A0A3Q0KC19_SCHMA Loading...

ER lumen protein-retaining receptor

AlphaFold DB , UniProt , Accession A0A3Q0KC19, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 212 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
1M79.3Confident92.6Very high138 Ų13861.3 Ų61.368%0.6831%0.308SS*.  0136.20-172.759.581.800107.4R5 F6 Y59M1-R5 HydrophobicContact CE-CG 4.45Å; M1-R5 HydrophobicContact SD-CB 3.76Å; M1-R5 VanDerWaalsContact SD-CD 3.56Å; M1-R5 HydrophobicContact SD-CG 3.55Å; M1-R5 VanDerWaalsContact SD-CG 3.55Å; M1-F6 HydrophobicContact CG-CB 4.37Å; M1-Y59 HydrophobicContact CE-CE1 4.21Å
2N90.6Very high92.9Very high20 Ų2057 Ų5711%0.10729%0.286CS..  trans-119.3168171.161.951.4000109.3F4 R5 F6 N165 Y168N2-F4 VanDerWaalsContact C-N 3.31Å; N2-F4 PolarHBondContact O-N 3.47Å; N2-F4 PolarHBondContact OD1-N 3.18Å; N2-R5 PolarHBondContact O-N 3.07Å; N2-R5 PolarHBondContact OD1-N 3.41Å; N2-F6 PolarHBondContact O-N 3.26Å; N2-N165 PolarHBondContact ND2-OD1 3.12Å; N2-N165 PolarHBondContact OD1-OD1 2.93Å; N2-Y168 HydrophobicContact CB-CD1 3.98Å; N2-Y168 HydrophobicContact CB-CE1 3.82Å; N2-Y168 WeakPolarHBondContact ND2-CD1 3.26Å
3I93.1Very high93.1Very high103 Ų10355.5 Ų55.553%0.52828%0.276SS..Hα-helixtrans-59-40.3-175.3-173.266.3000112.5R5 F6 L7I3-R5 PolarHBondContact O-N 2.94Å; I3-F6 PolarHBondContact O-N 2.96Å; I3-L7 HydrophobicContact CD1-CD1 4.31Å; I3-L7 HydrophobicContact CD1-CG 4.19Å; I3-L7 HydrophobicContact CG1-CD1 3.93Å; I3-L7 HydrophobicContact CG1-CG 4.23Å; I3-L7 WeakPolarHBondContact O-CB 3.23Å; I3-L7 WeakPolarHBondContact O-CG 3.25Å; I3-L7 PolarHBondContact O-N 3.37Å
4F94.1Very high93.3Very high65 Ų6553.9 Ų53.929%0.28528%0.277SS..Hα-helixtrans-64.3-43.3-178.8-58.5-65.6000111.9N2 G8 L164 N165 Y168N2-F4 VanDerWaalsContact C-N 3.31Å; N2-F4 PolarHBondContact O-N 3.47Å; N2-F4 PolarHBondContact OD1-N 3.18Å; F4-G8 PolarHBondContact O-N 3.25Å; F4-L164 HydrophobicContact CB-CB 4.24Å; F4-L164 HydrophobicContact CD1-CB 3.73Å; F4-L164 HydrophobicContact CD1-CD1 3.99Å; F4-L164 HydrophobicContact CE1-CB 4.19Å; F4-L164 HydrophobicContact CE1-CD1 4.1Å; F4-L164 HydrophobicContact CG-CB 3.91Å; F4-N165 HydrophobicContact CB-CB 3.82Å; F4-Y168 HydrophobicContact CD2-CD2 4.42Å; F4-Y168 HydrophobicContact CD2-CG 4.32Å; F4-Y168 HydrophobicContact CE2-CD2 4.05Å; F4-Y168 HydrophobicContact CE2-CG 4.36Å
5R91.7Very high93.5Very high82 Ų8250.3 Ų50.331%0.30926%0.258SS..Hα-helixtrans-65.3-42.9175.2-175.4173.8173.6175.81.7111.7M1 N2 I3 G8 D9 N165M1-R5 HydrophobicContact CE-CG 4.45Å; M1-R5 HydrophobicContact SD-CB 3.76Å; M1-R5 VanDerWaalsContact SD-CD 3.56Å; M1-R5 HydrophobicContact SD-CG 3.55Å; M1-R5 VanDerWaalsContact SD-CG 3.55Å; N2-R5 PolarHBondContact O-N 3.07Å; N2-R5 PolarHBondContact OD1-N 3.41Å; I3-R5 PolarHBondContact O-N 2.94Å; R5-G8 PolarHBondContact O-N 3.46Å; R5-D9 VanDerWaalsContact O-CG 3.32Å; R5-D9 PolarHBondContact O-N 3.27Å; R5-N165 HydrophobicContact CB-CB 4.27Å
6F92.9Very high93.6Very high107 Ų10748.5 Ų48.547%0.46925%0.249SC..Hα-helixtrans-60.7-47.2177.6177.3-96.9000111.9M1 N2 I3 G8 D9 A10M1-F6 HydrophobicContact CG-CB 4.37Å; N2-F6 PolarHBondContact O-N 3.26Å; I3-F6 PolarHBondContact O-N 2.96Å; F6-G8 VanDerWaalsContact C-N 3.33Å; F6-G8 PolarHBondContact O-N 2.89Å; F6-D9 PolarHBondContact O-N 2.92Å; F6-A10 WeakPolarHBondContact O-CB 3.45Å; F6-A10 PolarHBondContact O-N 3.42Å
7L95.7Very high93.7Very high80 Ų8051.2 Ų51.242%0.41926%0.262SS..Hα-helixtrans-64.9-37.5176.1-68.8176.1000111.9I3 A10 S11 L161I3-L7 HydrophobicContact CD1-CD1 4.31Å; I3-L7 HydrophobicContact CD1-CG 4.19Å; I3-L7 HydrophobicContact CG1-CD1 3.93Å; I3-L7 HydrophobicContact CG1-CG 4.23Å; I3-L7 WeakPolarHBondContact O-CB 3.23Å; I3-L7 WeakPolarHBondContact O-CG 3.25Å; I3-L7 PolarHBondContact O-N 3.37Å; L7-A10 PolarHBondContact O-N 3Å; L7-S11 WeakPolarHBondContact O-CB 3.39Å; L7-S11 PolarHBondContact O-N 3.39Å; L7-L161 HydrophobicContact CB-CD1 4Å; L7-L161 HydrophobicContact CB-CD2 4.27Å
8G95.6Very high93.8Very high0 Ų050.8 Ų50.80%026%0.261CS..Hα-helixtrans-59.7-53.2173.600000111.3F4 R5 F6 A10 S11 H12 Y158F4-G8 PolarHBondContact O-N 3.25Å; R5-G8 PolarHBondContact O-N 3.46Å; F6-G8 VanDerWaalsContact C-N 3.33Å; F6-G8 PolarHBondContact O-N 2.89Å; G8-A10 VanDerWaalsContact C-N 3.31Å; G8-A10 PolarHBondContact O-N 3.26Å; G8-S11 WeakPolarHBondContact O-CB 3.47Å; G8-S11 PolarHBondContact O-N 2.92Å; G8-S11 VanDerWaalsContact O-N 3.13Å; G8-H12 PolarHBondContact O-N 3.43Å; G8-Y158 VanDerWaalsContact O-CB 3.25Å; G8-Y158 WeakPolarHBondContact O-CB 3.39Å
9D94.1Very high94Very high15 Ų1548.5 Ų48.58%0.0825%0.249CC..Hα-helixtrans-58-45177.7-68.5-19.2000110.9R5 F6 S11 H12 F13 Y162R5-D9 VanDerWaalsContact O-CG 3.32Å; R5-D9 PolarHBondContact O-N 3.27Å; F6-D9 PolarHBondContact O-N 2.92Å; D9-S11 PolarHBondContact O-N 3.31Å; D9-H12 WeakPolarHBondContact O-CB 3.25Å; D9-H12 PolarHBondContact O-N 3.04Å; D9-H12 VanDerWaalsContact O-N 3.17Å; D9-F13 WeakPolarHBondContact O-CD2 3.44Å; D9-F13 PolarHBondContact O-N 3.24Å; D9-Y162 WeakPolarHBondContact OD1-CE2 3.39Å; D9-Y162 PolarHBondContact OD1-OH 2.87Å
10A95Very high94Very high45 Ų4548.2 Ų48.237%0.37225%0.249SC..Hα-helixtrans-59.6-42.4175.800000112.8F6 L7 G8 H12 F13 A14F6-A10 WeakPolarHBondContact O-CB 3.45Å; F6-A10 PolarHBondContact O-N 3.42Å; L7-A10 PolarHBondContact O-N 3Å; G8-A10 VanDerWaalsContact C-N 3.31Å; G8-A10 PolarHBondContact O-N 3.26Å; A10-H12 VanDerWaalsContact C-N 3.32Å; A10-H12 PolarHBondContact O-N 2.9Å; A10-F13 PolarHBondContact O-N 3.11Å; A10-A14 WeakPolarHBondContact O-CB 3.48Å; A10-A14 PolarHBondContact O-N 2.96Å
11S96Very high94.1Very high19 Ų1949.6 Ų49.613%0.13326%0.257CS..Hα-helixtrans-63.8-37.9175.8-168.20000111.9L7 G8 D9 A14 A15 S154L7-S11 WeakPolarHBondContact O-CB 3.39Å; L7-S11 PolarHBondContact O-N 3.39Å; G8-S11 WeakPolarHBondContact O-CB 3.47Å; G8-S11 PolarHBondContact O-N 2.92Å; G8-S11 VanDerWaalsContact O-N 3.13Å; D9-S11 PolarHBondContact O-N 3.31Å; S11-A14 PolarHBondContact O-N 3.34Å; S11-A15 PolarHBondContact O-N 2.73Å; S11-S154 PolarHBondContact OG-O 3.14Å
12H96.5Very high94.8Very high10 Ų1043.3 Ų43.35%0.04623%0.226CC..Hα-helixtrans-67.9-43.9176.8-164.6178.9000111.5G8 D9 A10 A14 A15 I16 F44 F67 Y158G8-H12 PolarHBondContact O-N 3.43Å; D9-H12 WeakPolarHBondContact O-CB 3.25Å; D9-H12 PolarHBondContact O-N 3.04Å; D9-H12 VanDerWaalsContact O-N 3.17Å; A10-H12 VanDerWaalsContact C-N 3.32Å; A10-H12 PolarHBondContact O-N 2.9Å; H12-A14 VanDerWaalsContact C-N 3.32Å; H12-A14 PolarHBondContact O-N 2.93Å; H12-A15 WeakPolarHBondContact O-CB 3.18Å; H12-A15 PolarHBondContact O-N 3.34Å; H12-I16 PolarHBondContact O-N 3.36Å; H12-F44 AromaticContact CE1-CE1 3.77Å; H12-F44 AromaticContact CE1-CZ 3.59Å; H12-F44 AromaticContact NE2-CZ 3.57Å; H12-F67 HydrophobicContact CB-CE1 4.37Å; H12-F67 HydrophobicContact CB-CZ 4.36Å; H12-F67 AromaticContact CD2-CE1 3.89Å; H12-F67 AromaticContact CE1-CE1 3.76Å; H12-F67 AromaticContact CG-CE1 3.69Å; H12-F67 AromaticContact ND1-CE1 3.6Å; H12-F67 AromaticContact ND1-CZ 3.77Å; H12-F67 AromaticContact NE2-CE1 3.94Å; H12-Y158 HydrophobicContact CB-CD1 4Å; H12-Y158 HydrophobicContact CB-CD2 4.41Å; H12-Y158 HydrophobicContact CB-CG 3.9Å; H12-Y158 AromaticContact CD2-CD1 4Å; H12-Y158 AromaticContact CG-CD1 3.86Å
