-N 3.47Å; T84-T87 PolarHBondContact O-N 2.99Å; T84-Q88 VanDerWaalsContact CG2-NE2 3.33Å; T84-Q88 WeakPolarHBondContact O-CG 3.06Å; T84-Q88 PolarHBondContact O-N 2.79Å; T84-Y192 HydrophobicContact CG2-CD1 3.43Å; T84-Y192 VanDerWaalsContact CG2-CD1 3.43Å; T84-Y192 HydrophobicContact CG2-CE1 3.76Å
85L84.1Confident81.6Confident3 Ų337.8 Ų37.82%0.01620%0.199CC..Hα-helixtrans-62.6-37.6176.2-70.1173.4000111.7L10 E14 I17 I65 R81 R83 Q88 A89L10-L85 HydrophobicContact CB-CD1 3.88Å; L10-L85 HydrophobicContact CD2-CD1 3.9Å; L10-L85 HydrophobicContact CG-CD1 4.46Å; L10-L85 VanDerWaalsContact O-CD1 3.22Å; L10-L85 WeakPolarHBondContact O-CD1 3.33Å; E14-L85 HydrophobicContact CB-CD1 4.49Å; E14-L85 HydrophobicContact CB-CD2 3.62Å; E14-L85 HydrophobicContact CG-CD2 3.84Å; I17-L85 HydrophobicContact CD1-CB 4.08Å; I17-L85 HydrophobicContact CD1-CD2 3.94Å; I17-L85 WeakPolarHBondContact CD1-O 3.35Å; I65-L85 HydrophobicContact CD1-CB 4.01Å; I65-L85 HydrophobicContact CD1-CD1 4.38Å; R81-L85 HydrophobicContact CG-CD1 4.2Å; R81-L85 VanDerWaalsContact O-CG 3.32Å; R81-L85 WeakPolarHBondContact O-CG 3.25Å; R81-L85 PolarHBondContact O-N 3.01Å; R83-L85 VanDerWaalsContact C-N 3.32Å; R83-L85 PolarHBondContact O-N 3.39Å; L85-Q88 PolarHBondContact O-N 3.41Å; L85-A89 WeakPolarHBondContact O-CB 3.49Å; L85-A89 PolarHBondContact O-N 3.25Å
86N82.2Confident82.1Confident3 Ų334.6 Ų34.62%0.01618%0.182CC..Hα-helixtrans-63.3-48.3174.8-147.1-46.5000111.8I65 I69 A82 R83 T84 Q88 A89 I90 Q177I65-N86 HydrophobicContact CG2-CB 4.38Å; I69-N86 HydrophobicContact CD1-CB 4.33Å; A82-N86 WeakPolarHBondContact O-CB 3.41Å; A82-N86 PolarHBondContact O-N 3.42Å; R83-N86 WeakPolarHBondContact O-CA 3.29Å; R83-N86 VanDerWaalsContact O-CB 3.31Å; R83-N86 WeakPolarHBondContact O-CB 3.45Å; R83-N86 PolarHBondContact O-N 3.43Å; T84-N86 VanDerWaalsContact C-N 3.28Å; T84-N86 PolarHBondContact O-N 3.47Å; N86-Q88 VanDerWaalsContact C-N 3.34Å; N86-Q88 PolarHBondContact O-N 3.18Å; N86-A89 WeakPolarHBondContact O-CB 3.37Å; N86-A89 PolarHBondContact O-N 3.04Å; N86-I90 VanDerWaalsContact O-CG1 3.26Å; N86-I90 WeakPolarHBondContact O-CG1 3.44Å; N86-I90 PolarHBondContact O-N 2.69Å; N86-Q177 VanDerWaalsContact CG-NE2 3.34Å; N86-Q177 VanDerWaalsContact CG-OE1 3.32Å; N86-Q177 PolarHBondContact ND2-NE2 2.79Å; N86-Q177 PolarHBondContact ND2-OE1 2.87Å; N86-Q177 PolarHBondContact OD1-NE2 3.32Å
87T80.8Confident82.4Confident37 Ų3737.5 Ų37.523%0.22718%0.182CC..Hα-helixtrans-58.6-44.4176.3-60.30000111.6R83 T84 A89 I90 N91R83-T87 PolarHBondContact O-N 2.88Å; R83-T87 PolarHBondContact O-OG1 2.69Å; T84-T87 PolarHBondContact O-N 2.99Å; T87-A89 PolarHBondContact O-N 3.48Å; T87-I90 PolarHBondContact O-N 2.98Å; T87-N91 PolarHBondContact O-N 2.64Å; T87-N91 PolarHBondContact O-ND2 2.82Å
88Q82.9Confident82.6Confident14 Ų1439.9 Ų39.97%0.06519%0.186CC..Hα-helixtrans-62.1-43.5175.7-73.1177.557.400112.3I17 T84 L85 N86 N91 Q92 Q196I17-Q88 HydrophobicContact CD1-CB 4.29Å; I17-Q88 HydrophobicContact CG2-CB 3.98Å; T84-Q88 VanDerWaalsContact CG2-NE2 3.33Å; T84-Q88 WeakPolarHBondContact O-CG 3.06Å; T84-Q88 PolarHBondContact O-N 2.79Å; L85-Q88 PolarHBondContact O-N 3.41Å; N86-Q88 VanDerWaalsContact C-N 3.34Å; N86-Q88 PolarHBondContact O-N 3.18Å; Q88-N91 PolarHBondContact O-N 2.78Å; Q88-Q92 WeakPolarHBondContact O-CG 3.32Å; Q88-Q92 PolarHBondContact O-N 3.39Å; Q88-Q196 VanDerWaalsContact NE2-CD 3.31Å
89A84.4Confident82.9Confident0 Ų040.3 Ų40.30%019%0.189CC..Hα-helixtrans-59.6-48.4175.200000111.2I17 L58 L62 L85 N86 T87 N91 Q92 L93I17-A89 HydrophobicContact CD1-CB 4.08Å; I17-A89 HydrophobicContact CG1-CB 4.15Å; L58-A89 HydrophobicContact CD2-CB 3.98Å; L62-A89 HydrophobicContact CD1-CB 4.09Å; L62-A89 HydrophobicContact CD2-CB 3.69Å; L62-A89 HydrophobicContact CG-CB 4.42Å; L85-A89 WeakPolarHBondContact O-CB 3.49Å; L85-A89 PolarHBondContact O-N 3.25Å; N86-A89 WeakPolarHBondContact O-CB 3.37Å; N86-A89 PolarHBondContact O-N 3.04Å; T87-A89 PolarHBondContact O-N 3.48Å; A89-N91 VanDerWaalsContact C-N 3.27Å; A89-N91 PolarHBondContact O-N 3.33Å; A89-Q92 PolarHBondContact O-N 2.87Å; A89-Q92 VanDerWaalsContact O-N 3.15Å; A89-L93 WeakPolarHBondContact O-CB 3.43Å; A89-L93 WeakPolarHBondContact O-CG 3.41Å; A89-L93 PolarHBondContact O-N 3.25Å
90I81.6Confident83.4Confident56 Ų5637 Ų3729%0.28718%0.178SC..Hα-helixtrans-55.4-43.9176.2-68.4162.1000111.1N86 T87 L93 G94 I174N86-I90 VanDerWaalsContact O-CG1 3.26Å; N86-I90 WeakPolarHBondContact O-CG1 3.44Å; N86-I90 PolarHBondContact O-N 2.69Å; T87-I90 PolarHBondContact O-N 2.98Å; I90-L93 WeakPolarHBondContact O-CB 3.39Å; I90-L93 PolarHBondContact O-N 2.96Å; I90-G94 PolarHBondContact O-N 2.87Å; I90-I174 HydrophobicContact CD1-CB 4.43Å; I90-I174 HydrophobicContact CD1-CG1 4.14Å; I90-I174 HydrophobicContact CD1-CG2 3.65Å; I90-I174 HydrophobicContact CG1-CB 4.39Å; I90-I174 HydrophobicContact CG1-CD1 3.75Å; I90-I174 HydrophobicContact CG1-CG1 3.67Å; I90-I174 HydrophobicContact CG1-CG2 3.85Å; I90-I174 HydrophobicContact CG2-CG2 4.44Å
91N82.8Confident83.7Confident77 Ų7737.5 Ų37.541%0.41219%0.187SC..Hα-helixtrans-63-44.3178.3-75.9-31.2000112T87 Q88 A89 G94 R95 E193T87-N91 PolarHBondContact O-N 2.64Å; T87-N91 PolarHBondContact O-ND2 2.82Å; Q88-N91 PolarHBondContact O-N 2.78Å; A89-N91 VanDerWaalsContact C-N 3.27Å; A89-N91 PolarHBondContact O-N 3.33Å; N91-G94 PolarHBondContact O-N 2.88Å; N91-R95 WeakPolarHBondContact O-CG 3.34Å; N91-R95 PolarHBondContact O-N 3.34Å; N91-R95 VanDerWaalsContact O-N 3.12Å; N91-E193 PolarHBondContact ND2-OE1 3.33Å
92Q84.2Confident84.1Confident12 Ų1238.1 Ų38.16%0.05620%0.197CC..Hα-helixtrans-64.3-41.1175.3-61.2-44.2-44.400111.8I17 I20 K21 I24 Q88 A89 G94 R95 L96I17-Q92 HydrophobicContact CG2-CG 4.24Å; I20-Q92 HydrophobicContact CG2-CB 4.06Å; K21-Q92 HydrophobicContact CB-CG 4.27Å; I24-Q92 HydrophobicContact CD1-CB 3.88Å; I24-Q92 WeakPolarHBondContact CD1-O 3.16Å; Q88-Q92 WeakPolarHBondContact O-CG 3.32Å; Q88-Q92 PolarHBondContact O-N 3.39Å; A89-Q92 PolarHBondContact O-N 2.87Å; A89-Q92 VanDerWaalsContact O-N 3.15Å; Q92-G94 VanDerWaalsContact C-N 3.34Å; Q92-G94 PolarHBondContact O-N 3.47Å; Q92-R95 WeakPolarHBondContact O-CB 3.48Å; Q92-R95 PolarHBondContact O-N 3.41Å; Q92-R95 VanDerWaalsContact O-N 3.12Å; Q92-L96 PolarHBondContact O-N 3.06Å
93L83.5Confident84.4Confident5 Ų538.1 Ų38.13%0.02620%0.197CC..Hα-helixtrans-59.8-43.7174.7-71.8176000111.5T55 L62 A89 I90 R95 L96 R97 F167 L170 I174T55-L93 HydrophobicContact CG2-CD2 3.61Å; L62-L93 HydrophobicContact CD1-CD1 4.31Å; A89-L93 WeakPolarHBondContact O-CB 3.43Å; A89-L93 WeakPolarHBondContact O-CG 3.41Å; A89-L93 PolarHBondContact O-N 3.25Å; I90-L93 WeakPolarHBondContact O-CB 3.39Å; I90-L93 PolarHBondContact O-N 2.96Å; L93-R95 VanDerWaalsContact C-N 3.28Å; L93-R95 PolarHBondContact O-N 2.76Å; L93-L96 PolarHBondContact O-N 3.5Å; L93-R97 PolarHBondContact O-N 3.27Å; L93-F167 HydrophobicContact CB-CE1 3.87Å; L93-F167 HydrophobicContact CD2-CE1 4.1Å; L93-F167 WeakPolarHBondContact O-CE1 3.18Å; L93-F167 WeakPolarHBondContact O-CZ 3.26Å; L93-L170 HydrophobicContact CD1-CB 4.31Å; L93-L170 HydrophobicContact CD1-CD1 3.74Å; L93-L170 HydrophobicContact CD1-CD2 4.18Å; L93-L170 HydrophobicContact CD1-CG 4.32Å; L93-L170 HydrophobicContact CD2-CD1 3.52Å; L93-L170 HydrophobicContact CG-CD1 4.26Å; L93-I174 HydrophobicContact CD1-CD1 3.94Å
94G82.4Confident84.8Confident32 Ų3240 Ų4033%0.3321%0.207SC..Hα-helixtrans-59.7-36.6174.100000113.3I90 N91 Q92 K98I90-G94 PolarHBondContact O-N 2.87Å; N91-G94 PolarHBondContact O-N 2.88Å; Q92-G94 VanDerWaalsContact C-N 3.34Å; Q92-G94 PolarHBondContact O-N 3.47Å; G94-K98 WeakPolarHBondContact O-CG 3.35Å; G94-K98 PolarHBondContact O-N 2.98Å
95R84.9Confident85.2Confident75 Ų7543.8 Ų43.828%0.28322%0.224SC..Hα-helixtrans-66.8-47.2174.3-64.6172.668.1-152.5-0.7111.6I24 D25 N91 Q92 L93 R97 K98 L99I24-R95 HydrophobicContact CD1-CB 4.39Å; I24-R95 HydrophobicContact CG2-CB 4.06Å; D25-R95 IonicContact OD1-CZ 3.6Å; D25-R95 VanDerWaalsContact OD1-CZ 3.28Å; D25-R95 IonicContact OD1-NH1 2.77Å; D25-R95 PolarHBondContact OD1-NH1 3.2Å; D25-R95 IonicContact OD1-NH2 3.35Å; D25-R95 PolarHBondContact OD1-NH2 3.41Å; N91-R95 WeakPolarHBondContact O-CG 3.34Å; N91-R95 PolarHBondContact O-N 3.34Å; N91-R95 VanDerWaalsContact O-N 3.12Å; Q92-R95 WeakPolarHBondContact O-CB 3.48Å; Q92-R95 PolarHBondContact O-N 3.41Å; Q92-R95 VanDerWaalsContact O-N 3.12Å; L93-R95 VanDerWaalsContact C-N 3.28Å; L93-R95 PolarHBondContact O-N 2.76Å; R95-R97 VanDerWaalsContact C-N 3.3Å; R95-R97 PolarHBondContact O-N 3.28Å; R95-K98 PolarHBondContact O-N 3.25Å; R95-L99 WeakPolarHBondContact O-CG 3.34Å; R95-L99 PolarHBondContact O-N 3.22Å
96L86.5Confident85.3Confident1 Ų144.7 Ų44.71%0.00523%0.228CC..Hα-helixtrans-59.2-41.1176.4172.853.7000111.6I24 Y48 L51 T55 Q92 L93 K98 L99 G100 V163 F167I24-L96 HydrophobicContact CD1-CB 4.15Å; I24-L96 HydrophobicContact CG1-CB 4.46Å; Y48-L96 HydrophobicContact CE2-CD1 3.99Å; L51-L96 HydrophobicContact CD1-CD2 4.46Å; L51-L96 HydrophobicContact CD2-CD1 3.39Å; L51-L96 HydrophobicContact CD2-CG 4.45Å; L51-L96 HydrophobicContact CG-CD1 3.81Å; L51-L96 HydrophobicContact CG-CD2 4.11Å; T55-L96 HydrophobicContact CG2-CD2 4.09Å; T55-L96 WeakPolarHBondContact OG1-CD2 3.42Å; Q92-L96 PolarHBondContact O-N 3.06Å; L93-L96 PolarHBondContact O-N 3.5Å; L96-K98 VanDerWaalsContact C-N 3.33Å; L96-K98 PolarHBondContact O-N 3.44Å; L96-L99 PolarHBondContact O-N 2.84Å; L96-G100 PolarHBondContact O-N 3.11Å; L96-V163 HydrophobicContact CG-CG1 4.3Å; L96-F167 HydrophobicContact CB-CZ 3.87Å; L96-F167 HydrophobicContact CD2-CZ 4.12Å; L96-F167 HydrophobicContact CG-CE2 4.13Å; L96-F167 HydrophobicContact CG-CZ 3.72Å