13F96Very high95.1Very high37 Ų3742.4 Ų42.416%0.16222%0.221CC..Hα-helixtrans-59.5-43.4172.1-80.9-68.6000111.9D9 A10 A15 I16 I17 A63 I66 F67D9-F13 WeakPolarHBondContact O-CD2 3.44Å; D9-F13 PolarHBondContact O-N 3.24Å; A10-F13 PolarHBondContact O-N 3.11Å; F13-A15 VanDerWaalsContact C-N 3.33Å; F13-A15 PolarHBondContact O-N 2.8Å; F13-I16 PolarHBondContact O-N 3.38Å; F13-I17 WeakPolarHBondContact O-CB 3.31Å; F13-I17 VanDerWaalsContact O-CG1 3.28Å; F13-I17 WeakPolarHBondContact O-CG1 3.44Å; F13-I17 PolarHBondContact O-N 3.33Å; F13-A63 HydrophobicContact CE2-CB 4.33Å; F13-A63 HydrophobicContact CZ-CB 3.67Å; F13-I66 HydrophobicContact CD1-CG2 4.31Å; F13-I66 HydrophobicContact CE1-CB 4.2Å; F13-I66 HydrophobicContact CE1-CD1 4.4Å; F13-I66 HydrophobicContact CE1-CG2 3.82Å; F13-F67 HydrophobicContact CD1-CE1 4.45Å; F13-F67 HydrophobicContact CD1-CZ 4.25Å; F13-F67 HydrophobicContact CD2-CZ 4.26Å; F13-F67 HydrophobicContact CE1-CE1 4.36Å; F13-F67 HydrophobicContact CE1-CE2 4.15Å; F13-F67 AromaticContact CE1-CZ 3.94Å; F13-F67 HydrophobicContact CE1-CZ 3.94Å; F13-F67 HydrophobicContact CE2-CE2 4.13Å; F13-F67 AromaticContact CE2-CZ 3.93Å; F13-F67 HydrophobicContact CE2-CZ 3.93Å; F13-F67 HydrophobicContact CG-CZ 4.4Å; F13-F67 AromaticContact CZ-CE2 3.72Å; F13-F67 HydrophobicContact CZ-CE2 3.72Å; F13-F67 AromaticContact CZ-CZ 3.76Å; F13-F67 HydrophobicContact CZ-CZ 3.76Å
14A96.2Very high95.2Very high34 Ų3443.7 Ų43.728%0.28122%0.219SC..Hα-helixtrans-58.6-44.6176.700000111.4A10 S11 H12 I16 I17 I18A10-A14 WeakPolarHBondContact O-CB 3.48Å; A10-A14 PolarHBondContact O-N 2.96Å; S11-A14 PolarHBondContact O-N 3.34Å; H12-A14 VanDerWaalsContact C-N 3.32Å; H12-A14 PolarHBondContact O-N 2.93Å; A14-I16 VanDerWaalsContact C-N 3.34Å; A14-I16 PolarHBondContact O-N 3.24Å; A14-I17 PolarHBondContact O-N 3.06Å; A14-I18 WeakPolarHBondContact O-CB 3.46Å; A14-I18 WeakPolarHBondContact O-CD1 3.25Å; A14-I18 WeakPolarHBondContact O-CG1 3.49Å; A14-I18 PolarHBondContact O-N 2.96Å
15A96.3Very high95.2Very high0 Ų048.3 Ų48.30%024%0.239CC..Hα-helixtrans-56.5-47.1177.400000112.1S11 H12 F13 I18 L19 Y151 L155S11-A15 PolarHBondContact O-N 2.73Å; H12-A15 WeakPolarHBondContact O-CB 3.18Å; H12-A15 PolarHBondContact O-N 3.34Å; F13-A15 VanDerWaalsContact C-N 3.33Å; F13-A15 PolarHBondContact O-N 2.8Å; A15-I18 PolarHBondContact O-N 3.25Å; A15-L19 WeakPolarHBondContact O-CB 3.39Å; A15-L19 PolarHBondContact O-N 3.15Å; A15-Y151 HydrophobicContact CB-CD2 4.02Å; A15-Y151 HydrophobicContact CB-CE2 4.36Å; A15-Y151 WeakPolarHBondContact O-CD2 3.25Å; A15-L155 HydrophobicContact CB-CB 3.94Å; A15-L155 HydrophobicContact CB-CD1 4.1Å
16I95.1Very high95.4Very high21 Ų2147.4 Ų47.411%0.10824%0.243CC..Hα-helixtrans-65.6-44.7179.9-69.2175.6000111.6H12 F13 A14 L19 V20 F67 S70H12-I16 PolarHBondContact O-N 3.36Å; F13-I16 PolarHBondContact O-N 3.38Å; A14-I16 VanDerWaalsContact C-N 3.34Å; A14-I16 PolarHBondContact O-N 3.24Å; I16-L19 PolarHBondContact O-N 3.36Å; I16-V20 HydrophobicContact CG2-CG2 4.42Å; I16-V20 WeakPolarHBondContact O-CG2 3.33Å; I16-V20 PolarHBondContact O-N 2.75Å; I16-F67 HydrophobicContact CD1-CD1 3.18Å; I16-F67 HydrophobicContact CD1-CE1 3.35Å; I16-F67 HydrophobicContact CD1-CG 4.44Å; I16-S70 VanDerWaalsContact CG2-OG 3.31Å; I16-S70 WeakPolarHBondContact CG2-OG 3.29Å
17I95.2Very high95.5Very high94 Ų9448 Ų4848%0.48224%0.242SC..Hα-helixtrans-61.8-46.5178.3-69.2166.5000110F13 A14 L19 V20 L21F13-I17 WeakPolarHBondContact O-CB 3.31Å; F13-I17 VanDerWaalsContact O-CG1 3.28Å; F13-I17 WeakPolarHBondContact O-CG1 3.44Å; F13-I17 PolarHBondContact O-N 3.33Å; A14-I17 PolarHBondContact O-N 3.06Å; I17-L19 VanDerWaalsContact C-N 3.33Å; I17-L19 PolarHBondContact O-N 2.96Å; I17-V20 PolarHBondContact O-N 2.91Å; I17-L21 HydrophobicContact CG2-CD1 3.56Å; I17-L21 HydrophobicContact CG2-CG 4.11Å; I17-L21 WeakPolarHBondContact O-CB 3.47Å; I17-L21 WeakPolarHBondContact O-CG 3.42Å; I17-L21 PolarHBondContact O-N 3.32Å
18I95.7Very high95.4Very high45 Ų4545.3 Ų45.323%0.23123%0.23CC..Hα-helixtrans-57.9-47.3177.2-68.8163.5000110.1A14 A15 K22 I147A14-I18 WeakPolarHBondContact O-CB 3.46Å; A14-I18 WeakPolarHBondContact O-CD1 3.25Å; A14-I18 WeakPolarHBondContact O-CG1 3.49Å; A14-I18 PolarHBondContact O-N 2.96Å; A15-I18 PolarHBondContact O-N 3.25Å; I18-K22 WeakPolarHBondContact O-CB 3.31Å; I18-K22 PolarHBondContact O-N 2.92Å; I18-I147 HydrophobicContact CG2-CG2 3.98Å
19L96.4Very high95.4Very high6 Ų645.3 Ų45.33%0.03123%0.23CC..Hα-helixtrans-62.1-51.1-178.9-177.662.9000112.3A15 I16 I17 K22 I23 L32 T74 Y151A15-L19 WeakPolarHBondContact O-CB 3.39Å; A15-L19 PolarHBondContact O-N 3.15Å; I16-L19 PolarHBondContact O-N 3.36Å; I17-L19 VanDerWaalsContact C-N 3.33Å; I17-L19 PolarHBondContact O-N 2.96Å; L19-K22 WeakPolarHBondContact O-CB 3.36Å; L19-K22 PolarHBondContact O-N 3.45Å; L19-I23 HydrophobicContact CD1-CD1 4.19Å; L19-I23 HydrophobicContact CG-CD1 4.2Å; L19-I23 WeakPolarHBondContact O-CG1 3.31Å; L19-I23 PolarHBondContact O-N 3.24Å; L19-L32 HydrophobicContact CD1-CD1 3.59Å; L19-L32 HydrophobicContact CD1-CD2 3.63Å; L19-L32 HydrophobicContact CD1-CG 4.26Å; L19-T74 HydrophobicContact CD2-CG2 3.85Å; L19-T74 HydrophobicContact CG-CG2 4.3Å; L19-Y151 HydrophobicContact CB-CD2 3.91Å; L19-Y151 HydrophobicContact CB-CE2 4.22Å; L19-Y151 HydrophobicContact CB-CG 4.32Å; L19-Y151 HydrophobicContact CD1-CD1 4.27Å; L19-Y151 HydrophobicContact CD1-CE1 4.35Å; L19-Y151 HydrophobicContact CD1-CG 4.35Å; L19-Y151 HydrophobicContact CD2-CD2 4.42Å; L19-Y151 HydrophobicContact CD2-CE2 3.92Å; L19-Y151 HydrophobicContact CG-CE2 4.49Å
20V95.4Very high95.3Very high42 Ų4246.1 Ų46.126%0.25524%0.238SC..Hα-helixtrans-64.2-44.3-179.4173.80000110.7I16 I17 K22 I23 W24I16-V20 HydrophobicContact CG2-CG2 4.42Å; I16-V20 WeakPolarHBondContact O-CG2 3.33Å; I16-V20 PolarHBondContact O-N 2.75Å; I17-V20 PolarHBondContact O-N 2.91Å; V20-K22 VanDerWaalsContact C-N 3.34Å; V20-K22 PolarHBondContact O-N 3.25Å; V20-I23 PolarHBondContact O-N 2.98Å; V20-W24 VanDerWaalsContact O-CB 3.3Å; V20-W24 WeakPolarHBondContact O-CB 3.25Å; V20-W24 PolarHBondContact O-N 3.49Å
21L95Very high95.1Very high79 Ų7945.3 Ų45.341%0.41423%0.234SC..Hα-helixtrans-64.3-38.7176.9-72.1178.8000111.9I17 W24 K25I17-L21 HydrophobicContact CG2-CD1 3.56Å; I17-L21 HydrophobicContact CG2-CG 4.11Å; I17-L21 WeakPolarHBondContact O-CB 3.47Å; I17-L21 WeakPolarHBondContact O-CG 3.42Å; I17-L21 PolarHBondContact O-N 3.32Å; L21-W24 PolarHBondContact O-N 2.94Å; L21-K25 VanDerWaalsContact O-CB 3.24Å; L21-K25 WeakPolarHBondContact O-CB 3.32Å; L21-K25 WeakPolarHBondContact O-CG 3.47Å; L21-K25 PolarHBondContact O-N 2.96Å