97R83.4Confident85.5Confident153 Ų15344.9 Ų44.958%0.57723%0.23SC*.Hα-helixtrans-60.3-43.2177.1-173.5179.8169.390.9-0.4112L93 R95 G100 G101 F167L93-R97 PolarHBondContact O-N 3.27Å; R95-R97 VanDerWaalsContact C-N 3.3Å; R95-R97 PolarHBondContact O-N 3.28Å; R97-G100 PolarHBondContact O-N 2.99Å; R97-G101 PolarHBondContact O-N 2.84Å; R97-G101 VanDerWaalsContact O-N 3.12Å; R97-F167 VanDerWaalsContact CA-CE2 3.41Å; R97-F167 VanDerWaalsContact CA-CZ 3.5Å; R97-F167 HydrophobicContact CB-CD1 4.49Å; R97-F167 HydrophobicContact CB-CD2 4.21Å; R97-F167 HydrophobicContact CB-CE1 3.97Å; R97-F167 HydrophobicContact CB-CE2 3.59Å; R97-F167 HydrophobicContact CB-CZ 3.51Å; R97-F167 HydrophobicContact CG-CD2 4.29Å; R97-F167 HydrophobicContact CG-CE2 4.11Å; R97-F167 HydrophobicContact CG-CZ 4.43Å
98K85.9Confident85.8Confident162 Ų16247.9 Ų47.970%0.70424%0.237SC*.Hα-helixtrans-61.8-44.7176.3-71.1174.4-176.3-179.90111.1G94 R95 L96 G101 V102G94-K98 WeakPolarHBondContact O-CG 3.35Å; G94-K98 PolarHBondContact O-N 2.98Å; R95-K98 PolarHBondContact O-N 3.25Å; L96-K98 VanDerWaalsContact C-N 3.33Å; L96-K98 PolarHBondContact O-N 3.44Å; K98-G101 PolarHBondContact O-N 3.5Å; K98-V102 PolarHBondContact O-N 3.5Å
99L88.1Confident86Confident16 Ų1651.2 Ų51.28%0.08426%0.255CS..Hα-helixtrans-63-43.9176.8-65.7173.2000111.6I24 F27 D28 L31 R95 L96 G101 V102 V103I24-L99 HydrophobicContact CG2-CD1 3.74Å; F27-L99 HydrophobicContact CD1-CB 4.29Å; F27-L99 HydrophobicContact CD1-CD1 3.93Å; F27-L99 HydrophobicContact CE1-CB 4.09Å; D28-L99 HydrophobicContact CB-CD1 3.96Å; D28-L99 HydrophobicContact CB-CD2 3.93Å; D28-L99 WeakPolarHBondContact OD1-CD2 3.46Å; L31-L99 HydrophobicContact CD2-CB 4.43Å; L31-L99 HydrophobicContact CD2-CD2 4Å; R95-L99 WeakPolarHBondContact O-CG 3.34Å; R95-L99 PolarHBondContact O-N 3.22Å; L96-L99 PolarHBondContact O-N 2.84Å; L99-G101 PolarHBondContact O-N 3.47Å; L99-V102 WeakPolarHBondContact O-CA 3.37Å; L99-V102 WeakPolarHBondContact O-CB 3.28Å; L99-V102 PolarHBondContact O-N 3.5Å; L99-V103 VanDerWaalsContact O-CG2 3.29Å; L99-V103 WeakPolarHBondContact O-CG2 3.5Å; L99-V103 PolarHBondContact O-N 3.13Å
100G87.7Confident85.8Confident7 Ų753.9 Ų53.97%0.07227%0.267CS..Hα-helixtrans-55.4-39.1174.500000112.8L96 R97 V102 V103 Q104L96-G100 PolarHBondContact O-N 3.11Å; R97-G100 PolarHBondContact O-N 2.99Å; G100-V102 PolarHBondContact O-N 3.2Å; G100-V103 PolarHBondContact O-N 3.37Å; G100-Q104 VanDerWaalsContact O-CB 3.32Å; G100-Q104 WeakPolarHBondContact O-CB 3.26Å; G100-Q104 PolarHBondContact O-N 3.3Å
101G87.3Confident85.8Confident36 Ų3654.9 Ų54.937%0.37127%0.27SS..Hα-helixtrans-63.1-38.6173.100000113.8R97 K98 L99 Q105R97-G101 PolarHBondContact O-N 2.84Å; R97-G101 VanDerWaalsContact O-N 3.12Å; K98-G101 PolarHBondContact O-N 3.5Å; L99-G101 PolarHBondContact O-N 3.47Å; G101-Q105 PolarHBondContact O-N 2.88Å
102V89.5Confident85.6Confident70 Ų7056.1 Ų56.142%0.42428%0.276SS..Hα-helixtrans-67.9-45.5175.3177.10000110.9L31 K98 L99 G100 Q104 Q105 H106L31-V102 HydrophobicContact CD2-CB 4Å; L31-V102 HydrophobicContact CD2-CG1 3.79Å; L31-V102 HydrophobicContact CG-CG1 4.24Å; K98-V102 PolarHBondContact O-N 3.5Å; L99-V102 WeakPolarHBondContact O-CA 3.37Å; L99-V102 WeakPolarHBondContact O-CB 3.28Å; L99-V102 PolarHBondContact O-N 3.5Å; G100-V102 PolarHBondContact O-N 3.2Å; V102-Q104 VanDerWaalsContact C-N 3.34Å; V102-Q104 PolarHBondContact O-N 3.17Å; V102-Q105 PolarHBondContact O-N 3.32Å; V102-H106 PolarHBondContact O-N 2.81Å
103V90.1Very high85.1Confident0 Ų058.5 Ų58.50%030%0.298CS..Hα-helixtrans-59.8-46.6176.6-1780000110.2F27 L31 L99 G100 Q105 H106 V107 L156 I160F27-V103 HydrophobicContact CE1-CG2 3.78Å; F27-V103 HydrophobicContact CZ-CG2 3.54Å; L31-V103 HydrophobicContact CD1-CG2 3.79Å; L31-V103 HydrophobicContact CD2-CG2 3.7Å; L31-V103 HydrophobicContact CG-CG2 4.39Å; L99-V103 VanDerWaalsContact O-CG2 3.29Å; L99-V103 WeakPolarHBondContact O-CG2 3.5Å; L99-V103 PolarHBondContact O-N 3.13Å; G100-V103 PolarHBondContact O-N 3.37Å; V103-Q105 VanDerWaalsContact C-N 3.27Å; V103-Q105 PolarHBondContact O-N 2.94Å; V103-H106 WeakPolarHBondContact O-CB 3.37Å; V103-H106 PolarHBondContact O-N 3.44Å; V103-H106 VanDerWaalsContact O-N 3.09Å; V103-V107 HydrophobicContact CG1-CG2 4.46Å; V103-V107 WeakPolarHBondContact O-CG2 3.45Å; V103-V107 PolarHBondContact O-N 2.96Å; V103-L156 HydrophobicContact CG1-CD1 3.54Å; V103-L156 HydrophobicContact CG1-CD2 3.78Å; V103-L156 HydrophobicContact CG1-CG 3.64Å; V103-I160 HydrophobicContact CB-CD1 4.44Å; V103-I160 HydrophobicContact CB-CG1 4.44Å; V103-I160 HydrophobicContact CG1-CD1 3.77Å; V103-I160 HydrophobicContact CG1-CG1 3.93Å
104Q88.3Confident84.2Confident76 Ų7663.8 Ų63.836%0.35532%0.318SS..Hα-helixtrans-62.6-36.3178.9-161.8-171.52.400111.9G100 V102 R108 I160G100-Q104 VanDerWaalsContact O-CB 3.32Å; G100-Q104 WeakPolarHBondContact O-CB 3.26Å; G100-Q104 PolarHBondContact O-N 3.3Å; V102-Q104 VanDerWaalsContact C-N 3.34Å; V102-Q104 PolarHBondContact O-N 3.17Å; Q104-R108 VanDerWaalsContact CG-NH1 3.29Å; Q104-R108 WeakPolarHBondContact O-CB 3.48Å; Q104-R108 WeakPolarHBondContact O-CG 3.36Å; Q104-R108 PolarHBondContact O-N 3.01Å; Q104-I160 HydrophobicContact CB-CD1 4.2Å; Q104-I160 HydrophobicContact CB-CG2 4.33Å; Q104-I160 HydrophobicContact CG-CD1 4.43Å; Q104-I160 HydrophobicContact CG-CG2 4.21Å
105Q88.1Confident83.1Confident84 Ų8465.1 Ų65.139%0.39332%0.323SS..Hα-helixtrans-66.8-41.5173.2-172.361.232.100111.9G101 V102 V103 R108 N109G101-Q105 PolarHBondContact O-N 2.88Å; V102-Q105 PolarHBondContact O-N 3.32Å; V103-Q105 VanDerWaalsContact C-N 3.27Å; V103-Q105 PolarHBondContact O-N 2.94Å; Q105-R108 PolarHBondContact O-N 3.43Å; Q105-N109 PolarHBondContact NE2-OD1 2.82Å; Q105-N109 WeakPolarHBondContact O-CB 3.32Å; Q105-N109 PolarHBondContact O-N 3.46Å; Q105-N109 PolarHBondContact O-OD1 2.83Å
106H86.8Confident81.8Confident23 Ų2366 Ų6611%0.10634%0.336CS..Hα-helixtrans-60.6-49.2175.7179.667.5000111.4V102 V103 R108 N109 E110V102-H106 PolarHBondContact O-N 2.81Å; V103-H106 WeakPolarHBondContact O-CB 3.37Å; V103-H106 PolarHBondContact O-N 3.44Å; V103-H106 VanDerWaalsContact O-N 3.09Å; H106-R108 VanDerWaalsContact C-N 3.33Å; H106-R108 PolarHBondContact O-N 3.17Å; H106-N109 PolarHBondContact O-N 3.47Å; H106-N109 VanDerWaalsContact O-N 3.16Å; H106-E110 IonicContact CE1-OE1 3.11Å; H106-E110 VanDerWaalsContact O-CG 3.32Å; H106-E110 WeakPolarHBondContact O-CG 3.38Å; H106-E110 PolarHBondContact O-N 2.84Å
107V86.7Confident80.1Confident7 Ų770.8 Ų70.84%0.04236%0.362CS..Hα-helixtrans-58-43.9176.6170.80000111.5V103 E110 K111 M153 L156 I160V103-V107 HydrophobicContact CG1-CG2 4.46Å; V103-V107 WeakPolarHBondContact O-CG2 3.45Å; V103-V107 PolarHBondContact O-N 2.96Å; V107-E110 PolarHBondContact O-N 3.49Å; V107-K111 HydrophobicContact CG1-CD 4.39Å; V107-K111 WeakPolarHBondContact O-CG 3.48Å; V107-K111 PolarHBondContact O-N 3.09Å; V107-M153 HydrophobicContact CG1-CG 3.82Å; V107-M153 HydrophobicContact CG1-SD 4.1Å; V107-M153 HydrophobicContact CG2-CG 4.46Å; V107-L156 HydrophobicContact CG2-CB 4.39Å; V107-L156 HydrophobicContact CG2-CD2 3.65Å; V107-L156 HydrophobicContact CG2-CG 3.91Å; V107-I160 HydrophobicContact CB-CD1 4.44Å; V107-I160 HydrophobicContact CG2-CD1 3.92Å
108R86.5Confident78.3Confident100 Ų10065.7 Ų65.738%0.37735%0.349SS..Hα-helixtrans-61.8-44.8175.7-78.4-169.6-64.9-100.2-2.3112.6Q104 Q105 H106 E110 K111 N112Q104-R108 VanDerWaalsContact CG-NH1 3.29Å; Q104-R108 WeakPolarHBondContact O-CB 3.48Å; Q104-R108 WeakPolarHBondContact O-CG 3.36Å; Q104-R108 PolarHBondContact O-N 3.01Å; Q105-R108 PolarHBondContact O-N 3.43Å; H106-R108 VanDerWaalsContact C-N 3.33Å; H106-R108 PolarHBondContact O-N 3.17Å; R108-E110 VanDerWaalsContact C-N 3.34Å; R108-K111 PolarHBondContact O-N 2.9Å; R108-N112 VanDerWaalsContact O-CG 3.29Å; R108-N112 PolarHBondContact O-N 2.87Å; R108-N112 PolarHBondContact O-ND2 2.96Å
109N86.5Confident75.9Confident84 Ų8465.7 Ų65.745%0.44935%0.352SS..Hα-helixtrans-63.5-41.9180-69.7-8.6000111.4Q105 H106 N112 A113Q105-N109 PolarHBondContact NE2-OD1 2.82Å; Q105-N109 WeakPolarHBondContact O-CB 3.32Å; Q105-N109 PolarHBondContact O-N 3.46Å; Q105-N109 PolarHBondContact O-OD1 2.83Å; H106-N109 PolarHBondContact O-N 3.47Å; H106-N109 VanDerWaalsContact O-N 3.16Å; N109-N112 PolarHBondContact O-N 3.05Å; N109-A113 PolarHBondContact O-N 3.34Å
110E81.2Confident73.6Confident55 Ų5572.7 Ų72.726%0.25738%0.384SS..Hα-helixtrans-64.1-44.1176.9-71-81.3136.400111.9K41 H106 V107 R108 N112 A113 Y114 M153K41-E110 IonicContact NZ-OE1 4Å; K41-E110 IonicContact NZ-OE2 3.07Å; K41-E110 PolarHBondContact NZ-OE2 3.14Å; H106-E110 IonicContact CE1-OE1 3.11Å; H106-E110 VanDerWaalsContact O-CG 3.32Å; H106-E110 WeakPolarHBondContact O-CG 3.38Å; H106-E110 PolarHBondContact O-N 2.84Å; V107-E110 PolarHBondContact O-N 3.49Å; R108-E110 VanDerWaalsContact C-N 3.34Å; E110-N112 VanDerWaalsContact C-N 3.35Å; E110-N112 PolarHBondContact O-N 3.47Å; E110-A113 PolarHBondContact O-N 3.39Å; E110-Y114 PolarHBondContact O-N 2.98Å; E110-Y114 VanDerWaalsContact O-N 3.08Å; E110-M153 HydrophobicContact CB-CE 4.2Å; E110-M153 HydrophobicContact CB-SD 3.51Å; E110-M153 VanDerWaalsContact CB-SD 3.51Å; E110-M153 HydrophobicContact CG-SD 4.48Å
111K81.1Confident71.2Confident78 Ų7880 Ų8034%0.33941%0.41SS..Hα-helixtrans-59.9-43.2174.8-75.8-175.7178.1-173.50112.2V107 R108 Y114 S115 M153 E157V107-K111 HydrophobicContact CG1-CD 4.39Å; V107-K111 WeakPolarHBondContact O-CG 3.48Å; V107-K111 PolarHBondContact O-N 3.09Å; R108-K111 PolarHBondContact O-N 2.9Å; K111-Y114 PolarHBondContact O-N 3.23Å; K111-S115 PolarHBondContact O-N 3.04Å; K111-S115 PolarHBondContact O-OG 2.64Å; K111-M153 HydrophobicContact CB-CE 4.47Å; K111-M153 HydrophobicContact CG-CE 3.57Å; K111-M153 HydrophobicContact CG-SD 3.91Å; K111-E157 IonicContact NZ-OE1 3.41Å; K111-E157 PolarHBondContact NZ-OE1 2.93Å; K111-E157 IonicContact NZ-OE2 2.9Å; K111-E157 PolarHBondContact NZ-OE2 3.45Å