22K94.7Very high95.1Very high6 Ų644.6 Ų44.63%0.02623%0.229CC..Hα-helixtrans-56.6-55.9174.8-178.3-90.9-173.1-173.20109.9I18 L19 V20 W24 T26 A30 L32 E145 I147I18-K22 WeakPolarHBondContact O-CB 3.31Å; I18-K22 PolarHBondContact O-N 2.92Å; L19-K22 WeakPolarHBondContact O-CB 3.36Å; L19-K22 PolarHBondContact O-N 3.45Å; V20-K22 VanDerWaalsContact C-N 3.34Å; V20-K22 PolarHBondContact O-N 3.25Å; K22-W24 VanDerWaalsContact C-N 3.33Å; K22-W24 PolarHBondContact O-N 3.16Å; K22-T26 WeakPolarHBondContact O-CB 3.32Å; K22-T26 WeakPolarHBondContact O-CG2 3.29Å; K22-T26 PolarHBondContact O-N 3.41Å; K22-T26 PolarHBondContact O-OG1 3.48Å; K22-A30 PolarHBondContact NZ-O 3.36Å; K22-L32 HydrophobicContact CD-CD1 4.2Å; K22-E145 WeakPolarHBondContact CE-OE2 3.41Å; K22-E145 IonicContact NZ-OE2 3.05Å; K22-E145 PolarHBondContact NZ-OE2 2.97Å; K22-I147 HydrophobicContact CB-CG2 3.69Å; K22-I147 HydrophobicContact CG-CB 4.09Å; K22-I147 HydrophobicContact CG-CG2 3.57Å
23I96Very high95.1Very high0 Ų044.1 Ų44.10%023%0.226CC..Hα-helixtrans-62.8-43-177.4-60.1164.3000110.7L19 V20 R27 S28 C29 L32 T74 L77 I78 F82L19-I23 HydrophobicContact CD1-CD1 4.19Å; L19-I23 HydrophobicContact CG-CD1 4.2Å; L19-I23 WeakPolarHBondContact O-CG1 3.31Å; L19-I23 PolarHBondContact O-N 3.24Å; V20-I23 PolarHBondContact O-N 2.98Å; I23-R27 VanDerWaalsContact O-CA 3.32Å; I23-R27 WeakPolarHBondContact O-CA 3.12Å; I23-R27 PolarHBondContact O-N 2.9Å; I23-S28 PolarHBondContact O-N 3.35Å; I23-C29 HydrophobicContact CG2-CB 4.5Å; I23-L32 HydrophobicContact CD1-CD1 3.65Å; I23-L32 HydrophobicContact CG1-CD1 3.49Å; I23-L32 VanDerWaalsContact CG1-CD1 3.49Å; I23-T74 HydrophobicContact CD1-CG2 3.88Å; I23-L77 HydrophobicContact CB-CD1 4.19Å; I23-L77 HydrophobicContact CG2-CB 3.77Å; I23-L77 HydrophobicContact CG2-CD1 3.92Å; I23-L77 HydrophobicContact CG2-CG 4.39Å; I23-I78 HydrophobicContact CD1-CG1 4.43Å; I23-F82 HydrophobicContact CG2-CD2 3.5Å; I23-F82 HydrophobicContact CG2-CE2 3.85Å
24W95Very high95.1Very high131 Ų13142.3 Ų42.350%0.49622%0.219SC..Hα-helixtrans-68.6-45.2-177.8-173.3-97.9000113.4V20 L21 K22 R27 L77V20-W24 VanDerWaalsContact O-CB 3.3Å; V20-W24 WeakPolarHBondContact O-CB 3.25Å; V20-W24 PolarHBondContact O-N 3.49Å; L21-W24 PolarHBondContact O-N 2.94Å; K22-W24 VanDerWaalsContact C-N 3.33Å; K22-W24 PolarHBondContact O-N 3.16Å; W24-R27 VanDerWaalsContact O-CD 3.27Å; W24-R27 WeakPolarHBondContact O-CD 3.44Å; W24-R27 PolarHBondContact O-NE 3.15Å; W24-L77 HydrophobicContact CE3-CD2 4.25Å; W24-L77 HydrophobicContact CZ3-CD2 4.43Å
25K95.2Very high95.2Very high161 Ų16143.9 Ų43.970%0.722%0.217SC*.Hα-helixtrans-73.6-41.9-178.1-72-173.8174.5-174.70112.3L21 R27L21-K25 VanDerWaalsContact O-CB 3.24Å; L21-K25 WeakPolarHBondContact O-CB 3.32Å; L21-K25 WeakPolarHBondContact O-CG 3.47Å; L21-K25 PolarHBondContact O-N 2.96Å; K25-R27 VanDerWaalsContact C-N 3.28Å; K25-R27 PolarHBondContact O-N 3.19Å
26T94.7Very high95.3Very high64 Ų6443.9 Ų43.939%0.39322%0.217SC..Hα-helixtrans-79.8-12179.363.80000112.9K22 S28K22-T26 WeakPolarHBondContact O-CB 3.32Å; K22-T26 WeakPolarHBondContact O-CG2 3.29Å; K22-T26 PolarHBondContact O-N 3.41Å; K22-T26 PolarHBondContact O-OG1 3.48Å; T26-S28 PolarHBondContact O-N 2.97Å; T26-S28 VanDerWaalsContact O-N 3.13Å; T26-S28 PolarHBondContact OG1-N 3.46Å; T26-S28 PolarHBondContact OG1-O 3.12Å
27R95.6Very high95.4Very high120 Ų12043.3 Ų43.345%0.45321%0.214SC..THydrogen-bonded Turntrans53.428.3-173-55.5-65.7-171.7-177.25.5112.4I23 W24 K25 F82I23-R27 VanDerWaalsContact O-CA 3.32Å; I23-R27 WeakPolarHBondContact O-CA 3.12Å; I23-R27 PolarHBondContact O-N 2.9Å; W24-R27 VanDerWaalsContact O-CD 3.27Å; W24-R27 WeakPolarHBondContact O-CD 3.44Å; W24-R27 PolarHBondContact O-NE 3.15Å; K25-R27 VanDerWaalsContact C-N 3.28Å; K25-R27 PolarHBondContact O-N 3.19Å; R27-F82 HydrophobicContact CB-CD1 4.3Å; R27-F82 HydrophobicContact CB-CE1 3.76Å; R27-F82 HydrophobicContact CB-CZ 4.23Å; R27-F82 HydrophobicContact CG-CE1 4.33Å; R27-F82 WeakPolarHBondContact O-CD1 3.07Å
28S94.3Very high95.6Very high23 Ų2341.4 Ų41.416%0.16121%0.205CC..  trans-144.6137.5-172.8178.10000111.5I23 T26 A30 T85I23-S28 PolarHBondContact O-N 3.35Å; T26-S28 PolarHBondContact O-N 2.97Å; T26-S28 VanDerWaalsContact O-N 3.13Å; T26-S28 PolarHBondContact OG1-N 3.46Å; T26-S28 PolarHBondContact OG1-O 3.12Å; S28-A30 WeakPolarHBondContact OG-CB 3.5Å; S28-A30 PolarHBondContact OG-N 3.14Å; S28-A30 VanDerWaalsContact OG-N 3.14Å; S28-T85 WeakPolarHBondContact CA-OG1 3.38Å; S28-T85 WeakPolarHBondContact OG-CB 3.38Å
29C94.4Very high95.7Very high0 Ų039.3 Ų39.30%019%0.194CC..  trans-104.717.3169.159.40000113I23 G31 L32 I78 F82 T85I23-C29 HydrophobicContact CG2-CB 4.5Å; C29-G31 PolarHBondContact O-N 2.82Å; C29-L32 HydrophobicContact CB-CD1 4.38Å; C29-L32 WeakPolarHBondContact O-CB 3.35Å; C29-L32 PolarHBondContact O-N 2.76Å; C29-I78 HydrophobicContact CB-CG1 3.89Å; C29-F82 PolarHBondContact SG-O 3.24Å; C29-F82 VanDerWaalsContact SG-O 3.38Å; C29-T85 PolarHBondContact N-OG1 2.67Å; C29-T85 PolarHBondContact SG-OG1 2.94Å
30A92.3Very high95.8Very high32 Ų3239.3 Ų39.326%0.26419%0.193SC..THydrogen-bonded Turntrans-53.5139.3174.800000111.6K22 S28 L32 T85K22-A30 PolarHBondContact NZ-O 3.36Å; S28-A30 WeakPolarHBondContact OG-CB 3.5Å; S28-A30 PolarHBondContact OG-N 3.14Å; S28-A30 VanDerWaalsContact OG-N 3.14Å; A30-L32 PolarHBondContact O-N 3.16Å; A30-T85 WeakPolarHBondContact CA-O 3.41Å; A30-T85 PolarHBondContact N-O 3.37Å
31G91.6Very high95.9Very high27 Ų2737.4 Ų37.428%0.27818%0.182SC..THydrogen-bonded Turntrans73.92.3-178.900000115.9C29 Q134 L137C29-G31 PolarHBondContact O-N 2.82Å; G31-Q134 PolarHBondContact O-NE2 3.16Å; G31-L137 WeakPolarHBondContact O-CD2 3.35Å
32L95.3Very high96.1Very high4 Ų436 Ų362%0.02118%0.175CC..  trans-102.6131.6176.5-61.4174.4000111.3L19 K22 I23 C29 A30 G34 T148L19-L32 HydrophobicContact CD1-CD1 3.59Å; L19-L32 HydrophobicContact CD1-CD2 3.63Å; L19-L32 HydrophobicContact CD1-CG 4.26Å; K22-L32 HydrophobicContact CD-CD1 4.2Å; I23-L32 HydrophobicContact CD1-CD1 3.65Å; I23-L32 HydrophobicContact CG1-CD1 3.49Å; I23-L32 VanDerWaalsContact CG1-CD1 3.49Å; C29-L32 HydrophobicContact CB-CD1 4.38Å; C29-L32 WeakPolarHBondContact O-CB 3.35Å; C29-L32 PolarHBondContact O-N 2.76Å; A30-L32 PolarHBondContact O-N 3.16Å; L32-G34 PolarHBondContact O-N 2.88Å; L32-T148 HydrophobicContact CD2-CG2 3.81Å
33S96.6Very high96.3Very high0 Ų035.8 Ų35.80%017%0.174CC..  trans-78.8114.8172.6172.70000110R35 S36 Q37 D91 P133S33-R35 PolarHBondContact O-N 2.86Å; S33-R35 PolarHBondContact OG-N 3.44Å; S33-S36 PolarHBondContact O-N 3.43Å; S33-S36 PolarHBondContact OG-N 3.47Å; S33-S36 VanDerWaalsContact OG-N 3.16Å; S33-Q37 WeakPolarHBondContact O-CG 3.37Å; S33-Q37 PolarHBondContact O-N 3.48Å; S33-D91 WeakPolarHBondContact CA-OD2 3.17Å; S33-D91 WeakPolarHBondContact CB-OD2 3.43Å; S33-D91 VanDerWaalsContact OG-CG 3.28Å; S33-D91 PolarHBondContact OG-OD1 2.97Å; S33-D91 PolarHBondContact OG-OD2 3.41Å; S33-P133 VanDerWaalsContact OG-CB 3.27Å; S33-P133 WeakPolarHBondContact OG-CB 3.5Å
34G97.2Very high96.3Very high0 Ų036 Ų360%018%0.175CC..Hα-helixtrans-65.3-32.7172.700000111L32 Q37 I38 Y79 D91L32-G34 PolarHBondContact O-N 2.88Å; G34-Q37 PolarHBondContact O-N 2.95Å; G34-Q37 VanDerWaalsContact O-N 3.16Å; G34-I38 WeakPolarHBondContact O-CG1 3.38Å; G34-I38 PolarHBondContact O-N 3.23Å; G34-Y79 VanDerWaalsContact CA-OH 3.28Å; G34-Y79 WeakPolarHBondContact CA-OH 3.23Å; G34-Y79 PolarHBondContact O-OH 3.45Å; G34-D91 PolarHBondContact N-OD2 3.48Å
35R97.7Very high96.5Very high67 Ų6732.2 Ų32.225%0.25317%0.166SC..Hα-helixtrans-66.5-38.5177.6-66.1-156-170.790.5-0.4113.9S33 Q37 I38 A39 Y79 D91 F93 P133S33-R35 PolarHBondContact O-N 2.86Å; S33-R35 PolarHBondContact OG-N 3.44Å; R35-Q37 VanDerWaalsContact C-N 3.31Å; R35-I38 PolarHBondContact O-N 2.99Å; R35-A39 PolarHBondContact O-N 3.34Å; R35-Y79 PolarHBondContact N-OH 3.27Å; R35-D91 VanDerWaalsContact CZ-O 3.27Å; R35-D91 IonicContact CZ-OD1 2.69Å; R35-D91 PolarHBondContact N-OD2 2.86Å; R35-D91 VanDerWaalsContact N-OD2 3.17Å; R35-D91 PolarHBondContact NH1-O 3.44Å; R35-D91 IonicContact NH1-OD1 3.68Å; R35-D91 PolarHBondContact NH1-OD1 2.63Å; R35-D91 PolarHBondContact NH2-O 2.92Å; R35-D91 VanDerWaalsContact NH2-O 3.16Å; R35-F93 WeakPolarHBondContact CD-O 3.49Å; R35-F93 VanDerWaalsContact CZ-O 3.25Å; R35-F93 PolarHBondContact NE-O 3.05Å; R35-F93 PolarHBondContact NH1-O 3.33Å; R35-P133 HydrophobicContact CB-CB 3.9Å; R35-P133 HydrophobicContact CB-CG 4.2Å
36S97.6Very high96.6Very high0 Ų025.6 Ų25.60%014%0.139CC..Hα-helixtrans-61.7-41.4170.4-860000111.5S33 I38 A39 F40 A130 P133 Q134S33-S36 PolarHBondContact O-N 3.43Å; S33-S36 PolarHBondContact OG-N 3.47Å; S33-S36 VanDerWaalsContact OG-N 3.16Å; S36-I38 VanDerWaalsContact C-N 3.32Å; S36-I38 PolarHBondContact O-N 3.18Å; S36-A39 WeakPolarHBondContact O-CB 3.47Å; S36-A39 PolarHBondContact O-N 2.88Å; S36-F40 WeakPolarHBondContact O-CD2 3.36Å; S36-F40 PolarHBondContact O-N 3.28Å; S36-A130 WeakPolarHBondContact CA-O 3.37Å; S36-A130 VanDerWaalsContact CB-O 3.31Å; S36-A130 WeakPolarHBondContact CB-O 3.43Å; S36-A130 PolarHBondContact OG-O 3.13Å; S36-P133 WeakPolarHBondContact OG-CB 3.31Å; S36-P133 WeakPolarHBondContact OG-CD 3.39Å; S36-Q134 WeakPolarHBondContact OG-CB 3.41Å; S36-Q134 PolarHBondContact OG-N 2.9Å
37Q98Very high96.8Very high9 Ų924 Ų244%0.04213%0.126CC..Hα-helixtrans-66-34.3177.2-58-50-46.700112.3S33 G34 R35 F40 A41 T74 L75 I78 Y151S33-Q37 WeakPolarHBondContact O-CG 3.37Å; S33-Q37 PolarHBondContact O-N 3.48Å; G34-Q37 PolarHBondContact O-N 2.95Å; G34-Q37 VanDerWaalsContact O-N 3.16Å; R35-Q37 VanDerWaalsContact C-N 3.31Å; Q37-F40 PolarHBondContact O-N 3.48Å; Q37-A41 WeakPolarHBondContact O-CB 3.37Å; Q37-A41 PolarHBondContact O-N 3.39Å; Q37-T74 HydrophobicContact CB-CG2 4.42Å; Q37-T74 HydrophobicContact CG-CG2 3.9Å; Q37-L75 HydrophobicContact CB-CD2 3.79Å; Q37-I78 HydrophobicContact CB-CD1 4.19Å; Q37-I78 HydrophobicContact CG-CD1 3.64Å; Q37-Y151 PolarHBondContact NE2-OH 3.18Å; Q37-Y151 VanDerWaalsContact NE2-OH 3.12Å
38I98.4Very high96.8Very high54 Ų5419.7 Ų19.728%0.27711%0.11SC..Hα-helixtrans-62.3-46.4172.3-69.1170.2000109.8G34 R35 S36 F40 A41 I42 L75 Y79 L95G34-I38 WeakPolarHBondContact O-CG1 3.38Å; G34-I38 PolarHBondContact O-N 3.23Å; R35-I38 PolarHBondContact O-N 2.99Å; S36-I38 VanDerWaalsContact C-N 3.32Å; S36-I38 PolarHBondContact O-N 3.18Å; I38-F40 PolarHBondContact O-N 3.03Å; I38-A41 PolarHBondContact O-N 3.41Å; I38-I42 HydrophobicContact CG2-CD1 3.88Å; I38-I42 HydrophobicContact CG2-CG1 4.5Å; I38-I42 WeakPolarHBondContact O-CG1 3.33Å; I38-I42 PolarHBondContact O-N 3.25Å; I38-L75 HydrophobicContact CB-CD2 4.41Å; I38-L75 HydrophobicContact CG1-CD2 3.57Å; I38-Y79 HydrophobicContact CD1-CE2 3.82Å; I38-Y79 WeakPolarHBondContact CD1-OH 3.47Å; I38-Y79 HydrophobicContact CG1-CE2 3.99Å; I38-L95 HydrophobicContact CB-CD2 4.25Å; I38-L95 HydrophobicContact CG2-CD2 3.68Å
39A98.4Very high96.9Very high0 Ų020.9 Ų20.90%012%0.116CC..Hα-helixtrans-58.8-47.1177.600000111.8R35 S36 A41 I42 V43 L95 A130R35-A39 PolarHBondContact O-N 3.34Å; S36-A39 WeakPolarHBondContact O-CB 3.47Å; S36-A39 PolarHBondContact O-N 2.88Å; A39-A41 PolarHBondContact O-N 3.44Å; A39-I42 PolarHBondContact O-N 2.88Å; A39-V43 WeakPolarHBondContact O-CG2 3.38Å; A39-V43 PolarHBondContact O-N 2.94Å; A39-L95 HydrophobicContact CB-CD1 3.98Å; A39-A130 HydrophobicContact CB-CB 3.7Å
40F98Very high96.8Very high6 Ų622.9 Ų22.93%0.02613%0.126CC..Hα-helixtrans-64.1-37.7177-73.6-59.4000113.3S36 Q37 I38 V43 F44 E127 A130 I131 L155S36-F40 WeakPolarHBondContact O-CD2 3.36Å; S36-F40 PolarHBondContact O-N 3.28Å; Q37-F40 PolarHBondContact O-N 3.48Å; I38-F40 PolarHBondContact O-N 3.03Å; F40-V43 WeakPolarHBondContact O-CB 3.47Å; F40-V43 PolarHBondContact O-N 3.3Å; F40-F44 HydrophobicContact CB-CE2 4.44Å; F40-F44 VanDerWaalsContact O-CD2 3.3Å; F40-F44 WeakPolarHBondContact O-CD2 3.32Å; F40-F44 PolarHBondContact O-N 2.98Å; F40-E127 HydrophobicContact CE1-CG 4.33Å; F40-A130 HydrophobicContact CD1-CB 3.86Å; F40-A130 HydrophobicContact CD2-CB 4.46Å; F40-A130 HydrophobicContact CE1-CB 3.61Å; F40-A130 HydrophobicContact CE2-CB 4.24Å; F40-A130 HydrophobicContact CG-CB 4.27Å; F40-A130 HydrophobicContact CZ-CB 3.8Å; F40-I131 HydrophobicContact CE2-CD1 4.04Å; F40-I131 HydrophobicContact CZ-CB 4.39Å; F40-I131 HydrophobicContact CZ-CD1 4.24Å; F40-L155 HydrophobicContact CE2-CD2 3.99Å; F40-L155 HydrophobicContact CZ-CD2 3.76Å
41A98.4Very high96.8Very high3 Ų323.6 Ų23.63%0.02513%0.126CC..Hα-helixtrans-62.5-4417400000111.4Q37 I38 A39 V43 F44 T45 L75Q37-A41 WeakPolarHBondContact O-CB 3.37Å; Q37-A41 PolarHBondContact O-N 3.39Å; I38-A41 PolarHBondContact O-N 3.41Å; A39-A41 PolarHBondContact O-N 3.44Å; A41-V43 VanDerWaalsContact C-N 3.33Å; A41-V43 PolarHBondContact O-N 3.28Å; A41-F44 PolarHBondContact O-N 2.8Å; A41-T45 WeakPolarHBondContact O-CB 3.34Å; A41-T45 PolarHBondContact O-N 3.35Å; A41-T45 PolarHBondContact O-OG1 2.95Å; A41-L75 HydrophobicContact CB-CD1 3.56Å; A41-L75 HydrophobicContact CB-CG 4.45Å