112N78.8Confident68.5Low102 Ų10287.9 Ų87.955%0.54543%0.429SS..Hα-helixtrans-66-37.7177.8-70.4-15.3000112.2R108 N109 E110 Y114 S115 V116R108-N112 VanDerWaalsContact O-CG 3.29Å; R108-N112 PolarHBondContact O-N 2.87Å; R108-N112 PolarHBondContact O-ND2 2.96Å; N109-N112 PolarHBondContact O-N 3.05Å; E110-N112 VanDerWaalsContact C-N 3.35Å; E110-N112 PolarHBondContact O-N 3.47Å; N112-Y114 VanDerWaalsContact C-N 3.3Å; N112-Y114 PolarHBondContact O-N 3.39Å; N112-S115 PolarHBondContact O-OG 3.48Å; N112-S115 VanDerWaalsContact O-OG 3.1Å; N112-V116 VanDerWaalsContact O-CG2 3.29Å; N112-V116 WeakPolarHBondContact O-CG2 3.39Å; N112-V116 PolarHBondContact O-N 3.38Å
113A74.3Confident66.1Low63 Ų6389.9 Ų89.952%0.52144%0.444SS..Hα-helixtrans-64.5-36.3175.300000112.1N109 E110 N117N109-A113 PolarHBondContact O-N 3.34Å; E110-A113 PolarHBondContact O-N 3.39Å; A113-N117 PolarHBondContact O-N 2.82Å
114Y64.7Low63.6Low115 Ų11595.5 Ų95.545%0.45148%0.483SS..Hα-helixtrans-70.8-44.1177.4-175.8-101.5000113E110 K111 N112 V116 N117 C118E110-Y114 PolarHBondContact O-N 2.98Å; E110-Y114 VanDerWaalsContact O-N 3.08Å; K111-Y114 PolarHBondContact O-N 3.23Å; N112-Y114 VanDerWaalsContact C-N 3.3Å; N112-Y114 PolarHBondContact O-N 3.39Å; Y114-V116 VanDerWaalsContact C-N 3.32Å; Y114-V116 PolarHBondContact O-N 3.06Å; Y114-N117 PolarHBondContact O-N 3.21Å; Y114-C118 VanDerWaalsContact CZ-SG 3.56Å; Y114-C118 PolarHBondContact O-N 2.84Å
115S58.6Low61Low61 Ų61100.8 Ų100.843%0.42751%0.513SS..Hα-helixtrans-64-35.6179.961.20000112.9K111 N112 Q119K111-S115 PolarHBondContact O-N 3.04Å; K111-S115 PolarHBondContact O-OG 2.64Å; N112-S115 PolarHBondContact O-OG 3.48Å; N112-S115 VanDerWaalsContact O-OG 3.1Å; S115-Q119 PolarHBondContact O-N 3.19Å
116V56.7Low58.4Low92 Ų92100 Ų10056%0.55853%0.528SS*.Hα-helixtrans-65.9-38.8174.9174.50000111.4N112 Y114 E120N112-V116 VanDerWaalsContact O-CG2 3.29Å; N112-V116 WeakPolarHBondContact O-CG2 3.39Å; N112-V116 PolarHBondContact O-N 3.38Å; Y114-V116 VanDerWaalsContact C-N 3.32Å; Y114-V116 PolarHBondContact O-N 3.06Å; V116-E120 PolarHBondContact O-N 3.39Å
117N51.5Low55.7Low103 Ų103107 Ų10755%0.55156%0.564SS**Hα-helixtrans-77.9-34.3-175.4-149.7-16.1000113A113 Y114 R121A113-N117 PolarHBondContact O-N 2.82Å; Y114-N117 PolarHBondContact O-N 3.21Å; N117-R121 PolarHBondContact O-N 3.22Å
118C45.1Very low53Low46 Ų46115.7 Ų115.731%0.31160%0.602SS.*Hα-helixtrans-68.1-34.1172.8-80.10000113.2Y114 R121 Y122Y114-C118 VanDerWaalsContact CZ-SG 3.56Å; Y114-C118 PolarHBondContact O-N 2.84Å; C118-R121 PolarHBondContact O-N 3.12Å; C118-Y122 WeakPolarHBondContact O-CD2 3.43Å
119Q36.9Very low50.3Low161 Ų161115.3 Ų115.375%0.75262%0.615SS**Hα-helixtrans-70.5-32.4-179.3-155.587.41.300112.1S115S115-Q119 PolarHBondContact O-N 3.19Å
120E38.2Very low47.8Very low163 Ų163118.4 Ų118.476%0.76263%0.63SS**Hα-helixtrans-75.3-21.4174.5-73.5-162.1171.300113.5V116V116-E120 PolarHBondContact O-N 3.39Å
121R37.5Very low45.6Very low162 Ų162122.9 Ų122.961%0.61166%0.655SS**Hα-helixtrans-86.4-8-176.4-162.1177.8-84.5-158.2-3.8114.5N117 C118 P123 E142N117-R121 PolarHBondContact O-N 3.22Å; C118-R121 PolarHBondContact O-N 3.12Å; R121-P123 VanDerWaalsContact C-CD 3.48Å; R121-P123 WeakPolarHBondContact O-CD 3.39Å; R121-E142 IonicContact CZ-OE1 3.39Å; R121-E142 IonicContact NH1-OE1 3.98Å; R121-E142 PolarHBondContact NH1-OE1 2.91Å; R121-E142 IonicContact NH2-OE1 2.69Å; R121-E142 PolarHBondContact NH2-OE1 2.69Å
122Y31.2Very low43.5Very low200 Ų200127 Ų12778%0.78468%0.675SS**SBendtrans-102.388.8167.4-68.5-78.7000110.3C118 S124C118-Y122 WeakPolarHBondContact O-CD2 3.43Å; Y122-S124 PolarHBondContact O-N 2.83Å
123P39.5Very low42Very low112 Ų112128.1 Ų128.173%0.72769%0.689SS**  trans-62.8128.9166.224.2-28.9000108.9R121 L125R121-P123 VanDerWaalsContact C-CD 3.48Å; R121-P123 WeakPolarHBondContact O-CD 3.39Å; P123-L125 PolarHBondContact O-N 3.48Å
124S36.9Very low40.4Very low119 Ų119130.2 Ų130.283%0.83270%0.699SS**  trans-39.9128.8173-176.20000110.9Y122 G126Y122-S124 PolarHBondContact O-N 2.83Å; S124-G126 PolarHBondContact O-N 3.25Å
125L34.3Very low39.6Very low186 Ų186130.7 Ų130.797%0.97471%0.705SS**  trans-43.994.1-176-133.880.5000112P123P123-L125 PolarHBondContact O-N 3.48Å
126G33.1Very low38.9Very low69 Ų69136.3 Ų136.371%0.71173%0.725SS**  trans-124.8113.8175.200000108.9S124 F128S124-G126 PolarHBondContact O-N 3.25Å; G126-F128 PolarHBondContact O-N 2.79Å
127I30Very low38.4Very low168 Ų168140 Ų14086%0.86273%0.734SS**  trans-54.1119.2-174.5-61.4163000112.1
128F30Very low38Very low191 Ų191141 Ų14184%0.83874%0.735SS**  trans-160.9133.1141.7-150.5-106.2000112.4G126G126-F128 PolarHBondContact O-N 2.79Å
129S31.1Very low38.3Very low92 Ų92143.4 Ų143.464%0.64375%0.748SS**  trans-86.7152.2175.4-51.90000111.8
130I32.8Very low39.2Very low149 Ų149138.6 Ų138.676%0.76473%0.732SS**  trans155.6136.3132-77.6160.7000110
131D34.8Very low40Very low148 Ų148136.2 Ų136.279%0.79172%0.724SS**  trans-50.6136.4-169.3-59.1-75.6000118.3
132Q37.4Very low40.9Very low164 Ų164131.6 Ų131.677%0.76671%0.71SS**  trans-139.9103.5150.1-104.1178.6-30.300110.3S134Q132-S134 PolarHBondContact O-N 3Å
133P47.1Very low42.6Very low127 Ų127124.8 Ų124.883%0.82569%0.691SS**THydrogen-bonded Turntrans-87.283.9176.632.4-29.3000110.5
134S41.8Very low43.9Very low106 Ų106126 Ų12674%0.74169%0.685SS**THydrogen-bonded Turntrans-162.616161.742.20000115.6Q132Q132-S134 PolarHBondContact O-N 3Å
135E47Very low45.5Very low125 Ų125123.1 Ų123.158%0.58467%0.668SS**  trans-105.1-5.3178.8-69.9-169.3130.200115.1K137 Q138 V139E135-K137 PolarHBondContact O-N 2.72Å; E135-K137 VanDerWaalsContact O-N 3.17Å; E135-Q138 PolarHBondContact O-N 3.11Å; E135-V139 WeakPolarHBondContact O-CG2 3.47Å; E135-V139 PolarHBondContact O-N 3.37Å; E135-V139 VanDerWaalsContact O-N 3.13Å
136Q44.5Very low47.3Very low179 Ų179116.7 Ų116.784%0.83664%0.635SS**Hα-helixtrans-67.6-22.4-175.3-161.7164-3.600113.9S140Q136-S140 WeakPolarHBondContact O-CB 3.35Å; Q136-S140 PolarHBondContact O-N 3.49Å
137K46.1Very low49.4Very low170 Ų170118.4 Ų118.474%0.73963%0.627SS**Hα-helixtrans-81.2-31.2176.2-155.7174.9-174.9-175.60112.7E135 L141E135-K137 PolarHBondContact O-N 2.72Å; E135-K137 VanDerWaalsContact O-N 3.17Å; K137-L141 PolarHBondContact O-N 2.97Å
138Q43.2Very low51.5Low123 Ų123114.7 Ų114.758%0.57561%0.606SS**Hα-helixtrans-77.8-43.3179.7-170.8165.9-11.700111.2E135 S140 L141 E142E135-Q138 PolarHBondContact O-N 3.11Å; Q138-S140 PolarHBondContact O-N 3.31Å; Q138-L141 PolarHBondContact O-N 3.45Å; Q138-E142 PolarHBondContact O-N 3.05Å
139V51.9Low53.6Low98 Ų98111.3 Ų111.359%0.59459%0.587SS**Hα-helixtrans-60.6-35.2173.6-179.40000111.6E135 S143E135-V139 WeakPolarHBondContact O-CG2 3.47Å; E135-V139 PolarHBondContact O-N 3.37Å; E135-V139 VanDerWaalsContact O-N 3.13Å; V139-S143 WeakPolarHBondContact O-CB 3.43Å; V139-S143 PolarHBondContact O-N 2.91Å
140S54.8Low55.8Low60 Ų60109.4 Ų109.442%0.4258%0.577SS.*Hα-helixtrans-70.6-37.7176.8-175.40000113.4Q136 Q138 K144Q136-S140 WeakPolarHBondContact O-CB 3.35Å; Q136-S140 PolarHBondContact O-N 3.49Å; Q138-S140 PolarHBondContact O-N 3.31Å; S140-K144 WeakPolarHBondContact O-CG 3.23Å; S140-K144 PolarHBondContact O-N 3.06Å; S140-K144 VanDerWaalsContact O-N 3.14Å
141L55.9Low58.1Low112 Ų112106.5 Ų106.559%0.58656%0.56SS**Hα-helixtrans-73-42.7177.1-79.5161.6000112K137 Q138 S143 K144 A145K137-L141 PolarHBondContact O-N 2.97Å; Q138-L141 PolarHBondContact O-N 3.45Å; L141-S143 VanDerWaalsContact C-N 3.34Å; L141-K144 PolarHBondContact O-N 2.83Å; L141-A145 PolarHBondContact O-N 3.43Å; L141-A145 VanDerWaalsContact O-N 3.09Å
142E55.9Low60.3Low66 Ų66100.8 Ų100.831%0.30853%0.529SS..Hα-helixtrans-59.1-46.8173.4-112.7164.688.100110.4R121 Q138 K144 A145 D146R121-E142 IonicContact CZ-OE1 3.39Å; R121-E142 IonicContact NH1-OE1 3.98Å; R121-E142 PolarHBondContact NH1-OE1 2.91Å; R121-E142 IonicContact NH2-OE1 2.69Å; R121-E142 PolarHBondContact NH2-OE1 2.69Å; Q138-E142 PolarHBondContact O-N 3.05Å; E142-K144 VanDerWaalsContact C-N 3.32Å; E142-K144 PolarHBondContact O-N 3.35Å; E142-A145 PolarHBondContact O-N 3.29Å; E142-D146 PolarHBondContact O-N 3.47Å
143S65.6Low62.4Low56 Ų5694.3 Ų94.339%0.39250%0.499SS..Hα-helixtrans-58.3-40.9176.4176.30000112.6V139 L141 D146 I147V139-S143 WeakPolarHBondContact O-CB 3.43Å; V139-S143 PolarHBondContact O-N 2.91Å; L141-S143 VanDerWaalsContact C-N 3.34Å; S143-D146 PolarHBondContact O-N 3.01Å; S143-I147 WeakPolarHBondContact O-CB 3.44Å; S143-I147 VanDerWaalsContact O-CD1 3.28Å; S143-I147 WeakPolarHBondContact O-CD1 3.45Å; S143-I147 WeakPolarHBondContact O-CG1 3.26Å; S143-I147 PolarHBondContact O-N 3.47Å
144K68.2Low64.3Low138 Ų13894.3 Ų94.360%0.649%0.488SS*.Hα-helixtrans-65.6-41.7177.3-75.9-179.2-178.4-166.10112.8S140 L141 E142 D146 I147 Q148S140-K144 WeakPolarHBondContact O-CG 3.23Å; S140-K144 PolarHBondContact O-N 3.06Å; S140-K144 VanDerWaalsContact O-N 3.14Å; L141-K144 PolarHBondContact O-N 2.83Å; E142-K144 VanDerWaalsContact C-N 3.32Å; E142-K144 PolarHBondContact O-N 3.35Å; K144-D146 VanDerWaalsContact C-N 3.35Å; K144-I147 PolarHBondContact O-N 3.17Å; K144-Q148 WeakPolarHBondContact O-CB 3.45Å; K144-Q148 PolarHBondContact O-N 2.96Å
145A70.7Confident66.4Low58 Ų5893.6 Ų93.648%0.47947%0.472SS..Hα-helixtrans-66.2-39.6178.900000111.6L141 E142 Q148 R149L141-A145 PolarHBondContact O-N 3.43Å; L141-A145 VanDerWaalsContact O-N 3.09Å; E142-A145 PolarHBondContact O-N 3.29Å; A145-Q148 PolarHBondContact O-N 3.46Å; A145-R149 WeakPolarHBondContact O-CB 3.22Å; A145-R149 PolarHBondContact O-N 3.3Å
146D71.5Confident68.3Low51 Ų5188 Ų8827%0.27345%0.447SS..Hα-helixtrans-67.8-41.2176.4-68.6-25.7000111.9E142 S143 K144 R149 A150E142-D146 PolarHBondContact O-N 3.47Å; S143-D146 PolarHBondContact O-N 3.01Å; K144-D146 VanDerWaalsContact C-N 3.35Å; D146-R149 PolarHBondContact O-N 3.19Å; D146-A150 WeakPolarHBondContact O-CB 3.31Å; D146-A150 PolarHBondContact O-N 2.87Å
147I76.3Confident70.3Confident106 Ų10683.2 Ų83.254%0.54442%0.424SS..Hα-helixtrans-62-45.9174.9-69.3162.3000110.8S143 K144 R149 A150 H151S143-I147 WeakPolarHBondContact O-CB 3.44Å; S143-I147 VanDerWaalsContact O-CD1 3.28Å; S143-I147 WeakPolarHBondContact O-CD1 3.45Å; S143-I147 WeakPolarHBondContact O-CG1 3.26Å; S143-I147 PolarHBondContact O-N 3.47Å; K144-I147 PolarHBondContact O-N 3.17Å; I147-R149 VanDerWaalsContact C-N 3.35Å; I147-R149 PolarHBondContact O-N 3.14Å; I147-A150 PolarHBondContact O-N 2.91Å; I147-H151 WeakPolarHBondContact O-CB 3.18Å; I147-H151 PolarHBondContact O-N 3.35Å
148Q75Confident72.3Confident90 Ų9078.6 Ų78.642%0.42141%0.414SS..Hα-helixtrans-60.8-45178.517960.727.400111.2K144 A145 A150 H151 E152K144-Q148 WeakPolarHBondContact O-CB 3.45Å; K144-Q148 PolarHBondContact O-N 2.96Å; A145-Q148 PolarHBondContact O-N 3.46Å; Q148-A150 VanDerWaalsContact C-N 3.35Å; Q148-A150 PolarHBondContact O-N 3.45Å; Q148-H151 PolarHBondContact O-N 3.43Å; Q148-E152 WeakPolarHBondContact CG-OE1 3.39Å; Q148-E152 PolarHBondContact NE2-OE1 3.02Å; Q148-E152 WeakPolarHBondContact O-CG 3.04Å; Q148-E152 PolarHBondContact O-N 2.96Å
149R73.1Confident74.4Confident120 Ų12073.3 Ų73.345%0.45339%0.389SS..Hα-helixtrans-62.5-41.1176.3-175.9-177.1-64.3170.62.9112.2A145 D146 I147 H151 M153A145-R149 WeakPolarHBondContact O-CB 3.22Å; A145-R149 PolarHBondContact O-N 3.3Å; D146-R149 PolarHBondContact O-N 3.19Å; I147-R149 VanDerWaalsContact C-N 3.35Å; I147-R149 PolarHBondContact O-N 3.14Å; R149-H151 VanDerWaalsContact C-N 3.33Å; R149-M153 WeakPolarHBondContact O-CB 3.45Å; R149-M153 PolarHBondContact O-N 3.21Å
150A77.1Confident76Confident51 Ų5169 Ų6942%0.42136%0.363SS..Hα-helixtrans-63-42.417700000111.3D146 I147 Q148 M153 E154D146-A150 WeakPolarHBondContact O-CB 3.31Å; D146-A150 PolarHBondContact O-N 2.87Å; I147-A150 PolarHBondContact O-N 2.91Å; Q148-A150 VanDerWaalsContact C-N 3.35Å; Q148-A150 PolarHBondContact O-N 3.45Å; A150-M153 PolarHBondContact O-N 2.78Å; A150-E154 WeakPolarHBondContact O-CB 3.3Å; A150-E154 PolarHBondContact O-N 3.35Å
151H81.5Confident77.5Confident88 Ų8870.5 Ų70.541%0.40737%0.369SS..Hα-helixtrans-65.5-44.8177.4-177.9-96.8000112.5I147 Q148 R149 M153 E154 Q155I147-H151 WeakPolarHBondContact O-CB 3.18Å; I147-H151 PolarHBondContact O-N 3.35Å; Q148-H151 PolarHBondContact O-N 3.43Å; R149-H151 VanDerWaalsContact C-N 3.33Å; H151-M153 VanDerWaalsContact C-N 3.27Å; H151-M153 PolarHBondContact O-N 3.1Å; H151-E154 PolarHBondContact O-N 3.25Å; H151-Q155 PolarHBondContact CE1-NE2 3.15Å; H151-Q155 WeakPolarHBondContact O-CG 3.5Å; H151-Q155 PolarHBondContact O-N 2.85Å
152E81.9Confident78.9Confident29 Ų2968.3 Ų68.314%0.13636%0.356CS..Hα-helixtrans-58.8-40.9173.3-74.4166.1-16300111.5K41 N45 Q148 Q155 L156K41-E152 WeakPolarHBondContact CB-OE2 3.49Å; N45-E152 WeakPolarHBondContact ND2-CA 3.11Å; N45-E152 PolarHBondContact ND2-O 3.38Å; Q148-E152 WeakPolarHBondContact CG-OE1 3.39Å; Q148-E152 PolarHBondContact NE2-OE1 3.02Å; Q148-E152 WeakPolarHBondContact O-CG 3.04Å; Q148-E152 PolarHBondContact O-N 2.96Å; E152-Q155 PolarHBondContact O-N 2.71Å; E152-L156 WeakPolarHBondContact O-CB 3.24Å; E152-L156 PolarHBondContact O-N 3.12Å
153M82.2Confident80.2Confident28 Ų2865.3 Ų65.314%0.13834%0.342CS..Hα-helixtrans-70.1-34.3179.2-170.2148.260.500112.7V107 E110 K111 R149 A150 H151 E157V107-M153 HydrophobicContact CG1-CG 3.82Å; V107-M153 HydrophobicContact CG1-SD 4.1Å; V107-M153 HydrophobicContact CG2-CG 4.46Å; E110-M153 HydrophobicContact CB-CE 4.2Å; E110-M153 HydrophobicContact CB-SD 3.51Å; E110-M153 VanDerWaalsContact CB-SD 3.51Å; E110-M153 HydrophobicContact CG-SD 4.48Å; K111-M153 HydrophobicContact CB-CE 4.47Å; K111-M153 HydrophobicContact CG-CE 3.57Å; K111-M153 HydrophobicContact CG-SD 3.91Å; R149-M153 WeakPolarHBondContact O-CB 3.45Å; R149-M153 PolarHBondContact O-N 3.21Å; A150-M153 PolarHBondContact O-N 2.78Å; H151-M153 VanDerWaalsContact C-N 3.27Å; H151-M153 PolarHBondContact O-N 3.1Å; M153-E157 WeakPolarHBondContact O-CB 3.1Å; M153-E157 PolarHBondContact O-N 3.12Å
154E85.4Confident80.9Confident127 Ų12765.8 Ų65.859%0.59334%0.34SS*.Hα-helixtrans-66.4-42.8174.5-175177.6-17200111.7A150 H151 E157 S158A150-E154 WeakPolarHBondContact O-CB 3.3Å; A150-E154 PolarHBondContact O-N 3.35Å; H151-E154 PolarHBondContact O-N 3.25Å; E154-E157 PolarHBondContact O-N 3.37Å; E154-S158 PolarHBondContact O-N 3.29Å
155Q85.8Confident81.6Confident90 Ų9065.4 Ų65.442%0.42134%0.34SS..Hα-helixtrans-61.6-46.2174.5-71.9-176.3-22.800111.6H151 E152 E157 S158 D159H151-Q155 PolarHBondContact CE1-NE2 3.15Å; H151-Q155 WeakPolarHBondContact O-CG 3.5Å; H151-Q155 PolarHBondContact O-N 2.85Å; E152-Q155 PolarHBondContact O-N 2.71Å; Q155-E157 VanDerWaalsContact C-N 3.28Å; Q155-E157 PolarHBondContact O-N 2.78Å; Q155-S158 WeakPolarHBondContact O-CB 3.07Å; Q155-S158 PolarHBondContact O-N 3.32Å; Q155-D159 PolarHBondContact O-N 3.04Å
156L86.8Confident82.2Confident8 Ų863.7 Ų63.74%0.04232%0.323CS..Hα-helixtrans-61-38.5177.2-168.850.7000112.1L44 N45 Y48 V103 V107 E152 D159 I160L44-L156 HydrophobicContact CD2-CD2 4.14Å; N45-L156 VanDerWaalsContact OD1-CB 3.3Å; N45-L156 WeakPolarHBondContact OD1-CB 3.47Å; N45-L156 WeakPolarHBondContact OD1-CD1 3.21Å; Y48-L156 HydrophobicContact CD1-CD1 3.68Å; Y48-L156 HydrophobicContact CE1-CD1 4.32Å; Y48-L156 HydrophobicContact CG-CD1 4.31Å; V103-L156 HydrophobicContact CG1-CD1 3.54Å; V103-L156 HydrophobicContact CG1-CD2 3.78Å; V103-L156 HydrophobicContact CG1-CG 3.64Å; V107-L156 HydrophobicContact CG2-CB 4.39Å; V107-L156 HydrophobicContact CG2-CD2 3.65Å; V107-L156 HydrophobicContact CG2-CG 3.91Å; E152-L156 WeakPolarHBondContact O-CB 3.24Å; E152-L156 PolarHBondContact O-N 3.12Å; L156-D159 PolarHBondContact O-N 2.83Å; L156-I160 WeakPolarHBondContact O-CD1 3.4Å; L156-I160 VanDerWaalsContact O-CG1 3.26Å; L156-I160 WeakPolarHBondContact O-CG1 3.25Å; L156-I160 PolarHBondContact O-N 3.36Å
157E87.4Confident82.5Confident78 Ų7862.2 Ų62.236%0.36431%0.314SS..Hα-helixtrans-65.4-43.2175.5179.8169.2-140.600112.1K111 M153 E154 Q155 D159 I160 V161K111-E157 IonicContact NZ-OE1 3.41Å; K111-E157 PolarHBondContact NZ-OE1 2.93Å; K111-E157 IonicContact NZ-OE2 2.9Å; K111-E157 PolarHBondContact NZ-OE2 3.45Å; M153-E157 WeakPolarHBondContact O-CB 3.1Å; M153-E157 PolarHBondContact O-N 3.12Å; E154-E157 PolarHBondContact O-N 3.37Å; Q155-E157 VanDerWaalsContact C-N 3.28Å; Q155-E157 PolarHBondContact O-N 2.78Å; E157-D159 VanDerWaalsContact C-N 3.32Å; E157-D159 PolarHBondContact O-N 3.31Å; E157-I160 WeakPolarHBondContact O-CB 3.11Å; E157-I160 PolarHBondContact O-N 3.01Å; E157-V161 WeakPolarHBondContact O-CG2 3.37Å; E157-V161 PolarHBondContact O-N 3.33Å
158S87.5Confident82.5Confident74 Ų7461.7 Ų61.752%0.51732%0.316SS..Hα-helixtrans-58.4-45.9174.6-168.10000111.5E154 Q155 I160 V161 Q162E154-S158 PolarHBondContact O-N 3.29Å; Q155-S158 WeakPolarHBondContact O-CB 3.07Å; Q155-S158 PolarHBondContact O-N 3.32Å; S158-I160 VanDerWaalsContact C-N 3.34Å; S158-I160 PolarHBondContact O-N 3.45Å; S158-V161 PolarHBondContact O-N 3.32Å; S158-Q162 PolarHBondContact O-N 3.28Å
159D87.6Confident82.4Confident12 Ų1260.1 Ų60.16%0.06431%0.313CS..Hα-helixtrans-63.1-37.6176.3-81.1-15.9000111.9Y48 H49 I52 Q155 L156 E157 V161 Q162 V163Y48-D159 HydrophobicContact CD1-CB 3.42Å; Y48-D159 VanDerWaalsContact CD1-CB 3.42Å; Y48-D159 HydrophobicContact CE1-CB 3.77Å; Y48-D159 HydrophobicContact CG-CB 4.48Å; H49-D159 IonicContact CG-OD1 2.72Å; H49-D159 PolarHBondContact N-OD2 3.45Å; H49-D159 IonicContact ND1-OD1 3.36Å; H49-D159 PolarHBondContact ND1-OD1 2.6Å; H49-D159 VanDerWaalsContact ND1-OD1 3.11Å; H49-D159 IonicContact ND1-OD2 2.64Å; I52-D159 HydrophobicContact CD1-CB 3.38Å; I52-D159 VanDerWaalsContact CD1-O 3.26Å; I52-D159 WeakPolarHBondContact CD1-O 3.19Å; Q155-D159 PolarHBondContact O-N 3.04Å; L156-D159 PolarHBondContact O-N 2.83Å; E157-D159 VanDerWaalsContact C-N 3.32Å; E157-D159 PolarHBondContact O-N 3.31Å; D159-V161 VanDerWaalsContact C-N 3.34Å; D159-V161 PolarHBondContact O-N 2.88Å; D159-Q162 PolarHBondContact O-N 2.91Å; D159-V163 WeakPolarHBondContact O-CG2 3.32Å; D159-V163 PolarHBondContact O-N 2.78Å
160I85.1Confident82.5Confident8 Ų854.5 Ų54.54%0.04129%0.292CS..Hα-helixtrans-61.1-43.5174.2-71158.5000111Y48 V103 Q104 V107 L156 E157 S158 Q162 V163 N164Y48-I160 HydrophobicContact CE1-CG1 3.87Å; V103-I160 HydrophobicContact CB-CD1 4.44Å; V103-I160 HydrophobicContact CB-CG1 4.44Å; V103-I160 HydrophobicContact CG1-CD1 3.77Å; V103-I160 HydrophobicContact CG1-CG1 3.93Å; Q104-I160 HydrophobicContact CB-CD1 4.2Å; Q104-I160 HydrophobicContact CB-CG2 4.33Å; Q104-I160 HydrophobicContact CG-CD1 4.43Å; Q104-I160 HydrophobicContact CG-CG2 4.21Å; V107-I160 HydrophobicContact CB-CD1 4.44Å; V107-I160 HydrophobicContact CG2-CD1 3.92Å; L156-I160 WeakPolarHBondContact O-CD1 3.4Å; L156-I160 VanDerWaalsContact O-CG1 3.26Å; L156-I160 WeakPolarHBondContact O-CG1 3.25Å; L156-I160 PolarHBondContact O-N 3.36Å; E157-I160 WeakPolarHBondContact O-CB 3.11Å; E157-I160 PolarHBondContact O-N 3.01Å; S158-I160 VanDerWaalsContact C-N 3.34Å; S158-I160 PolarHBondContact O-N 3.45Å; I160-Q162 VanDerWaalsContact C-N 3.33Å; I160-V163 PolarHBondContact O-N 3.12Å; I160-N164 PolarHBondContact O-N 3.37Å; I160-N164 VanDerWaalsContact O-N 3.14Å; I160-N164 PolarHBondContact O-ND2 3.4Å