42I98.5Very high96.8Very high50 Ų5029.8 Ų29.826%0.25615%0.152SC..Hα-helixtrans-60.6-43.1174.6-66.7167.6000110.8I38 A39 T45 T46 L99 F122 L126I38-I42 HydrophobicContact CG2-CD1 3.88Å; I38-I42 HydrophobicContact CG2-CG1 4.5Å; I38-I42 WeakPolarHBondContact O-CG1 3.33Å; I38-I42 PolarHBondContact O-N 3.25Å; A39-I42 PolarHBondContact O-N 2.88Å; I42-T45 PolarHBondContact O-N 3.07Å; I42-T46 HydrophobicContact CG2-CG2 4.3Å; I42-T46 WeakPolarHBondContact O-CB 3.45Å; I42-T46 WeakPolarHBondContact O-CG2 3.43Å; I42-T46 PolarHBondContact O-N 3.34Å; I42-T46 PolarHBondContact O-OG1 3.25Å; I42-L99 HydrophobicContact CD1-CD1 4.31Å; I42-L99 HydrophobicContact CD1-CD2 3.93Å; I42-L99 HydrophobicContact CG2-CD2 4.45Å; I42-F122 HydrophobicContact CG2-CE1 3.69Å; I42-F122 HydrophobicContact CG2-CZ 4.12Å; I42-L126 HydrophobicContact CB-CD2 3.99Å; I42-L126 HydrophobicContact CG2-CD2 3.59Å
43V98.5Very high96.6Very high0 Ų034.4 Ų34.40%018%0.18CC..Hα-helixtrans-55.2-54.2175.6166.10000110.8A39 F40 A41 T45 T46 R47 L126 E127A39-V43 WeakPolarHBondContact O-CG2 3.38Å; A39-V43 PolarHBondContact O-N 2.94Å; F40-V43 WeakPolarHBondContact O-CB 3.47Å; F40-V43 PolarHBondContact O-N 3.3Å; A41-V43 VanDerWaalsContact C-N 3.33Å; A41-V43 PolarHBondContact O-N 3.28Å; V43-T45 PolarHBondContact O-N 3Å; V43-T46 PolarHBondContact O-N 2.85Å; V43-T46 PolarHBondContact O-OG1 3.19Å; V43-R47 WeakPolarHBondContact O-CB 3.45Å; V43-R47 PolarHBondContact O-N 3.36Å; V43-L126 HydrophobicContact CG2-CB 3.92Å; V43-L126 HydrophobicContact CG2-CD2 3.84Å; V43-L126 HydrophobicContact CG2-CG 3.72Å; V43-E127 HydrophobicContact CG1-CB 3.82Å; V43-E127 HydrophobicContact CG1-CG 4.15Å; V43-E127 HydrophobicContact CG2-CB 3.89Å
44F97.7Very high96.3Very high6 Ų637.2 Ų37.23%0.02620%0.2CC..Hα-helixtrans-68.2-37.8-176.4-62-40.1000112.5H12 F40 A41 Y48 F67 I68H12-F44 AromaticContact CE1-CE1 3.77Å; H12-F44 AromaticContact CE1-CZ 3.59Å; H12-F44 AromaticContact NE2-CZ 3.57Å; F40-F44 HydrophobicContact CB-CE2 4.44Å; F40-F44 VanDerWaalsContact O-CD2 3.3Å; F40-F44 WeakPolarHBondContact O-CD2 3.32Å; F40-F44 PolarHBondContact O-N 2.98Å; A41-F44 PolarHBondContact O-N 2.8Å; F44-Y48 HydrophobicContact CB-CD2 3.91Å; F44-Y48 HydrophobicContact CB-CE2 3.83Å; F44-Y48 HydrophobicContact CD1-CD2 4.39Å; F44-Y48 AromaticContact CD1-CE2 3.5Å; F44-Y48 HydrophobicContact CD1-CE2 3.5Å; F44-Y48 AromaticContact CD1-CZ 3.94Å; F44-Y48 HydrophobicContact CE1-CE2 4.4Å; F44-Y48 AromaticContact CG-CE2 3.92Å; F44-Y48 HydrophobicContact CG-CE2 3.92Å; F44-Y48 VanDerWaalsContact O-CB 3.3Å; F44-Y48 WeakPolarHBondContact O-CB 3.49Å; F44-Y48 VanDerWaalsContact O-CD2 3.22Å; F44-Y48 WeakPolarHBondContact O-CD2 3.38Å; F44-Y48 PolarHBondContact O-N 3.07Å; F44-F67 HydrophobicContact CD1-CB 4.25Å; F44-F67 HydrophobicContact CD2-CB 4.15Å; F44-F67 HydrophobicContact CE1-CB 4.46Å; F44-F67 HydrophobicContact CE1-CD1 4.35Å; F44-F67 HydrophobicContact CE1-CG 4.48Å; F44-F67 HydrophobicContact CE2-CB 4.35Å; F44-F67 HydrophobicContact CE2-CD1 4.35Å; F44-F67 HydrophobicContact CG-CB 4.11Å; F44-F67 HydrophobicContact CZ-CD1 4.04Å; F44-I68 HydrophobicContact CB-CG1 4.25Å
45T98.1Very high96.1Very high51 Ų5145.1 Ų45.131%0.31323%0.231SC..Hα-helixtrans-62.4-44.6176.3-63.20000111.7A41 I42 V43 V49 Y72A41-T45 WeakPolarHBondContact O-CB 3.34Å; A41-T45 PolarHBondContact O-N 3.35Å; A41-T45 PolarHBondContact O-OG1 2.95Å; I42-T45 PolarHBondContact O-N 3.07Å; V43-T45 PolarHBondContact O-N 3Å; T45-V49 WeakPolarHBondContact O-CG2 3.22Å; T45-Y72 WeakPolarHBondContact OG1-CE2 3.33Å; T45-Y72 PolarHBondContact OG1-OH 3.09Å
46T97.9Very high95.7Very high21 Ų2146.8 Ų46.813%0.12925%0.248CC..Hα-helixtrans-76.6-34.5-179.652.80000113I42 V43 L119 F122 S123I42-T46 HydrophobicContact CG2-CG2 4.3Å; I42-T46 WeakPolarHBondContact O-CB 3.45Å; I42-T46 WeakPolarHBondContact O-CG2 3.43Å; I42-T46 PolarHBondContact O-N 3.34Å; I42-T46 PolarHBondContact O-OG1 3.25Å; V43-T46 PolarHBondContact O-N 2.85Å; V43-T46 PolarHBondContact O-OG1 3.19Å; T46-L119 HydrophobicContact CG2-CD2 4.08Å; T46-F122 HydrophobicContact CG2-CD1 3.96Å; T46-F122 HydrophobicContact CG2-CE1 3.99Å; T46-S123 WeakPolarHBondContact OG1-CB 3.35Å
47R97.7Very high95.5Very high32 Ų3248.9 Ų48.912%0.12126%0.263CS..Hα-helixtrans-69.8-38.4179-170.6170.1-67.8171.3-2.1113.4V43 S123 E127V43-R47 WeakPolarHBondContact O-CB 3.45Å; V43-R47 PolarHBondContact O-N 3.36Å; R47-S123 WeakPolarHBondContact CB-OG 3.34Å; R47-S123 PolarHBondContact NE-OG 2.93Å; R47-S123 PolarHBondContact NH2-O 3.34Å; R47-E127 IonicContact CZ-OE1 2.76Å; R47-E127 IonicContact CZ-OE2 3.77Å; R47-E127 IonicContact NH1-OE1 2.76Å; R47-E127 PolarHBondContact NH1-OE1 3.48Å; R47-E127 IonicContact NH1-OE2 3.8Å; R47-E127 PolarHBondContact NH1-OE2 3.35Å; R47-E127 VanDerWaalsContact NH2-CD 3.27Å; R47-E127 IonicContact NH2-OE1 3.84Å; R47-E127 IonicContact NH2-OE2 3.43Å; R47-E127 PolarHBondContact NH2-OE2 3.09Å
48Y96.7Very high95.3Very high29 Ų2953.8 Ų53.811%0.11429%0.288CS..THydrogen-bonded Turntrans-103.419.5-169.1-55.6-35.7000113.2F44 D50 L51 K64 F67 I68F44-Y48 HydrophobicContact CB-CD2 3.91Å; F44-Y48 HydrophobicContact CB-CE2 3.83Å; F44-Y48 HydrophobicContact CD1-CD2 4.39Å; F44-Y48 AromaticContact CD1-CE2 3.5Å; F44-Y48 HydrophobicContact CD1-CE2 3.5Å; F44-Y48 AromaticContact CD1-CZ 3.94Å; F44-Y48 HydrophobicContact CE1-CE2 4.4Å; F44-Y48 AromaticContact CG-CE2 3.92Å; F44-Y48 HydrophobicContact CG-CE2 3.92Å; F44-Y48 VanDerWaalsContact O-CB 3.3Å; F44-Y48 WeakPolarHBondContact O-CB 3.49Å; F44-Y48 VanDerWaalsContact O-CD2 3.22Å; F44-Y48 WeakPolarHBondContact O-CD2 3.38Å; F44-Y48 PolarHBondContact O-N 3.07Å; Y48-D50 WeakPolarHBondContact CA-OD1 3.35Å; Y48-D50 PolarHBondContact O-N 3.41Å; Y48-L51 VanDerWaalsContact O-CB 3.25Å; Y48-L51 WeakPolarHBondContact O-CB 3.49Å; Y48-L51 WeakPolarHBondContact O-CG 3.29Å; Y48-L51 PolarHBondContact O-N 3.48Å; Y48-K64 HydrophobicContact CD1-CB 4.24Å; Y48-K64 HydrophobicContact CD1-CD 3.67Å; Y48-K64 HydrophobicContact CD1-CG 3.54Å; Y48-K64 HydrophobicContact CD2-CB 3.91Å; Y48-K64 HydrophobicContact CD2-CG 4.08Å; Y48-K64 HydrophobicContact CE1-CD 4.3Å; Y48-K64 HydrophobicContact CE1-CG 3.78Å; Y48-K64 HydrophobicContact CE2-CB 4.33Å; Y48-K64 HydrophobicContact CE2-CG 4.3Å; Y48-K64 HydrophobicContact CG-CB 3.87Å; Y48-K64 HydrophobicContact CG-CD 3.93Å; Y48-K64 HydrophobicContact CG-CG 3.71Å; Y48-F67 HydrophobicContact CE2-CB 3.71Å; Y48-F67 HydrophobicContact CE2-CD2 4.18Å; Y48-F67 HydrophobicContact CE2-CG 4.24Å; Y48-I68 HydrophobicContact CD2-CD1 4.23Å; Y48-I68 HydrophobicContact CD2-CG1 3.97Å
49V95.3Very high95Very high48 Ų4856.2 Ų56.229%0.29130%0.295SS..G310 helixtrans-55.9-29169.7176.60000111.3T45 L51 L52 L119T45-V49 WeakPolarHBondContact O-CG2 3.22Å; V49-L51 PolarHBondContact O-N 2.93Å; V49-L51 VanDerWaalsContact O-N 3.14Å; V49-L52 PolarHBondContact O-N 3.17Å; V49-L52 VanDerWaalsContact O-N 3.13Å; V49-L119 HydrophobicContact CG2-CD1 4.07Å