161V86.9Confident82Confident91 Ų9154.6 Ų54.655%0.55229%0.292SS*.Hα-helixtrans-63.2-43.8178.4174.40000110.1E157 S158 D159 V163 N164 E165E157-V161 WeakPolarHBondContact O-CG2 3.37Å; E157-V161 PolarHBondContact O-N 3.33Å; S158-V161 PolarHBondContact O-N 3.32Å; D159-V161 VanDerWaalsContact C-N 3.34Å; D159-V161 PolarHBondContact O-N 2.88Å; V161-V163 PolarHBondContact O-N 3.17Å; V161-N164 PolarHBondContact O-N 2.84Å; V161-E165 PolarHBondContact O-N 3.01Å
162Q85.3Confident81.4Confident65 Ų6553.9 Ų53.930%0.30429%0.294SS..Hα-helixtrans-63.2-40.2178.8-167167116.900112.5I52 S158 D159 I160 N164 E165 L166I52-Q162 HydrophobicContact CD1-CB 4.46Å; I52-Q162 HydrophobicContact CG2-CB 4.35Å; I52-Q162 HydrophobicContact CG2-CG 3.72Å; S158-Q162 PolarHBondContact O-N 3.28Å; D159-Q162 PolarHBondContact O-N 2.91Å; I160-Q162 VanDerWaalsContact C-N 3.33Å; Q162-N164 VanDerWaalsContact C-N 3.34Å; Q162-N164 PolarHBondContact O-N 2.91Å; Q162-E165 PolarHBondContact O-N 3.4Å; Q162-L166 WeakPolarHBondContact O-CG 3.4Å; Q162-L166 PolarHBondContact O-N 2.94Å
163V83.2Confident80.6Confident3 Ų356.2 Ų56.22%0.01830%0.302CS..Hα-helixtrans-60.5-42.9173.5168.20000111.8Y48 I52 L96 D159 I160 V161 L166 F167Y48-V163 HydrophobicContact CE1-CG2 4.18Å; Y48-V163 HydrophobicContact CE2-CG2 4.06Å; Y48-V163 WeakPolarHBondContact OH-CG2 3.43Å; I52-V163 HydrophobicContact CD1-CG2 3.71Å; I52-V163 HydrophobicContact CG1-CG2 3.3Å; L96-V163 HydrophobicContact CG-CG1 4.3Å; D159-V163 WeakPolarHBondContact O-CG2 3.32Å; D159-V163 PolarHBondContact O-N 2.78Å; I160-V163 PolarHBondContact O-N 3.12Å; V161-V163 PolarHBondContact O-N 3.17Å; V163-L166 PolarHBondContact O-N 3.11Å; V163-F167 HydrophobicContact CG1-CD2 3.51Å; V163-F167 HydrophobicContact CG1-CE2 3.14Å; V163-F167 HydrophobicContact CG1-CZ 4.18Å; V163-F167 WeakPolarHBondContact O-CD2 3.34Å; V163-F167 PolarHBondContact O-N 2.94Å
164N79.5Confident79.6Confident67 Ų6757.1 Ų57.136%0.35831%0.308SS..Hα-helixtrans-66.1-37.5179-76.9-41000112.7I160 V161 Q162 F167 T168I160-N164 PolarHBondContact O-N 3.37Å; I160-N164 VanDerWaalsContact O-N 3.14Å; I160-N164 PolarHBondContact O-ND2 3.4Å; V161-N164 PolarHBondContact O-N 2.84Å; Q162-N164 VanDerWaalsContact C-N 3.34Å; Q162-N164 PolarHBondContact O-N 2.91Å; N164-F167 PolarHBondContact O-N 2.95Å; N164-T168 PolarHBondContact O-N 3.48Å; N164-T168 PolarHBondContact O-OG1 3.32Å
165E84.6Confident78.2Confident129 Ų12958.4 Ų58.460%0.60331%0.313SS*.Hα-helixtrans-62.5-49.5172.7-172179.6-176.600110.7V161 Q162 F167 T168 T169V161-E165 PolarHBondContact O-N 3.01Å; Q162-E165 PolarHBondContact O-N 3.4Å; E165-F167 VanDerWaalsContact C-N 3.28Å; E165-F167 PolarHBondContact O-N 2.99Å; E165-T168 WeakPolarHBondContact O-CB 3.41Å; E165-T168 PolarHBondContact O-N 3.29Å; E165-T169 PolarHBondContact O-N 3.39Å; E165-T169 PolarHBondContact O-OG1 2.8Å
166L82.6Confident76.7Confident22 Ų2259.1 Ų59.112%0.11532%0.32CS..Hα-helixtrans-56.2-41.6175.3-72.8179.6000112I52 T55 K56 Q162 V163 T168 T169 L170I52-L166 HydrophobicContact CG2-CD1 3.77Å; T55-L166 HydrophobicContact CG2-CD1 4.01Å; K56-L166 HydrophobicContact CB-CD1 4.26Å; K56-L166 HydrophobicContact CB-CD2 4.1Å; K56-L166 HydrophobicContact CG-CD2 4.32Å; Q162-L166 WeakPolarHBondContact O-CG 3.4Å; Q162-L166 PolarHBondContact O-N 2.94Å; V163-L166 PolarHBondContact O-N 3.11Å; L166-T168 VanDerWaalsContact C-N 3.32Å; L166-T168 PolarHBondContact O-N 3.37Å; L166-T169 PolarHBondContact O-N 3.45Å; L166-L170 VanDerWaalsContact O-CB 3.26Å; L166-L170 WeakPolarHBondContact O-CB 3.41Å; L166-L170 WeakPolarHBondContact O-CD1 3.34Å; L166-L170 WeakPolarHBondContact O-CG 3.46Å; L166-L170 PolarHBondContact O-N 3.21Å
167F78Confident74.9Confident20 Ų2061.4 Ų61.49%0.08833%0.33CS..Hα-helixtrans-64.9-35.4175.7-80.6-54.5000113.4L93 L96 R97 V163 N164 E165 L170 A171L93-F167 HydrophobicContact CB-CE1 3.87Å; L93-F167 HydrophobicContact CD2-CE1 4.1Å; L93-F167 WeakPolarHBondContact O-CE1 3.18Å; L93-F167 WeakPolarHBondContact O-CZ 3.26Å; L96-F167 HydrophobicContact CB-CZ 3.87Å; L96-F167 HydrophobicContact CD2-CZ 4.12Å; L96-F167 HydrophobicContact CG-CE2 4.13Å; L96-F167 HydrophobicContact CG-CZ 3.72Å; R97-F167 VanDerWaalsContact CA-CE2 3.41Å; R97-F167 VanDerWaalsContact CA-CZ 3.5Å; R97-F167 HydrophobicContact CB-CD1 4.49Å; R97-F167 HydrophobicContact CB-CD2 4.21Å; R97-F167 HydrophobicContact CB-CE1 3.97Å; R97-F167 HydrophobicContact CB-CE2 3.59Å; R97-F167 HydrophobicContact CB-CZ 3.51Å; R97-F167 HydrophobicContact CG-CD2 4.29Å; R97-F167 HydrophobicContact CG-CE2 4.11Å; R97-F167 HydrophobicContact CG-CZ 4.43Å; V163-F167 HydrophobicContact CG1-CD2 3.51Å; V163-F167 HydrophobicContact CG1-CE2 3.14Å; V163-F167 HydrophobicContact CG1-CZ 4.18Å; V163-F167 WeakPolarHBondContact O-CD2 3.34Å; V163-F167 PolarHBondContact O-N 2.94Å; N164-F167 PolarHBondContact O-N 2.95Å; E165-F167 VanDerWaalsContact C-N 3.28Å; E165-F167 PolarHBondContact O-N 2.99Å; F167-L170 PolarHBondContact O-N 3.41Å; F167-A171 WeakPolarHBondContact O-CB 3.4Å; F167-A171 PolarHBondContact O-N 2.8Å
168T76Confident73.1Confident96 Ų9660.1 Ų60.159%0.58934%0.338SS*.Hα-helixtrans-67.6-43.9177.3-55.50000110N164 E165 L166 A171N164-T168 PolarHBondContact O-N 3.48Å; N164-T168 PolarHBondContact O-OG1 3.32Å; E165-T168 WeakPolarHBondContact O-CB 3.41Å; E165-T168 PolarHBondContact O-N 3.29Å; L166-T168 VanDerWaalsContact C-N 3.32Å; L166-T168 PolarHBondContact O-N 3.37Å; T168-A171 PolarHBondContact O-N 3.28Å
169T73.2Confident71.1Confident57 Ų5763 Ų6335%0.3535%0.352SS..Hα-helixtrans-64.7-38.4174.1-520000112.3E165 L166 T172 Y173E165-T169 PolarHBondContact O-N 3.39Å; E165-T169 PolarHBondContact O-OG1 2.8Å; L166-T169 PolarHBondContact O-N 3.45Å; T169-T172 PolarHBondContact O-OG1 3.18Å; T169-Y173 HydrophobicContact CG2-CE2 3.8Å; T169-Y173 WeakPolarHBondContact O-CD2 3.39Å; T169-Y173 WeakPolarHBondContact O-CE2 3.21Å
170L74.8Confident68.9Low2 Ų268.2 Ų68.21%0.0138%0.38CS..Hα-helixtrans-75.8-32.3178.7-73.1164.3000112.4T55 S59 L62 L93 L166 F167 T172 Y173 I174T55-L170 HydrophobicContact CG2-CD1 3.99Å; S59-L170 WeakPolarHBondContact OG-CD2 3.42Å; L62-L170 HydrophobicContact CD1-CD2 3.77Å; L93-L170 HydrophobicContact CD1-CB 4.31Å; L93-L170 HydrophobicContact CD1-CD1 3.74Å; L93-L170 HydrophobicContact CD1-CD2 4.18Å; L93-L170 HydrophobicContact CD1-CG 4.32Å; L93-L170 HydrophobicContact CD2-CD1 3.52Å; L93-L170 HydrophobicContact CG-CD1 4.26Å; L166-L170 VanDerWaalsContact O-CB 3.26Å; L166-L170 WeakPolarHBondContact O-CB 3.41Å; L166-L170 WeakPolarHBondContact O-CD1 3.34Å; L166-L170 WeakPolarHBondContact O-CG 3.46Å; L166-L170 PolarHBondContact O-N 3.21Å; F167-L170 PolarHBondContact O-N 3.41Å; L170-T172 VanDerWaalsContact C-N 3.26Å; L170-T172 PolarHBondContact O-N 2.95Å; L170-Y173 HydrophobicContact CD2-CD2 4.38Å; L170-Y173 WeakPolarHBondContact O-CB 3.41Å; L170-Y173 PolarHBondContact O-N 3.41Å; L170-Y173 VanDerWaalsContact O-N 3.12Å; L170-I174 HydrophobicContact CB-CD1 4.33Å; L170-I174 WeakPolarHBondContact O-CB 3.29Å; L170-I174 WeakPolarHBondContact O-CD1 3.4Å; L170-I174 WeakPolarHBondContact O-CG1 3.46Å; L170-I174 PolarHBondContact O-N 2.9Å
171A67.7Low66.7Low52 Ų5273.7 Ų73.743%0.4341%0.413SS..Hα-helixtrans-62.3-35.2178.700000111.8F167 T168 I174 H175F167-A171 WeakPolarHBondContact O-CB 3.4Å; F167-A171 PolarHBondContact O-N 2.8Å; T168-A171 PolarHBondContact O-N 3.28Å; A171-I174 PolarHBondContact O-N 3.32Å; A171-H175 WeakPolarHBondContact O-CB 3.46Å; A171-H175 PolarHBondContact O-N 3.32Å
172T68.2Low64.7Low73 Ų7374 Ų7445%0.44841%0.412SS..Hα-helixtrans-64.6-43.3173.860.70000110.6T169 L170 I174 D176T169-T172 PolarHBondContact O-OG1 3.18Å; L170-T172 VanDerWaalsContact C-N 3.26Å; L170-T172 PolarHBondContact O-N 2.95Å; T172-I174 VanDerWaalsContact C-N 3.34Å; T172-I174 PolarHBondContact O-N 2.95Å; T172-D176 WeakPolarHBondContact O-CB 3.14Å; T172-D176 VanDerWaalsContact O-CG 3.26Å; T172-D176 PolarHBondContact O-N 2.89Å
173Y65.2Low63.2Low78 Ų7875.1 Ų75.131%0.30643%0.427SS..Hα-helixtrans-66-34.1176.8-63.2-45.3000113.7Q66 T169 L170 Q177Q66-Y173 VanDerWaalsContact NE2-C 3.27Å; Q66-Y173 VanDerWaalsContact NE2-CB 3.31Å; Q66-Y173 PolarHBondContact NE2-O 3.47Å; T169-Y173 HydrophobicContact CG2-CE2 3.8Å; T169-Y173 WeakPolarHBondContact O-CD2 3.39Å; T169-Y173 WeakPolarHBondContact O-CE2 3.21Å; L170-Y173 HydrophobicContact CD2-CD2 4.38Å; L170-Y173 WeakPolarHBondContact O-CB 3.41Å; L170-Y173 PolarHBondContact O-N 3.41Å; L170-Y173 VanDerWaalsContact O-N 3.12Å; Y173-Q177 PolarHBondContact O-NE2 3.44Å
174I61.4Low61.6Low48 Ų4881.5 Ų81.525%0.24646%0.46CS..Hα-helixtrans-78.4-41.4179.9-65.5164.7000110.8I90 L93 L170 A171 T172 Q177I90-I174 HydrophobicContact CD1-CB 4.43Å; I90-I174 HydrophobicContact CD1-CG1 4.14Å; I90-I174 HydrophobicContact CD1-CG2 3.65Å; I90-I174 HydrophobicContact CG1-CB 4.39Å; I90-I174 HydrophobicContact CG1-CD1 3.75Å; I90-I174 HydrophobicContact CG1-CG1 3.67Å; I90-I174 HydrophobicContact CG1-CG2 3.85Å; I90-I174 HydrophobicContact CG2-CG2 4.44Å; L93-I174 HydrophobicContact CD1-CD1 3.94Å; L170-I174 HydrophobicContact CB-CD1 4.33Å; L170-I174 WeakPolarHBondContact O-CB 3.29Å; L170-I174 WeakPolarHBondContact O-CD1 3.4Å; L170-I174 WeakPolarHBondContact O-CG1 3.46Å; L170-I174 PolarHBondContact O-N 2.9Å; A171-I174 PolarHBondContact O-N 3.32Å; T172-I174 VanDerWaalsContact C-N 3.34Å; T172-I174 PolarHBondContact O-N 2.95Å; I174-Q177 PolarHBondContact O-N 3.32Å
175H55.7Low60.3Low154 Ų15479.5 Ų79.571%0.71346%0.455SS*.Hα-helixtrans-66.8-37-178.4-171.768.9000112.7A171 Q177 G178A171-H175 WeakPolarHBondContact O-CB 3.46Å; A171-H175 PolarHBondContact O-N 3.32Å; H175-Q177 PolarHBondContact O-N 3.03Å; H175-G178 PolarHBondContact O-N 2.89Å; H175-G178 VanDerWaalsContact O-N 3.08Å
176D53.3Low58.8Low104 Ų10476.9 Ų76.956%0.55645%0.445SS*.THydrogen-bonded Turntrans-65.1-3.8179.3-74.8-6.5000114.2T172T172-D176 WeakPolarHBondContact O-CB 3.14Å; T172-D176 VanDerWaalsContact O-CG 3.26Å; T172-D176 PolarHBondContact O-N 2.89Å
177Q50.5Low57.8Low57 Ų5781.8 Ų81.827%0.26647%0.471SS..THydrogen-bonded Turntrans-100.410.7176.5-63.6177.378.100113.3N86 Y173 I174 H175 T179N86-Q177 VanDerWaalsContact CG-NE2 3.34Å; N86-Q177 VanDerWaalsContact CG-OE1 3.32Å; N86-Q177 PolarHBondContact ND2-NE2 2.79Å; N86-Q177 PolarHBondContact ND2-OE1 2.87Å; N86-Q177 PolarHBondContact OD1-NE2 3.32Å; Y173-Q177 PolarHBondContact O-NE2 3.44Å; I174-Q177 PolarHBondContact O-N 3.32Å; H175-Q177 PolarHBondContact O-N 3.03Å; Q177-T179 PolarHBondContact O-N 3.5Å
178G48.2Very low56.8Low50 Ų5086.3 Ų86.352%0.51550%0.495SS..  trans-53.2120.916800000111.1H175H175-G178 PolarHBondContact O-N 2.89Å; H175-G178 VanDerWaalsContact O-N 3.08Å
179T45.1Very low55.6Low135 Ų13583.1 Ų83.183%0.82847%0.474SS*.  trans63.782.116264.30000116.3Q177Q177-T179 PolarHBondContact O-N 3.5Å
180L43Very low55Low121 Ų12183.5 Ų83.563%0.63448%0.475SS*.  trans-129.483.8148.7-152.9132.5000110.8R83R83-L180 PolarHBondContact NH2-O 3.36Å
181V39.3Very low54.5Low124 Ų12485.7 Ų85.775%0.75249%0.494SS*.  trans-31.7125.3163.2177.20000112.5
182D44.6Very low54.3Low96 Ų9688 Ų8851%0.51349%0.492SS..  -165.2117.2125.5-158.85.9000111.3I184 G185D182-I184 PolarHBondContact O-N 2.84Å; D182-G185 PolarHBondContact O-N 3.37Å; D182-G185 VanDerWaalsContact O-N 3.1Å
183S52.3Low54Low89 Ų8987.6 Ų87.662%0.62249%0.485SS*.THydrogen-bonded Turntrans-67.87.7-161.9-49.40000116.8
184I51Low54.1Low138 Ų13890.2 Ų90.271%0.70850%0.5SS*.THydrogen-bonded Turntrans-98.2-27173.7-62174.1000110.7D182D182-I184 PolarHBondContact O-N 2.84Å
185G51.1Low54.7Low25 Ų2592.4 Ų92.426%0.25852%0.516SS..Hα-helixtrans-75-39.7176.700000113D182 N187 I188 E189D182-G185 PolarHBondContact O-N 3.37Å; D182-G185 VanDerWaalsContact O-N 3.1Å; G185-N187 VanDerWaalsContact C-N 3.3Å; G185-N187 PolarHBondContact O-N 2.82Å; G185-I188 PolarHBondContact O-N 2.88Å; G185-I188 VanDerWaalsContact O-N 3.14Å; G185-E189 WeakPolarHBondContact O-CB 3.42Å; G185-E189 PolarHBondContact O-N 2.83Å
186D54.2Low55.3Low74 Ų7486.2 Ų86.240%0.39649%0.487SS..Hα-helixtrans-59.8-36-175.2-73.24.4000112.8I188 E189 V190D186-I188 PolarHBondContact O-N 3.47Å; D186-E189 PolarHBondContact O-N 2.74Å; D186-V190 WeakPolarHBondContact O-CB 3.29Å; D186-V190 WeakPolarHBondContact O-CG2 3.22Å; D186-V190 PolarHBondContact O-N 3.04Å
187N60.1Low56Low125 Ų12583.4 Ų83.467%0.66848%0.476SS*.Hα-helixtrans-71-33.9-179.7-72.116.7000112.4G185 A191G185-N187 VanDerWaalsContact C-N 3.3Å; G185-N187 PolarHBondContact O-N 2.82Å; N187-A191 WeakPolarHBondContact O-CB 3.44Å; N187-A191 PolarHBondContact O-N 3.01Å
188I57.1Low57.2Low115 Ų11582.2 Ų82.259%0.5948%0.479SS*.Hα-helixtrans-77.7-38.5174.7-63.1173.9000109.8G185 D186 A191 Y192G185-I188 PolarHBondContact O-N 2.88Å; G185-I188 VanDerWaalsContact O-N 3.14Å; D186-I188 PolarHBondContact O-N 3.47Å; I188-A191 PolarHBondContact O-N 3.43Å; I188-Y192 VanDerWaalsContact O-CB 3.23Å; I188-Y192 WeakPolarHBondContact O-CB 3.46Å; I188-Y192 PolarHBondContact O-N 3.13Å
189E52.1Low58.6Low29 Ų2983.6 Ų83.614%0.13648%0.477CS..Hα-helixtrans-61-47.6175.9-175.5167.9172.600111.2R83 G185 D186 E193R83-E189 WeakPolarHBondContact CB-OE1 3.29Å; R83-E189 WeakPolarHBondContact CD-OE2 3.2Å; G185-E189 WeakPolarHBondContact O-CB 3.42Å; G185-E189 PolarHBondContact O-N 2.83Å; D186-E189 PolarHBondContact O-N 2.74Å; E189-E193 VanDerWaalsContact O-CB 3.29Å; E189-E193 WeakPolarHBondContact O-CB 3.46Å; E189-E193 PolarHBondContact O-N 3.39Å
190V59.5Low59.8Low64 Ų6479.6 Ų79.639%0.38845%0.449SS..Hα-helixtrans-67.5-41174.8171.90000111.2D186 E193 Q194D186-V190 WeakPolarHBondContact O-CB 3.29Å; D186-V190 WeakPolarHBondContact O-CG2 3.22Å; D186-V190 PolarHBondContact O-N 3.04Å; V190-E193 PolarHBondContact O-N 3.34Å; V190-Q194 HydrophobicContact CG1-CG 4.29Å; V190-Q194 VanDerWaalsContact O-CB 3.29Å; V190-Q194 WeakPolarHBondContact O-CB 3.4Å; V190-Q194 WeakPolarHBondContact O-CG 3.32Å; V190-Q194 PolarHBondContact O-N 2.97Å
191A64.8Low61.3Low48 Ų4879.9 Ų79.940%0.39745%0.447SS..Hα-helixtrans-65.4-42.8177.500000111.8N187 I188 Q194 V195N187-A191 WeakPolarHBondContact O-CB 3.44Å; N187-A191 PolarHBondContact O-N 3.01Å; I188-A191 PolarHBondContact O-N 3.43Å; A191-Q194 PolarHBondContact O-N 3.47Å; A191-V195 WeakPolarHBondContact O-CB 3.22Å; A191-V195 VanDerWaalsContact O-CG2 3.22Å; A191-V195 WeakPolarHBondContact O-CG2 3.32Å; A191-V195 PolarHBondContact O-N 2.92Å
192Y63.6Low63.3Low101 Ų10179.5 Ų79.540%0.39644%0.44SS..Hα-helixtrans-68-40.5177.3-174.8-91.4000111.1T84 I188 V195 Q196T84-Y192 HydrophobicContact CG2-CD1 3.43Å; T84-Y192 VanDerWaalsContact CG2-CD1 3.43Å; T84-Y192 HydrophobicContact CG2-CE1 3.76Å; I188-Y192 VanDerWaalsContact O-CB 3.23Å; I188-Y192 WeakPolarHBondContact O-CB 3.46Å; I188-Y192 PolarHBondContact O-N 3.13Å; Y192-V195 PolarHBondContact O-N 3.37Å; Y192-Q196 VanDerWaalsContact O-CB 3.29Å; Y192-Q196 WeakPolarHBondContact O-CB 3.49Å; Y192-Q196 PolarHBondContact O-N 3.36Å
193E61.7Low64.9Low64 Ų6477.7 Ų77.730%0.29944%0.435SS..Hα-helixtrans-60.4-45.2171.5-175.5-178-166.900111.6N91 E189 V190 V195 Q196 S197N91-E193 PolarHBondContact ND2-OE1 3.33Å; E189-E193 VanDerWaalsContact O-CB 3.29Å; E189-E193 WeakPolarHBondContact O-CB 3.46Å; E189-E193 PolarHBondContact O-N 3.39Å; V190-E193 PolarHBondContact O-N 3.34Å; E193-V195 PolarHBondContact O-N 3.5Å; E193-Q196 PolarHBondContact O-N 3.24Å; E193-S197 WeakPolarHBondContact O-CB 3.14Å; E193-S197 PolarHBondContact O-N 2.96Å
194Q68.5Low66Low133 Ų13375.7 Ų75.762%0.62142%0.419SS*.Hα-helixtrans-64.9-39.3177.6-76.5179.424.400112.2V190 A191 G198V190-Q194 HydrophobicContact CG1-CG 4.29Å; V190-Q194 VanDerWaalsContact O-CB 3.29Å; V190-Q194 WeakPolarHBondContact O-CB 3.4Å; V190-Q194 WeakPolarHBondContact O-CG 3.32Å; V190-Q194 PolarHBondContact O-N 2.97Å; A191-Q194 PolarHBondContact O-N 3.47Å; Q194-G198 WeakPolarHBondContact O-CA 3.32Å; Q194-G198 PolarHBondContact O-N 3.42Å
195V73.8Confident67.4Low94 Ų9471.6 Ų71.657%0.5741%0.406SS*.Hα-helixtrans-67.9-47175.9170.30000110A191 Y192 E193 G198 T199A191-V195 WeakPolarHBondContact O-CB 3.22Å; A191-V195 VanDerWaalsContact O-CG2 3.22Å; A191-V195 WeakPolarHBondContact O-CG2 3.32Å; A191-V195 PolarHBondContact O-N 2.92Å; Y192-V195 PolarHBondContact O-N 3.37Å; E193-V195 PolarHBondContact O-N 3.5Å; V195-G198 CarbonylContact O-C 3.58Å; V195-G198 PolarHBondContact O-N 3.21Å; V195-T199 HydrophobicContact CG1-CG2 4.37Å; V195-T199 VanDerWaalsContact O-CG2 3.24Å; V195-T199 WeakPolarHBondContact O-CG2 3.26Å; V195-T199 PolarHBondContact O-N 3.35Å; V195-T199 PolarHBondContact O-OG1 3.46Å
196Q68.3Low68.9Low24 Ų2474 Ų7411%0.11242%0.416CS..Hα-helixtrans-64.7-50.6179.9-173.3156.18.200111.1Q88 Y192 E193 G198 T199 E200Q88-Q196 VanDerWaalsContact NE2-CD 3.31Å; Y192-Q196 VanDerWaalsContact O-CB 3.29Å; Y192-Q196 WeakPolarHBondContact O-CB 3.49Å; Y192-Q196 PolarHBondContact O-N 3.36Å; E193-Q196 PolarHBondContact O-N 3.24Å; Q196-G198 VanDerWaalsContact C-N 3.27Å; Q196-G198 PolarHBondContact O-N 2.78Å; Q196-T199 WeakPolarHBondContact CA-OG1 3.46Å; Q196-T199 PolarHBondContact O-N 3.31Å; Q196-T199 VanDerWaalsContact O-N 3.1Å; Q196-T199 PolarHBondContact O-OG1 3.41Å; Q196-E200 WeakPolarHBondContact O-CG 3.46Å; Q196-E200 PolarHBondContact O-N 3.38Å
197S67.3Low70.1Confident46 Ų4677.3 Ų77.332%0.32243%0.427SS..Hα-helixtrans-56.7-41172.3-176.20000111.7E193 E200 Q201E193-S197 WeakPolarHBondContact O-CB 3.14Å; E193-S197 PolarHBondContact O-N 2.96Å; S197-E200 WeakPolarHBondContact O-CB 3.31Å; S197-E200 PolarHBondContact O-N 2.95Å; S197-Q201 WeakPolarHBondContact O-CB 3.2Å; S197-Q201 VanDerWaalsContact O-CG 3.25Å; S197-Q201 WeakPolarHBondContact O-CG 3.14Å; S197-Q201 PolarHBondContact O-N 2.88Å; S197-Q201 PolarHBondContact OG-NE2 3.02Å
198G75.6Confident71.1Confident32 Ų3277.4 Ų77.433%0.3342%0.423SS..Hα-helixtrans-62.1-42.7174.500000112.9Q194 V195 Q196 Q201 L202Q194-G198 WeakPolarHBondContact O-CA 3.32Å; Q194-G198 PolarHBondContact O-N 3.42Å; V195-G198 CarbonylContact O-C 3.58Å; V195-G198 PolarHBondContact O-N 3.21Å; Q196-G198 VanDerWaalsContact C-N 3.27Å; Q196-G198 PolarHBondContact O-N 2.78Å; G198-Q201 PolarHBondContact O-N 3.42Å; G198-L202 WeakPolarHBondContact O-CB 3.49Å; G198-L202 PolarHBondContact O-N 2.97Å
199T77.1Confident72.3Confident79 Ų7981.6 Ų81.649%0.48543%0.431SS..Hα-helixtrans-68.8-34.3175.663.30000112.2V195 Q196 L202 S203V195-T199 HydrophobicContact CG1-CG2 4.37Å; V195-T199 VanDerWaalsContact O-CG2 3.24Å; V195-T199 WeakPolarHBondContact O-CG2 3.26Å; V195-T199 PolarHBondContact O-N 3.35Å; V195-T199 PolarHBondContact O-OG1 3.46Å; Q196-T199 WeakPolarHBondContact CA-OG1 3.46Å; Q196-T199 PolarHBondContact O-N 3.31Å; Q196-T199 VanDerWaalsContact O-N 3.1Å; Q196-T199 PolarHBondContact O-OG1 3.41Å; T199-L202 PolarHBondContact O-N 3.04Å; T199-S203 WeakPolarHBondContact O-CB 3.49Å; T199-S203 PolarHBondContact O-N 2.87Å