50D93.3Very high94.7Very high41 Ų4157.7 Ų57.722%0.21930%0.303CS..G310 helixtrans-62.8-12.6174.972.1-21.6000114.2Y48 L52 T53 S54 K64Y48-D50 WeakPolarHBondContact CA-OD1 3.35Å; Y48-D50 PolarHBondContact O-N 3.41Å; D50-L52 PolarHBondContact O-N 3.24Å; D50-L52 VanDerWaalsContact O-N 3.17Å; D50-T53 PolarHBondContact O-N 3.11Å; D50-T53 PolarHBondContact O-OG1 3.14Å; D50-S54 PolarHBondContact O-N 3.41Å; D50-K64 IonicContact OD1-NZ 3.15Å; D50-K64 PolarHBondContact OD1-NZ 2.92Å; D50-K64 IonicContact OD2-NZ 3.37Å; D50-K64 PolarHBondContact OD2-NZ 3.45Å
51L92.8Very high94.6Very high48 Ų4858.3 Ų58.325%0.25131%0.308SS..G310 helixtrans-55.5-28.1168.5-82.7174.4000112.7Y48 V49 K64 I65 I68Y48-L51 VanDerWaalsContact O-CB 3.25Å; Y48-L51 WeakPolarHBondContact O-CB 3.49Å; Y48-L51 WeakPolarHBondContact O-CG 3.29Å; Y48-L51 PolarHBondContact O-N 3.48Å; V49-L51 PolarHBondContact O-N 2.93Å; V49-L51 VanDerWaalsContact O-N 3.14Å; L51-K64 HydrophobicContact CD1-CB 3.75Å; L51-K64 HydrophobicContact CD1-CD 4.37Å; L51-K64 HydrophobicContact CD2-CB 3.93Å; L51-K64 HydrophobicContact CD2-CD 3.66Å; L51-K64 HydrophobicContact CD2-CG 4.44Å; L51-K64 HydrophobicContact CG-CB 4.01Å; L51-K64 HydrophobicContact CG-CD 3.73Å; L51-I65 HydrophobicContact CD1-CG1 4.28Å; L51-I68 HydrophobicContact CD1-CD1 3.8Å
52L90.8Very high94.4Very high157 Ų15762.4 Ų62.482%0.82233%0.329SS*.G310 helixtrans-83.2-14.5-179.6-57.5178.8000113V49 D50V49-L52 PolarHBondContact O-N 3.17Å; V49-L52 VanDerWaalsContact O-N 3.13Å; D50-L52 PolarHBondContact O-N 3.24Å; D50-L52 VanDerWaalsContact O-N 3.17Å
53T90.2Very high94.2Very high101 Ų10160.5 Ų60.562%0.6232%0.321SS*.THydrogen-bonded Turntrans-123.9-26.7-170.4620000113.8D50D50-T53 PolarHBondContact O-N 3.11Å; D50-T53 PolarHBondContact O-OG1 3.14Å
54S90.3Very high94.1Very high58 Ų5861.1 Ų61.141%0.40632%0.323SS..  trans-135.3124.7-167.3-58.40000111.8D50D50-S54 PolarHBondContact O-N 3.41Å
55Y92.9Very high94.1Very high167 Ų16765.2 Ų65.266%0.65534%0.344SS*.  trans-104.6116.6170.1179-101.4000110.3L58Y55-L58 PolarHBondContact OH-N 3.19Å
56V90.8Very high94Very high102 Ų10266.8 Ų66.862%0.61835%0.35SS*.  trans-97.1-51.6177.4-179.80000111N60V56-N60 HydrophobicContact CB-CB 4.22Å
57S92.9Very high93.9Very high44 Ų4466.2 Ų66.231%0.30835%0.346SS..  trans-169.1159.9177.960.60000110.1Y59 N60 S61S57-Y59 VanDerWaalsContact C-N 3.29Å; S57-Y59 PolarHBondContact O-N 3.35Å; S57-N60 PolarHBondContact O-N 3.05Å; S57-N60 VanDerWaalsContact O-N 3.1Å; S57-N60 WeakPolarHBondContact OG-CB 3.47Å; S57-N60 PolarHBondContact OG-N 3.26Å; S57-S61 PolarHBondContact O-N 3.11Å; S57-S61 PolarHBondContact O-OG 2.61Å
58L93.6Very high93.9Very high111 Ų11166.8 Ų66.858%0.58135%0.351SS*.Hα-helixtrans-55.6-45.1176.2-178.963.8000111.7Y55 N60 S61 L62Y55-L58 PolarHBondContact OH-N 3.19Å; L58-N60 VanDerWaalsContact C-N 3.35Å; L58-N60 PolarHBondContact O-N 3.18Å; L58-S61 PolarHBondContact O-N 3.38Å; L58-L62 HydrophobicContact CD1-CD1 3.93Å; L58-L62 HydrophobicContact CD1-CG 4.02Å; L58-L62 HydrophobicContact CG-CD1 3.87Å; L58-L62 HydrophobicContact CG-CG 4.33Å; L58-L62 WeakPolarHBondContact O-CB 3.29Å; L58-L62 WeakPolarHBondContact O-CG 3.45Å; L58-L62 PolarHBondContact O-N 3.34Å
59Y92.1Very high94Very high105 Ų10572.7 Ų72.741%0.41238%0.378SS..Hα-helixtrans-57-47.1176.3173.5-96.4000111.8M1 S57 A63M1-Y59 HydrophobicContact CE-CE1 4.21Å; S57-Y59 VanDerWaalsContact C-N 3.29Å; S57-Y59 PolarHBondContact O-N 3.35Å; Y59-A63 WeakPolarHBondContact O-CB 3.41Å; Y59-A63 PolarHBondContact O-N 3.12Å
60N92.3Very high94.1Very high32 Ų3271 Ų7117%0.17137%0.368CS..Hα-helixtrans-65-45.9-179.2-176.6-100000112V56 S57 L58 A63 K64V56-N60 HydrophobicContact CB-CB 4.22Å; S57-N60 PolarHBondContact O-N 3.05Å; S57-N60 VanDerWaalsContact O-N 3.1Å; S57-N60 WeakPolarHBondContact OG-CB 3.47Å; S57-N60 PolarHBondContact OG-N 3.26Å; L58-N60 VanDerWaalsContact C-N 3.35Å; L58-N60 PolarHBondContact O-N 3.18Å; N60-A63 PolarHBondContact O-N 2.85Å; N60-K64 WeakPolarHBondContact O-CG 3.48Å; N60-K64 PolarHBondContact O-N 3.31Å; N60-K64 VanDerWaalsContact O-N 3.09Å; N60-K64 WeakPolarHBondContact OD1-CE 3.35Å; N60-K64 PolarHBondContact OD1-NZ 2.98Å
61S95Very high94.3Very high19 Ų1969.3 Ų69.313%0.13336%0.359CS..Hα-helixtrans-63.7-46.6179.1-630000111.8S57 L58 A63 K64 I65S57-S61 PolarHBondContact O-N 3.11Å; S57-S61 PolarHBondContact O-OG 2.61Å; L58-S61 PolarHBondContact O-N 3.38Å; S61-A63 PolarHBondContact O-N 2.85Å; S61-K64 PolarHBondContact O-N 2.83Å; S61-I65 WeakPolarHBondContact O-CG1 3.4Å; S61-I65 PolarHBondContact O-N 3.36Å
62L95.2Very high94.5Very high88 Ų8872.4 Ų72.446%0.46137%0.368SS..Hα-helixtrans-61.8-42.7176.7-72.3177.1000112L58 K64 I65 I66L58-L62 HydrophobicContact CD1-CD1 3.93Å; L58-L62 HydrophobicContact CD1-CG 4.02Å; L58-L62 HydrophobicContact CG-CD1 3.87Å; L58-L62 HydrophobicContact CG-CG 4.33Å; L58-L62 WeakPolarHBondContact O-CB 3.29Å; L58-L62 WeakPolarHBondContact O-CG 3.45Å; L58-L62 PolarHBondContact O-N 3.34Å; L62-K64 PolarHBondContact O-N 3.09Å; L62-I65 PolarHBondContact O-N 2.95Å; L62-I66 VanDerWaalsContact O-CG1 3.26Å; L62-I66 WeakPolarHBondContact O-CG1 3.38Å; L62-I66 PolarHBondContact O-N 3.44Å
63A94.9Very high94.9Very high10 Ų1066.3 Ų66.38%0.08334%0.34CS..Hα-helixtrans-57.1-50.5177.200000111.6F13 Y59 N60 S61 I65 I66 F67F13-A63 HydrophobicContact CE2-CB 4.33Å; F13-A63 HydrophobicContact CZ-CB 3.67Å; Y59-A63 WeakPolarHBondContact O-CB 3.41Å; Y59-A63 PolarHBondContact O-N 3.12Å; N60-A63 PolarHBondContact O-N 2.85Å; S61-A63 PolarHBondContact O-N 2.85Å; A63-I65 PolarHBondContact O-N 3.42Å; A63-I66 PolarHBondContact O-N 3.02Å; A63-F67 HydrophobicContact CB-CD2 4.49Å; A63-F67 HydrophobicContact CB-CE2 4.24Å; A63-F67 WeakPolarHBondContact O-CD2 3.27Å; A63-F67 WeakPolarHBondContact O-CG 3.3Å; A63-F67 PolarHBondContact O-N 3.49Å
64K96.3Very high95.2Very high13 Ų1361.6 Ų61.66%0.05731%0.311CS..Hα-helixtrans-59.7-43.6178.4-67.2178.2175.6179.20112.2Y48 D50 L51 N60 S61 L62 I66 F67 I68Y48-K64 HydrophobicContact CD1-CB 4.24Å; Y48-K64 HydrophobicContact CD1-CD 3.67Å; Y48-K64 HydrophobicContact CD1-CG 3.54Å; Y48-K64 HydrophobicContact CD2-CB 3.91Å; Y48-K64 HydrophobicContact CD2-CG 4.08Å; Y48-K64 HydrophobicContact CE1-CD 4.3Å; Y48-K64 HydrophobicContact CE1-CG 3.78Å; Y48-K64 HydrophobicContact CE2-CB 4.33Å; Y48-K64 HydrophobicContact CE2-CG 4.3Å; Y48-K64 HydrophobicContact CG-CB 3.87Å; Y48-K64 HydrophobicContact CG-CD 3.93Å; Y48-K64 HydrophobicContact CG-CG 3.71Å; D50-K64 IonicContact OD1-NZ 3.15Å; D50-K64 PolarHBondContact OD1-NZ 2.92Å; D50-K64 IonicContact OD2-NZ 3.37Å; D50-K64 PolarHBondContact OD2-NZ 3.45Å; L51-K64 HydrophobicContact CD1-CB 3.75Å; L51-K64 HydrophobicContact CD1-CD 4.37Å; L51-K64 HydrophobicContact CD2-CB 3.93Å; L51-K64 HydrophobicContact CD2-CD 3.66Å; L51-K64 HydrophobicContact CD2-CG 4.44Å; L51-K64 HydrophobicContact CG-CB 4.01Å; L51-K64 HydrophobicContact CG-CD 3.73Å; N60-K64 WeakPolarHBondContact O-CG 3.48Å; N60-K64 PolarHBondContact O-N 3.31Å; N60-K64 VanDerWaalsContact O-N 3.09Å; N60-K64 WeakPolarHBondContact OD1-CE 3.35Å; N60-K64 PolarHBondContact OD1-NZ 2.98Å; S61-K64 PolarHBondContact O-N 2.83Å; L62-K64 PolarHBondContact O-N 3.09Å; K64-I66 VanDerWaalsContact C-N 3.35Å; K64-I66 PolarHBondContact O-N 3.22Å; K64-F67 PolarHBondContact O-N 2.95Å; K64-I68 WeakPolarHBondContact O-CG1 3.45Å; K64-I68 PolarHBondContact O-N 3.4Å