200E71.5Confident73.6Confident50 Ų5086.3 Ų86.323%0.23445%0.451CS..Hα-helixtrans-68-44.7174-74-174.9-173.300112K21 Q196 S197 L202 S203 T204K21-E200 WeakPolarHBondContact CE-OE2 3.08Å; Q196-E200 WeakPolarHBondContact O-CG 3.46Å; Q196-E200 PolarHBondContact O-N 3.38Å; S197-E200 WeakPolarHBondContact O-CB 3.31Å; S197-E200 PolarHBondContact O-N 2.95Å; E200-L202 VanDerWaalsContact C-N 3.28Å; E200-L202 PolarHBondContact O-N 3.18Å; E200-S203 PolarHBondContact O-N 3.42Å; E200-T204 VanDerWaalsContact O-CB 3.3Å; E200-T204 WeakPolarHBondContact O-CB 3.23Å; E200-T204 PolarHBondContact O-N 3.12Å; E200-T204 PolarHBondContact O-OG1 3.45Å
201Q74.4Confident74.6Confident127 Ų12785.2 Ų85.259%0.59345%0.447SS*.Hα-helixtrans-60.7-41.3173.2-74.1177.624.700110.1S197 G198 A205S197-Q201 WeakPolarHBondContact O-CB 3.2Å; S197-Q201 VanDerWaalsContact O-CG 3.25Å; S197-Q201 WeakPolarHBondContact O-CG 3.14Å; S197-Q201 PolarHBondContact O-N 2.88Å; S197-Q201 PolarHBondContact OG-NE2 3.02Å; G198-Q201 PolarHBondContact O-N 3.42Å; Q201-A205 WeakPolarHBondContact O-CA 3.39Å; Q201-A205 WeakPolarHBondContact O-CB 3.18Å; Q201-A205 PolarHBondContact O-N 2.79Å
202L81Confident75.4Confident116 Ų11684.9 Ų84.961%0.60744%0.444SS*.Hα-helixtrans-64.8-46.8176-172.565.1000111.6G198 T199 E200 T204 A205 T206G198-L202 WeakPolarHBondContact O-CB 3.49Å; G198-L202 PolarHBondContact O-N 2.97Å; T199-L202 PolarHBondContact O-N 3.04Å; E200-L202 VanDerWaalsContact C-N 3.28Å; E200-L202 PolarHBondContact O-N 3.18Å; L202-T204 PolarHBondContact O-N 3.36Å; L202-A205 CarbonylContact O-C 3.57Å; L202-A205 PolarHBondContact O-N 2.78Å; L202-T206 WeakPolarHBondContact O-CG2 3.12Å; L202-T206 PolarHBondContact O-N 3.35Å
203S78.6Confident76.5Confident58 Ų5888.1 Ų88.141%0.40646%0.455SS..Hα-helixtrans-60.1-47.6177.2178.80000111.4T199 E200 A205 T206 K207T199-S203 WeakPolarHBondContact O-CB 3.49Å; T199-S203 PolarHBondContact O-N 2.87Å; E200-S203 PolarHBondContact O-N 3.42Å; S203-A205 PolarHBondContact O-N 3.4Å; S203-T206 PolarHBondContact O-N 3.09Å; S203-T206 PolarHBondContact O-OG1 2.85Å; S203-K207 PolarHBondContact O-N 3.36Å
204T75.3Confident77.7Confident48 Ų4891.7 Ų91.729%0.29447%0.466SS..Hα-helixtrans-64.1-42.3176.8-54.30000110.9E200 L202 T206 K207 H208E200-T204 VanDerWaalsContact O-CB 3.3Å; E200-T204 WeakPolarHBondContact O-CB 3.23Å; E200-T204 PolarHBondContact O-N 3.12Å; E200-T204 PolarHBondContact O-OG1 3.45Å; L202-T204 PolarHBondContact O-N 3.36Å; T204-T206 VanDerWaalsContact C-N 3.31Å; T204-T206 PolarHBondContact O-N 3.22Å; T204-K207 PolarHBondContact O-N 2.99Å; T204-H208 VanDerWaalsContact CG2-CE1 3.43Å; T204-H208 WeakPolarHBondContact CG2-CE1 3.14Å; T204-H208 WeakPolarHBondContact CG2-ND1 3.21Å; T204-H208 PolarHBondContact O-N 2.79Å; T204-H208 PolarHBondContact O-ND1 2.84Å
205A79.8Confident78.6Confident52 Ų5292 Ų9243%0.4347%0.466SS..Hα-helixtrans-62.2-36.7174.400000111.9Q201 L202 S203 H208 R209Q201-A205 WeakPolarHBondContact O-CA 3.39Å; Q201-A205 WeakPolarHBondContact O-CB 3.18Å; Q201-A205 PolarHBondContact O-N 2.79Å; L202-A205 CarbonylContact O-C 3.57Å; L202-A205 PolarHBondContact O-N 2.78Å; S203-A205 PolarHBondContact O-N 3.4Å; A205-H208 PolarHBondContact O-N 3.41Å; A205-R209 WeakPolarHBondContact O-CB 3.32Å; A205-R209 PolarHBondContact O-N 3.49Å
206T81.9Confident79.3Confident75 Ų7594.8 Ų94.846%0.4647%0.47SS..Hα-helixtrans-67-41.3175.671.60000111.8L202 S203 T204 R209 K210L202-T206 WeakPolarHBondContact O-CG2 3.12Å; L202-T206 PolarHBondContact O-N 3.35Å; S203-T206 PolarHBondContact O-N 3.09Å; S203-T206 PolarHBondContact O-OG1 2.85Å; T204-T206 VanDerWaalsContact C-N 3.31Å; T204-T206 PolarHBondContact O-N 3.22Å; T206-R209 PolarHBondContact O-N 3.14Å; T206-K210 PolarHBondContact O-N 3.26Å
207K80.5Confident80.4Confident144 Ų14497.2 Ų97.263%0.62649%0.489SS*.Hα-helixtrans-61.3-47.9174.3-69.8-179.1-177.9-179.80111S203 T204 K210 S211S203-K207 PolarHBondContact O-N 3.36Å; T204-K207 PolarHBondContact O-N 2.99Å; K207-K210 PolarHBondContact O-N 3.07Å; K207-S211 PolarHBondContact O-N 2.88Å
208H80.4Confident81.6Confident126 Ų126100.3 Ų100.358%0.58350%0.501SS*.Hα-helixtrans-61.8-44.6176.2-7683.5000111.8T204 A205 K210 S211 A212T204-H208 VanDerWaalsContact CG2-CE1 3.43Å; T204-H208 WeakPolarHBondContact CG2-CE1 3.14Å; T204-H208 WeakPolarHBondContact CG2-ND1 3.21Å; T204-H208 PolarHBondContact O-N 2.79Å; T204-H208 PolarHBondContact O-ND1 2.84Å; A205-H208 PolarHBondContact O-N 3.41Å; H208-K210 VanDerWaalsContact C-N 3.31Å; H208-K210 PolarHBondContact O-N 2.76Å; H208-S211 PolarHBondContact O-N 3.35Å; H208-A212 WeakPolarHBondContact O-CB 3.38Å; H208-A212 PolarHBondContact O-N 2.98Å
209R81.7Confident82.4Confident203 Ų203102.3 Ų102.377%0.76651%0.509SS*.Hα-helixtrans-58.1-41.8175.7-177.4179.8173.6-161-1.2111.7A205 T206 R213A205-R209 WeakPolarHBondContact O-CB 3.32Å; A205-R209 PolarHBondContact O-N 3.49Å; T206-R209 PolarHBondContact O-N 3.14Å; R209-R213 VanDerWaalsContact O-CB 3.31Å; R209-R213 WeakPolarHBondContact O-CB 3.45Å; R209-R213 PolarHBondContact O-N 3.45Å
210K80.9Confident83.3Confident128 Ų128103.8 Ų103.856%0.55751%0.513SS*.Hα-helixtrans-66.3-45177.9-170.7175.3-177.5177.70111.9T206 K207 H208 R214T206-K210 PolarHBondContact O-N 3.26Å; K207-K210 PolarHBondContact O-N 3.07Å; H208-K210 VanDerWaalsContact C-N 3.31Å; H208-K210 PolarHBondContact O-N 2.76Å; K210-R214 PolarHBondContact O-N 2.94Å
211S79.5Confident84.3Confident42 Ų42103.4 Ų103.429%0.29452%0.523SS..Hα-helixtrans-65.7-46.4177-172.90000111.9K207 H208 R213 R214 K215K207-S211 PolarHBondContact O-N 2.88Å; H208-S211 PolarHBondContact O-N 3.35Å; S211-R213 VanDerWaalsContact C-N 3.33Å; S211-R213 PolarHBondContact O-N 3.31Å; S211-R214 PolarHBondContact O-N 3.31Å; S211-R214 VanDerWaalsContact O-N 3.14Å; S211-K215 PolarHBondContact O-N 3.04Å
212A82.3Confident85.3Confident41 Ų41102.3 Ų102.334%0.33952%0.52SS..Hα-helixtrans-60.7-40177.200000112H208 R214 K215 K216H208-A212 WeakPolarHBondContact O-CB 3.38Å; H208-A212 PolarHBondContact O-N 2.98Å; A212-R214 PolarHBondContact O-N 3.02Å; A212-K215 PolarHBondContact O-N 2.82Å; A212-K216 WeakPolarHBondContact O-CB 3.28Å; A212-K216 VanDerWaalsContact O-CG 3.31Å; A212-K216 WeakPolarHBondContact O-CG 3.49Å; A212-K216 PolarHBondContact O-N 3.05Å
213R85.9Confident86Confident169 Ų169101.5 Ų101.564%0.63852%0.515SS*.Hα-helixtrans-60.3-43.3174.5177.6173.5153-106.4-3.1111.9R209 S211 K216 C217R209-R213 VanDerWaalsContact O-CB 3.31Å; R209-R213 WeakPolarHBondContact O-CB 3.45Å; R209-R213 PolarHBondContact O-N 3.45Å; S211-R213 VanDerWaalsContact C-N 3.33Å; S211-R213 PolarHBondContact O-N 3.31Å; R213-K216 PolarHBondContact O-N 3.48Å; R213-C217 PolarHBondContact O-N 3.5Å; R213-C217 PolarHBondContact O-SG 3.05Å; R213-C217 VanDerWaalsContact O-SG 3.34Å
214R87.4Confident86.9Confident138 Ų138103 Ų10352%0.52152%0.522SS..Hα-helixtrans-61.5-47.4176-71.9-171.5-67.2-123.91.5111.6K210 S211 A212 K216 C217 I218K210-R214 PolarHBondContact O-N 2.94Å; S211-R214 PolarHBondContact O-N 3.31Å; S211-R214 VanDerWaalsContact O-N 3.14Å; A212-R214 PolarHBondContact O-N 3.02Å; R214-K216 PolarHBondContact O-N 3.32Å; R214-C217 PolarHBondContact O-N 3.2Å; R214-I218 WeakPolarHBondContact O-CG1 3.23Å; R214-I218 PolarHBondContact O-N 3.34Å
215K87.8Confident87.8Confident141 Ų141105.2 Ų105.261%0.61353%0.531SS*.Hα-helixtrans-59.2-45.4176.6-66.5-177.9-177.8-175.50111.6S211 A212 C217 I218 C219S211-K215 PolarHBondContact O-N 3.04Å; A212-K215 PolarHBondContact O-N 2.82Å; K215-C217 PolarHBondContact O-N 2.97Å; K215-I218 PolarHBondContact O-N 2.84Å; K215-C219 PolarHBondContact O-N 3.19Å; K215-C219 PolarHBondContact O-SG 2.92Å; K215-C219 VanDerWaalsContact O-SG 3.36Å
216K88.3Confident88.6Confident151 Ų151107.3 Ų107.366%0.65754%0.538SS*.Hα-helixtrans-59.6-44.5176-74.2-179.7-178.5-172.40112.5A212 R213 R214 C219 L220A212-K216 WeakPolarHBondContact O-CB 3.28Å; A212-K216 VanDerWaalsContact O-CG 3.31Å; A212-K216 WeakPolarHBondContact O-CG 3.49Å; A212-K216 PolarHBondContact O-N 3.05Å; R213-K216 PolarHBondContact O-N 3.48Å; R214-K216 PolarHBondContact O-N 3.32Å; K216-C219 PolarHBondContact O-N 2.99Å; K216-L220 WeakPolarHBondContact O-CB 3.33Å; K216-L220 PolarHBondContact O-N 3.39Å
217C90.8Very high89.3Confident75 Ų75108.8 Ų108.851%0.50754%0.543SS..Hα-helixtrans-62.9-41.8176.8-71.50000112.3R213 R214 K215 L220 G221R213-C217 PolarHBondContact O-N 3.5Å; R213-C217 PolarHBondContact O-SG 3.05Å; R213-C217 VanDerWaalsContact O-SG 3.34Å; R214-C217 PolarHBondContact O-N 3.2Å; K215-C217 PolarHBondContact O-N 2.97Å; C217-L220 PolarHBondContact O-N 3.35Å; C217-G221 PolarHBondContact O-N 3.37Å
218I92.8Very high90Very high112 Ų112107.9 Ų107.957%0.57454%0.54SS*.Hα-helixtrans-63.4-48176.5-65.7165.6000110.2R214 K215 L220 G221 L222R214-I218 WeakPolarHBondContact O-CG1 3.23Å; R214-I218 PolarHBondContact O-N 3.34Å; K215-I218 PolarHBondContact O-N 2.84Å; I218-L220 VanDerWaalsContact C-N 3.34Å; I218-L220 PolarHBondContact O-N 3.48Å; I218-G221 PolarHBondContact O-N 2.92Å; I218-L222 WeakPolarHBondContact O-CG 3.47Å; I218-L222 PolarHBondContact O-N 2.94Å
219C92.9Very high90.7Very high74 Ų74106.7 Ų106.750%0.554%0.536SS..Hα-helixtrans-59.4-42.8176.4-69.40000112.4K215 K216 L222 I223K215-C219 PolarHBondContact O-N 3.19Å; K215-C219 PolarHBondContact O-SG 2.92Å; K215-C219 VanDerWaalsContact O-SG 3.36Å; K216-C219 PolarHBondContact O-N 2.99Å; C219-L222 PolarHBondContact O-N 2.97Å; C219-I223 WeakPolarHBondContact O-CG1 3.42Å; C219-I223 PolarHBondContact O-N 2.71Å
220L94.8Very high91.3Very high110 Ų110101.8 Ų101.858%0.57653%0.525SS*.Hα-helixtrans-60.3-44.3175.1-105.7156.3000111.9K216 C217 I218 L222 I223 V224K216-L220 WeakPolarHBondContact O-CB 3.33Å; K216-L220 PolarHBondContact O-N 3.39Å; C217-L220 PolarHBondContact O-N 3.35Å; I218-L220 VanDerWaalsContact C-N 3.34Å; I218-L220 PolarHBondContact O-N 3.48Å; L220-L222 VanDerWaalsContact C-N 3.32Å; L220-L222 PolarHBondContact O-N 2.77Å; L220-I223 PolarHBondContact O-N 2.97Å; L220-V224 WeakPolarHBondContact O-CG2 3.49Å; L220-V224 PolarHBondContact O-N 2.97Å
221G94.1Very high91.9Very high42 Ų4298.6 Ų98.643%0.43352%0.523SS..Hα-helixtrans-59.6-41.2176.400000112.7C217 I218 V224 L225C217-G221 PolarHBondContact O-N 3.37Å; I218-G221 PolarHBondContact O-N 2.92Å; G221-V224 PolarHBondContact O-N 3.19Å; G221-L225 WeakPolarHBondContact O-CB 3.29Å; G221-L225 PolarHBondContact O-N 3.08Å
222L95.6Very high92.6Very high104 Ų104100.8 Ų100.855%0.54553%0.53SS..Hα-helixtrans-65.8-43.1175.9-66.5178.8000112.4I218 C219 L220 V224 L225 V226I218-L222 WeakPolarHBondContact O-CG 3.47Å; I218-L222 PolarHBondContact O-N 2.94Å; C219-L222 PolarHBondContact O-N 2.97Å; L220-L222 VanDerWaalsContact C-N 3.32Å; L220-L222 PolarHBondContact O-N 2.77Å; L222-V224 VanDerWaalsContact C-N 3.34Å; L222-V224 PolarHBondContact O-N 3.1Å; L222-L225 PolarHBondContact O-N 2.89Å; L222-V226 WeakPolarHBondContact O-CG2 3.38Å; L222-V226 PolarHBondContact O-N 3.37Å
223I95.6Very high93.1Very high99 Ų99101.2 Ų101.251%0.50853%0.534SS..Hα-helixtrans-60.8-46176.9-68.3166.6000110.4C219 L220 L225 V226 L227C219-I223 WeakPolarHBondContact O-CG1 3.42Å; C219-I223 PolarHBondContact O-N 2.71Å; L220-I223 PolarHBondContact O-N 2.97Å; I223-L225 VanDerWaalsContact C-N 3.32Å; I223-L225 PolarHBondContact O-N 3.44Å; I223-V226 PolarHBondContact O-N 2.99Å; I223-L227 HydrophobicContact CG2-CD1 4.09Å; I223-L227 HydrophobicContact CG2-CG 4.47Å; I223-L227 WeakPolarHBondContact O-CG 3.29Å; I223-L227 PolarHBondContact O-N 3.29Å
224V96Very high93.5Very high89 Ų8997.5 Ų97.554%0.53953%0.525SS..Hα-helixtrans-61.7-41.2177.7172.50000111.2L220 G221 L222 L227 F228L220-V224 WeakPolarHBondContact O-CG2 3.49Å; L220-V224 PolarHBondContact O-N 2.97Å; G221-V224 PolarHBondContact O-N 3.19Å; L222-V224 VanDerWaalsContact C-N 3.34Å; L222-V224 PolarHBondContact O-N 3.1Å; V224-L227 PolarHBondContact O-N 3.21Å; V224-F228 WeakPolarHBondContact O-CB 3.44Å; V224-F228 PolarHBondContact O-N 3.49Å
225L95.6Very high93.7Very high94 Ų9492.9 Ų92.949%0.49252%0.521SS..Hα-helixtrans-62.3-44.7176.7-178.666000112.1G221 L222 I223 F228 I229G221-L225 WeakPolarHBondContact O-CB 3.29Å; G221-L225 PolarHBondContact O-N 3.08Å; L222-L225 PolarHBondContact O-N 2.89Å; I223-L225 VanDerWaalsContact C-N 3.32Å; I223-L225 PolarHBondContact O-N 3.44Å; L225-F228 PolarHBondContact O-N 3.31Å; L225-I229 HydrophobicContact CD1-CD1 4.46Å; L225-I229 HydrophobicContact CG-CD1 4.25Å; L225-I229 WeakPolarHBondContact O-CG1 3.43Å; L225-I229 PolarHBondContact O-N 3.45Å
226V96.1Very high93.9Very high96 Ų9692 Ų9258%0.58252%0.522SS*.Hα-helixtrans-62.3-45177.61710000111L222 I223 F228 I229 L230L222-V226 WeakPolarHBondContact O-CG2 3.38Å; L222-V226 PolarHBondContact O-N 3.37Å; I223-V226 PolarHBondContact O-N 2.99Å; V226-F228 VanDerWaalsContact C-N 3.32Å; V226-F228 PolarHBondContact O-N 3.15Å; V226-I229 PolarHBondContact O-N 2.96Å; V226-L230 PolarHBondContact O-N 3.11Å
227L95.6Very high93.9Very high107 Ų10788.8 Ų88.856%0.5652%0.519SS*.Hα-helixtrans-63.3-38.3176.4-68.6176.3000112.1I223 V224 L230 A231I223-L227 HydrophobicContact CG2-CD1 4.09Å; I223-L227 HydrophobicContact CG2-CG 4.47Å; I223-L227 WeakPolarHBondContact O-CG 3.29Å; I223-L227 PolarHBondContact O-N 3.29Å; V224-L227 PolarHBondContact O-N 3.21Å; L227-L230 PolarHBondContact O-N 2.96Å; L227-A231 WeakPolarHBondContact O-CB 3.41Å; L227-A231 PolarHBondContact O-N 3.22Å
228F95.5Very high93.8Very high125 Ų12591.9 Ų91.955%0.54853%0.53SS..Hα-helixtrans-64.3-45.1177-177.7-105.3000112.1V224 L225 V226 L230 A231 L232V224-F228 WeakPolarHBondContact O-CB 3.44Å; V224-F228 PolarHBondContact O-N 3.49Å; L225-F228 PolarHBondContact O-N 3.31Å; V226-F228 VanDerWaalsContact C-N 3.32Å; V226-F228 PolarHBondContact O-N 3.15Å; F228-L230 VanDerWaalsContact C-N 3.34Å; F228-L230 PolarHBondContact O-N 3.16Å; F228-A231 PolarHBondContact O-N 3.22Å; F228-L232 HydrophobicContact CD1-CD1 3.96Å; F228-L232 HydrophobicContact CD1-CG 4.48Å; F228-L232 HydrophobicContact CE1-CD1 3.44Å; F228-L232 VanDerWaalsContact CE1-CD1 3.44Å; F228-L232 HydrophobicContact CE1-CG 4.16Å; F228-L232 HydrophobicContact CZ-CD1 3.8Å; F228-L232 HydrophobicContact CZ-CD2 4.33Å; F228-L232 HydrophobicContact CZ-CG 4.18Å; F228-L232 WeakPolarHBondContact O-CG 3.47Å; F228-L232 PolarHBondContact O-N 3.22Å
229I95.3Very high93.4Very high101 Ų10197.3 Ų97.352%0.51854%0.543SS..Hα-helixtrans-61.2-44.1175.8-67.4168.5000110.7L225 V226 A231 L232 A233L225-I229 HydrophobicContact CD1-CD1 4.46Å; L225-I229 HydrophobicContact CG-CD1 4.25Å; L225-I229 WeakPolarHBondContact O-CG1 3.43Å; L225-I229 PolarHBondContact O-N 3.45Å; V226-I229 PolarHBondContact O-N 2.96Å; I229-A231 VanDerWaalsContact C-N 3.35Å; I229-A231 PolarHBondContact O-N 3.36Å; I229-L232 PolarHBondContact O-N 3.34Å; I229-A233 WeakPolarHBondContact O-CB 3.4Å; I229-A233 PolarHBondContact O-N 3.33Å
230L94.7Very high92.1Very high99 Ų99104.9 Ų104.952%0.51857%0.571SS.*Hα-helixtrans-63.1-41.5178.7-171.765.2000111.7V226 L227 F228 A233 I234V226-L230 PolarHBondContact O-N 3.11Å; L227-L230 PolarHBondContact O-N 2.96Å; F228-L230 VanDerWaalsContact C-N 3.34Å; F228-L230 PolarHBondContact O-N 3.16Å; L230-A233 PolarHBondContact O-N 2.84Å; L230-I234 HydrophobicContact CD1-CD1 4.39Å; L230-I234 HydrophobicContact CG-CD1 4.01Å; L230-I234 VanDerWaalsContact O-CG1 3.3Å; L230-I234 WeakPolarHBondContact O-CG1 3.42Å; L230-I234 PolarHBondContact O-N 3.2Å
231A94Very high92Very high62 Ų62104.7 Ų104.751%0.51257%0.571SS.*Hα-helixtrans-63.6-41.3176.100000112.3L227 F228 I229 G235L227-A231 WeakPolarHBondContact O-CB 3.41Å; L227-A231 PolarHBondContact O-N 3.22Å; F228-A231 PolarHBondContact O-N 3.22Å; I229-A231 VanDerWaalsContact C-N 3.35Å; I229-A231 PolarHBondContact O-N 3.36Å; A231-G235 PolarHBondContact O-N 3.43Å
232L93.7Very high91.8Very high88 Ų88107.9 Ų107.946%0.46158%0.578SS.*Hα-helixtrans-64.2-43174.3-70.7-179.3000111.9F228 I229 I234 G235 L236F228-L232 HydrophobicContact CD1-CD1 3.96Å; F228-L232 HydrophobicContact CD1-CG 4.48Å; F228-L232 HydrophobicContact CE1-CD1 3.44Å; F228-L232 VanDerWaalsContact CE1-CD1 3.44Å; F228-L232 HydrophobicContact CE1-CG 4.16Å; F228-L232 HydrophobicContact CZ-CD1 3.8Å; F228-L232 HydrophobicContact CZ-CD2 4.33Å; F228-L232 HydrophobicContact CZ-CG 4.18Å; F228-L232 WeakPolarHBondContact O-CG 3.47Å; F228-L232 PolarHBondContact O-N 3.22Å; I229-L232 PolarHBondContact O-N 3.34Å; L232-I234 PolarHBondContact O-N 3.04Å; L232-G235 PolarHBondContact O-N 3.37Å; L232-L236 WeakPolarHBondContact O-CB 3.44Å; L232-L236 VanDerWaalsContact O-CG 3.28Å; L232-L236 WeakPolarHBondContact O-CG 3.45Å; L232-L236 PolarHBondContact O-N 2.84Å
233A92.7Very high91.6Very high49 Ų49108.2 Ų108.241%0.40558%0.58SS.*Hα-helixtrans-62.8-42.1178.700000112.3I229 L230 S237I229-A233 WeakPolarHBondContact O-CB 3.4Å; I229-A233 PolarHBondContact O-N 3.33Å; L230-A233 PolarHBondContact O-N 2.84Å; A233-S237 WeakPolarHBondContact O-CB 3.3Å; A233-S237 PolarHBondContact O-N 3.19Å; A233-S237 PolarHBondContact O-OG 3.11Å
234I94.6Very high91.4Very high91 Ų91108.7 Ų108.747%0.46758%0.584SS.*Hα-helixtrans-67.8-44.6175.7-65.8165.5000110.5L230 L232 L236 S237 L238L230-I234 HydrophobicContact CD1-CD1 4.39Å; L230-I234 HydrophobicContact CG-CD1 4.01Å; L230-I234 VanDerWaalsContact O-CG1 3.3Å; L230-I234 WeakPolarHBondContact O-CG1 3.42Å; L230-I234 PolarHBondContact O-N 3.2Å; L232-I234 PolarHBondContact O-N 3.04Å; I234-L236 PolarHBondContact O-N 3.04Å; I234-S237 PolarHBondContact O-N 2.78Å; I234-L238 HydrophobicContact CG2-CD1 3.71Å; I234-L238 WeakPolarHBondContact O-CB 3.15Å; I234-L238 PolarHBondContact O-N 2.71Å
235G91.5Very high91.1Very high41 Ų41109.9 Ų109.942%0.42359%0.587SS.*Hα-helixtrans-65-36.6179.700000113.9A231 L232 R239A231-G235 PolarHBondContact O-N 3.43Å; L232-G235 PolarHBondContact O-N 3.37Å; G235-R239 PolarHBondContact O-N 2.88Å
236L91.5Very high90.8Very high122 Ų122111 Ų11164%0.63959%0.593SS**Hα-helixtrans-70.5-43.7173.5-71.5172.1000111.4L232 I234 L238 R239 Q240L232-L236 WeakPolarHBondContact O-CB 3.44Å; L232-L236 VanDerWaalsContact O-CG 3.28Å; L232-L236 WeakPolarHBondContact O-CG 3.45Å; L232-L236 PolarHBondContact O-N 2.84Å; I234-L236 PolarHBondContact O-N 3.04Å; L236-L238 VanDerWaalsContact C-N 3.32Å; L236-L238 PolarHBondContact O-N 2.63Å; L236-R239 PolarHBondContact O-N 3.3Å; L236-Q240 PolarHBondContact O-N 2.83Å
237S89.6Confident90.4Very high85 Ų85112.1 Ų112.159%0.59459%0.594SS**Hα-helixtrans-62.6-35.3177.5-59.40000113A233 I234 R239A233-S237 WeakPolarHBondContact O-CB 3.3Å; A233-S237 PolarHBondContact O-N 3.19Å; A233-S237 PolarHBondContact O-OG 3.11Å; I234-S237 PolarHBondContact O-N 2.78Å; S237-R239 VanDerWaalsContact C-N 3.32Å
238L88.2Confident90Very high139 Ų139112.5 Ų112.573%0.72860%0.597SS**Hα-helixtrans-74.1-20.5177.1-84.8159.1000113.7I234 L236I234-L238 HydrophobicContact CG2-CD1 3.71Å; I234-L238 WeakPolarHBondContact O-CB 3.15Å; I234-L238 PolarHBondContact O-N 2.71Å; L236-L238 VanDerWaalsContact C-N 3.32Å; L236-L238 PolarHBondContact O-N 2.63Å
239R83.9Confident89.6Confident227 Ų227111.4 Ų111.486%0.85760%0.601SS**Hα-helixtrans-87.8-19.4-179.5-179.9166.8175.5176.7-1.8112.7G235 L236 S237G235-R239 PolarHBondContact O-N 2.88Å; L236-R239 PolarHBondContact O-N 3.3Å; S237-R239 VanDerWaalsContact C-N 3.32Å
240Q65.4Low89.1Confident233 Ų233112.4 Ų112.4100%1.08961%0.608SS**  trans-84.90179.8-150.7-178.9-22.800111L236L236-Q240 PolarHBondContact O-N 2.83Å

Retrieved 240 of 240 residues in 45.7 ms (Link to these results)

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