65I96.4Very high95.6Very high92 Ų9260.1 Ų60.147%0.47230%0.299SS..Hα-helixtrans-60.9-44.5176.7-68166.4000110.8L51 S61 L62 A63 F67 I68 F69L51-I65 HydrophobicContact CD1-CG1 4.28Å; S61-I65 WeakPolarHBondContact O-CG1 3.4Å; S61-I65 PolarHBondContact O-N 3.36Å; L62-I65 PolarHBondContact O-N 2.95Å; A63-I65 PolarHBondContact O-N 3.42Å; I65-F67 PolarHBondContact O-N 3.29Å; I65-I68 PolarHBondContact O-N 2.86Å; I65-F69 VanDerWaalsContact O-CB 3.31Å; I65-F69 WeakPolarHBondContact O-CB 3.26Å; I65-F69 PolarHBondContact O-N 3.45Å
66I96.6Very high95.8Very high84 Ų8458.3 Ų58.343%0.43129%0.292SS..Hα-helixtrans-62.3-43.8177.7-68.2164.2000110.8F13 L62 A63 K64 F69 S70F13-I66 HydrophobicContact CD1-CG2 4.31Å; F13-I66 HydrophobicContact CE1-CB 4.2Å; F13-I66 HydrophobicContact CE1-CD1 4.4Å; F13-I66 HydrophobicContact CE1-CG2 3.82Å; L62-I66 VanDerWaalsContact O-CG1 3.26Å; L62-I66 WeakPolarHBondContact O-CG1 3.38Å; L62-I66 PolarHBondContact O-N 3.44Å; A63-I66 PolarHBondContact O-N 3.02Å; K64-I66 VanDerWaalsContact C-N 3.35Å; K64-I66 PolarHBondContact O-N 3.22Å; I66-F69 PolarHBondContact O-N 3.08Å; I66-S70 WeakPolarHBondContact O-CB 3.44Å; I66-S70 PolarHBondContact O-N 3.45Å; I66-S70 PolarHBondContact O-OG 2.72Å
67F96.5Very high96.2Very high10 Ų1054 Ų544%0.04427%0.265CS..Hα-helixtrans-60.4-46.9176.8-74.8-60000112.3H12 F13 I16 F44 Y48 A63 K64 I65 S70 S71H12-F67 HydrophobicContact CB-CE1 4.37Å; H12-F67 HydrophobicContact CB-CZ 4.36Å; H12-F67 AromaticContact CD2-CE1 3.89Å; H12-F67 AromaticContact CE1-CE1 3.76Å; H12-F67 AromaticContact CG-CE1 3.69Å; H12-F67 AromaticContact ND1-CE1 3.6Å; H12-F67 AromaticContact ND1-CZ 3.77Å; H12-F67 AromaticContact NE2-CE1 3.94Å; F13-F67 HydrophobicContact CD1-CE1 4.45Å; F13-F67 HydrophobicContact CD1-CZ 4.25Å; F13-F67 HydrophobicContact CD2-CZ 4.26Å; F13-F67 HydrophobicContact CE1-CE1 4.36Å; F13-F67 HydrophobicContact CE1-CE2 4.15Å; F13-F67 AromaticContact CE1-CZ 3.94Å; F13-F67 HydrophobicContact CE1-CZ 3.94Å; F13-F67 HydrophobicContact CE2-CE2 4.13Å; F13-F67 AromaticContact CE2-CZ 3.93Å; F13-F67 HydrophobicContact CE2-CZ 3.93Å; F13-F67 HydrophobicContact CG-CZ 4.4Å; F13-F67 AromaticContact CZ-CE2 3.72Å; F13-F67 HydrophobicContact CZ-CE2 3.72Å; F13-F67 AromaticContact CZ-CZ 3.76Å; F13-F67 HydrophobicContact CZ-CZ 3.76Å; I16-F67 HydrophobicContact CD1-CD1 3.18Å; I16-F67 HydrophobicContact CD1-CE1 3.35Å; I16-F67 HydrophobicContact CD1-CG 4.44Å; F44-F67 HydrophobicContact CD1-CB 4.25Å; F44-F67 HydrophobicContact CD2-CB 4.15Å; F44-F67 HydrophobicContact CE1-CB 4.46Å; F44-F67 HydrophobicContact CE1-CD1 4.35Å; F44-F67 HydrophobicContact CE1-CG 4.48Å; F44-F67 HydrophobicContact CE2-CB 4.35Å; F44-F67 HydrophobicContact CE2-CD1 4.35Å; F44-F67 HydrophobicContact CG-CB 4.11Å; F44-F67 HydrophobicContact CZ-CD1 4.04Å; Y48-F67 HydrophobicContact CE2-CB 3.71Å; Y48-F67 HydrophobicContact CE2-CD2 4.18Å; Y48-F67 HydrophobicContact CE2-CG 4.24Å; A63-F67 HydrophobicContact CB-CD2 4.49Å; A63-F67 HydrophobicContact CB-CE2 4.24Å; A63-F67 WeakPolarHBondContact O-CD2 3.27Å; A63-F67 WeakPolarHBondContact O-CG 3.3Å; A63-F67 PolarHBondContact O-N 3.49Å; K64-F67 PolarHBondContact O-N 2.95Å; I65-F67 PolarHBondContact O-N 3.29Å; F67-S70 PolarHBondContact O-OG 2.99Å; F67-S70 VanDerWaalsContact O-OG 3.13Å; F67-S71 WeakPolarHBondContact O-CB 3.42Å; F67-S71 PolarHBondContact O-N 3.49Å; F67-S71 VanDerWaalsContact O-N 3.12Å; F67-S71 PolarHBondContact O-OG 3.33Å
68I97.5Very high96.4Very high43 Ų4351.9 Ų51.922%0.22125%0.25CS..Hα-helixtrans-61.8-56.7176.7-65168.7000109.4F44 Y48 L51 K64 I65 S70 S71 Y72F44-I68 HydrophobicContact CB-CG1 4.25Å; Y48-I68 HydrophobicContact CD2-CD1 4.23Å; Y48-I68 HydrophobicContact CD2-CG1 3.97Å; L51-I68 HydrophobicContact CD1-CD1 3.8Å; K64-I68 WeakPolarHBondContact O-CG1 3.45Å; K64-I68 PolarHBondContact O-N 3.4Å; I65-I68 PolarHBondContact O-N 2.86Å; I68-S70 VanDerWaalsContact C-N 3.35Å; I68-S70 PolarHBondContact O-N 3.44Å; I68-S71 PolarHBondContact O-N 2.91Å; I68-S71 VanDerWaalsContact O-N 3.15Å; I68-S71 PolarHBondContact O-OG 3.3Å; I68-Y72 HydrophobicContact CG2-CD2 3.83Å; I68-Y72 HydrophobicContact CG2-CE2 3.9Å; I68-Y72 WeakPolarHBondContact O-CD2 3.25Å; I68-Y72 PolarHBondContact O-N 3.02Å; I68-Y72 VanDerWaalsContact O-N 3.14Å
69F97.7Very high96.6Very high154 Ų15449.7 Ų49.768%0.67524%0.235SC*.Hα-helixtrans-58.1-45.5-175.3-179.6-95.9000112.4I65 I66 S71 A73I65-F69 VanDerWaalsContact O-CB 3.31Å; I65-F69 WeakPolarHBondContact O-CB 3.26Å; I65-F69 PolarHBondContact O-N 3.45Å; I66-F69 PolarHBondContact O-N 3.08Å; F69-S71 PolarHBondContact O-N 3.34Å; F69-A73 HydrophobicContact CE1-CB 4.46Å; F69-A73 WeakPolarHBondContact O-CB 3.43Å; F69-A73 PolarHBondContact O-N 3.39Å
70S97.2Very high96.8Very high12 Ų1252 Ų528%0.08425%0.247CC..Hα-helixtrans-66-35.2179.558.90000113.3I16 I66 F67 I68 A73 T74I16-S70 VanDerWaalsContact CG2-OG 3.31Å; I16-S70 WeakPolarHBondContact CG2-OG 3.29Å; I66-S70 WeakPolarHBondContact O-CB 3.44Å; I66-S70 PolarHBondContact O-N 3.45Å; I66-S70 PolarHBondContact O-OG 2.72Å; F67-S70 PolarHBondContact O-OG 2.99Å; F67-S70 VanDerWaalsContact O-OG 3.13Å; I68-S70 VanDerWaalsContact C-N 3.35Å; I68-S70 PolarHBondContact O-N 3.44Å; S70-A73 PolarHBondContact O-N 2.86Å; S70-T74 WeakPolarHBondContact O-CB 3.39Å; S70-T74 PolarHBondContact O-N 2.88Å; S70-T74 PolarHBondContact O-OG1 3.01Å
71S97.7Very high97Very high5 Ų556.4 Ų56.44%0.03526%0.262CS..Hα-helixtrans-67.3-47.2177.269.30000111.9F67 I68 F69 T74 L75F67-S71 WeakPolarHBondContact O-CB 3.42Å; F67-S71 PolarHBondContact O-N 3.49Å; F67-S71 VanDerWaalsContact O-N 3.12Å; F67-S71 PolarHBondContact O-OG 3.33Å; I68-S71 PolarHBondContact O-N 2.91Å; I68-S71 VanDerWaalsContact O-N 3.15Å; I68-S71 PolarHBondContact O-OG 3.3Å; F69-S71 PolarHBondContact O-N 3.34Å; S71-T74 WeakPolarHBondContact O-CB 3.28Å; S71-T74 PolarHBondContact O-N 3.48Å; S71-L75 WeakPolarHBondContact O-CG 3.36Å; S71-L75 PolarHBondContact O-N 2.72Å
72Y98.2Very high97.1Very high114 Ų11456.2 Ų56.245%0.44726%0.258SS..Hα-helixtrans-66.5-36.8173.8-77.1-81.5000112.7T45 I68 T74 L75 Y76T45-Y72 WeakPolarHBondContact OG1-CE2 3.33Å; T45-Y72 PolarHBondContact OG1-OH 3.09Å; I68-Y72 HydrophobicContact CG2-CD2 3.83Å; I68-Y72 HydrophobicContact CG2-CE2 3.9Å; I68-Y72 WeakPolarHBondContact O-CD2 3.25Å; I68-Y72 PolarHBondContact O-N 3.02Å; I68-Y72 VanDerWaalsContact O-N 3.14Å; Y72-T74 VanDerWaalsContact C-N 3.33Å; Y72-T74 PolarHBondContact O-N 3.44Å; Y72-L75 HydrophobicContact CD1-CD1 4.48Å; Y72-L75 PolarHBondContact O-N 3.23Å; Y72-Y76 PolarHBondContact O-N 2.82Å
73A97.7Very high97.2Very high28 Ų2858.9 Ų58.923%0.23127%0.266CS..Hα-helixtrans-61.9-43.1173.600000111F69 S70 L75 Y76 L77F69-A73 HydrophobicContact CE1-CB 4.46Å; F69-A73 WeakPolarHBondContact O-CB 3.43Å; F69-A73 PolarHBondContact O-N 3.39Å; S70-A73 PolarHBondContact O-N 2.86Å; A73-L75 VanDerWaalsContact C-N 3.35Å; A73-L75 PolarHBondContact O-N 3.38Å; A73-Y76 WeakPolarHBondContact O-CB 3.27Å; A73-Y76 PolarHBondContact O-N 3.49Å; A73-L77 VanDerWaalsContact O-CG 3.29Å; A73-L77 WeakPolarHBondContact O-CG 3.23Å; A73-L77 PolarHBondContact O-N 3.26Å
74T97.8Very high97.2Very high3 Ų363.4 Ų63.42%0.01830%0.304CS..Hα-helixtrans-61.3-43.5175.9-58.80000111.2L19 I23 Q37 S70 S71 Y72 Y76 L77 I78L19-T74 HydrophobicContact CD2-CG2 3.85Å; L19-T74 HydrophobicContact CG-CG2 4.3Å; I23-T74 HydrophobicContact CD1-CG2 3.88Å; Q37-T74 HydrophobicContact CB-CG2 4.42Å; Q37-T74 HydrophobicContact CG-CG2 3.9Å; S70-T74 WeakPolarHBondContact O-CB 3.39Å; S70-T74 PolarHBondContact O-N 2.88Å; S70-T74 PolarHBondContact O-OG1 3.01Å; S71-T74 WeakPolarHBondContact O-CB 3.28Å; S71-T74 PolarHBondContact O-N 3.48Å; Y72-T74 VanDerWaalsContact C-N 3.33Å; Y72-T74 PolarHBondContact O-N 3.44Å; T74-Y76 PolarHBondContact O-N 2.93Å; T74-L77 PolarHBondContact O-N 2.85Å; T74-I78 HydrophobicContact CG2-CD1 3.96Å; T74-I78 WeakPolarHBondContact O-CG1 3.39Å; T74-I78 PolarHBondContact O-N 3.4Å
75L98.2Very high97.2Very high26 Ų2665.2 Ų65.214%0.13632%0.316CS..Hα-helixtrans-59.9-43.9173.5-71.6179.2000112.6Q37 I38 A41 S71 Y72 A73 L77 I78 Y79Q37-L75 HydrophobicContact CB-CD2 3.79Å; I38-L75 HydrophobicContact CB-CD2 4.41Å; I38-L75 HydrophobicContact CG1-CD2 3.57Å; A41-L75 HydrophobicContact CB-CD1 3.56Å; A41-L75 HydrophobicContact CB-CG 4.45Å; S71-L75 WeakPolarHBondContact O-CG 3.36Å; S71-L75 PolarHBondContact O-N 2.72Å; Y72-L75 HydrophobicContact CD1-CD1 4.48Å; Y72-L75 PolarHBondContact O-N 3.23Å; A73-L75 VanDerWaalsContact C-N 3.35Å; A73-L75 PolarHBondContact O-N 3.38Å; L75-L77 VanDerWaalsContact C-N 3.31Å; L75-L77 PolarHBondContact O-N 3.44Å; L75-I78 PolarHBondContact O-N 2.89Å; L75-Y79 HydrophobicContact CD2-CD2 4.05Å; L75-Y79 HydrophobicContact CD2-CE2 3.8Å; L75-Y79 PolarHBondContact O-N 3.43Å
76Y98.1Very high97.1Very high130 Ų13062.9 Ų62.951%0.5130%0.301SS..Hα-helixtrans-59.4-42.9174.4169.9-98.7000111.7Y72 A73 T74 I78 F80 R81Y72-Y76 PolarHBondContact O-N 2.82Å; A73-Y76 WeakPolarHBondContact O-CB 3.27Å; A73-Y76 PolarHBondContact O-N 3.49Å; T74-Y76 PolarHBondContact O-N 2.93Å; Y76-I78 PolarHBondContact O-N 3.26Å; Y76-F80 HydrophobicContact CD2-CB 3.95Å; Y76-F80 HydrophobicContact CD2-CD2 4.24Å; Y76-F80 HydrophobicContact CD2-CG 4.27Å; Y76-F80 HydrophobicContact CE2-CB 3.98Å; Y76-F80 WeakPolarHBondContact O-CA 3.24Å; Y76-F80 WeakPolarHBondContact O-CB 2.73Å; Y76-F80 PolarHBondContact O-N 3.28Å; Y76-R81 HydrophobicContact CD1-CB 4.49Å; Y76-R81 HydrophobicContact CE1-CB 4Å; Y76-R81 PolarHBondContact O-N 2.95Å
77L97.9Very high96.9Very high11 Ų1161.2 Ų61.26%0.05829%0.293CS..Iπ-helixtrans-63.6-41.3178.1-66.5178.9000112.1I23 W24 A73 T74 L75 R81 F82I23-L77 HydrophobicContact CB-CD1 4.19Å; I23-L77 HydrophobicContact CG2-CB 3.77Å; I23-L77 HydrophobicContact CG2-CD1 3.92Å; I23-L77 HydrophobicContact CG2-CG 4.39Å; W24-L77 HydrophobicContact CE3-CD2 4.25Å; W24-L77 HydrophobicContact CZ3-CD2 4.43Å; A73-L77 VanDerWaalsContact O-CG 3.29Å; A73-L77 WeakPolarHBondContact O-CG 3.23Å; A73-L77 PolarHBondContact O-N 3.26Å; T74-L77 PolarHBondContact O-N 2.85Å; L75-L77 VanDerWaalsContact C-N 3.31Å; L75-L77 PolarHBondContact O-N 3.44Å; L77-R81 HydrophobicContact CD2-CB 4.11Å; L77-R81 HydrophobicContact CD2-CG 4.22Å; L77-F82 HydrophobicContact CB-CD2 4.22Å; L77-F82 HydrophobicContact CD2-CD2 4.25Å; L77-F82 HydrophobicContact CD2-CE2 3.86Å; L77-F82 WeakPolarHBondContact O-CB 3.25Å; L77-F82 PolarHBondContact O-N 3.11Å
78I97.3Very high96.6Very high0 Ų062.5 Ų62.50%031%0.309CS..Iπ-helixtrans-73.4-53.6-178.7-66.4171.8000111.8I23 C29 Q37 T74 L75 Y76 K83 Y86I23-I78 HydrophobicContact CD1-CG1 4.43Å; C29-I78 HydrophobicContact CB-CG1 3.89Å; Q37-I78 HydrophobicContact CB-CD1 4.19Å; Q37-I78 HydrophobicContact CG-CD1 3.64Å; T74-I78 HydrophobicContact CG2-CD1 3.96Å; T74-I78 WeakPolarHBondContact O-CG1 3.39Å; T74-I78 PolarHBondContact O-N 3.4Å; L75-I78 PolarHBondContact O-N 2.89Å; Y76-I78 PolarHBondContact O-N 3.26Å; I78-K83 VanDerWaalsContact O-CA 3.29Å; I78-K83 WeakPolarHBondContact O-CA 3.35Å; I78-K83 PolarHBondContact O-N 3.42Å; I78-Y86 HydrophobicContact CG2-CD2 3.62Å; I78-Y86 HydrophobicContact CG2-CE2 4.03Å; I78-Y86 HydrophobicContact CG2-CG 4.03Å
79Y97.4Very high96.3Very high64 Ų6467.3 Ų67.325%0.25134%0.336SS..Iπ-helixtrans-89-15.7-168.4-71.8-71.5000114.3G34 R35 I38 L75 Y86G34-Y79 VanDerWaalsContact CA-OH 3.28Å; G34-Y79 WeakPolarHBondContact CA-OH 3.23Å; G34-Y79 PolarHBondContact O-OH 3.45Å; R35-Y79 PolarHBondContact N-OH 3.27Å; I38-Y79 HydrophobicContact CD1-CE2 3.82Å; I38-Y79 WeakPolarHBondContact CD1-OH 3.47Å; I38-Y79 HydrophobicContact CG1-CE2 3.99Å; L75-Y79 HydrophobicContact CD2-CD2 4.05Å; L75-Y79 HydrophobicContact CD2-CE2 3.8Å; L75-Y79 PolarHBondContact O-N 3.43Å; Y79-Y86 HydrophobicContact CE1-CD1 4.5Å; Y79-Y86 AromaticContact CE1-CE1 3.95Å; Y79-Y86 HydrophobicContact CE1-CE1 3.95Å
80F97.1Very high96.1Very high154 Ų15463.8 Ų63.868%0.67532%0.321SS*.Iπ-helixtrans-122.7-65.5-179-61.7-92.7000112Y76 F82Y76-F80 HydrophobicContact CD2-CB 3.95Å; Y76-F80 HydrophobicContact CD2-CD2 4.24Å; Y76-F80 HydrophobicContact CD2-CG 4.27Å; Y76-F80 HydrophobicContact CE2-CB 3.98Å; Y76-F80 WeakPolarHBondContact O-CA 3.24Å; Y76-F80 WeakPolarHBondContact O-CB 2.73Å; Y76-F80 PolarHBondContact O-N 3.28Å; F80-F82 PolarHBondContact O-N 2.53Å
81R97Very high96Very high125 Ų12563.2 Ų63.247%0.47232%0.317SS..Iπ-helixtrans-67.5-40.6-167.6-175.662-18091.7-5.7114.1Y76 L77Y76-R81 HydrophobicContact CD1-CB 4.49Å; Y76-R81 HydrophobicContact CE1-CB 4Å; Y76-R81 PolarHBondContact O-N 2.95Å; L77-R81 HydrophobicContact CD2-CB 4.11Å; L77-R81 HydrophobicContact CD2-CG 4.22Å
82F97Very high95.8Very high14 Ų1465.6 Ų65.66%0.06133%0.331CS..THydrogen-bonded Turntrans-122.326.5-177.6-55.8-60.3000112.3I23 R27 C29 L77 F80 A84 T85I23-F82 HydrophobicContact CG2-CD2 3.5Å; I23-F82 HydrophobicContact CG2-CE2 3.85Å; R27-F82 HydrophobicContact CB-CD1 4.3Å; R27-F82 HydrophobicContact CB-CE1 3.76Å; R27-F82 HydrophobicContact CB-CZ 4.23Å; R27-F82 HydrophobicContact CG-CE1 4.33Å; R27-F82 WeakPolarHBondContact O-CD1 3.07Å; C29-F82 PolarHBondContact SG-O 3.24Å; C29-F82 VanDerWaalsContact SG-O 3.38Å; L77-F82 HydrophobicContact CB-CD2 4.22Å; L77-F82 HydrophobicContact CD2-CD2 4.25Å; L77-F82 HydrophobicContact CD2-CE2 3.86Å; L77-F82 WeakPolarHBondContact O-CB 3.25Å; L77-F82 PolarHBondContact O-N 3.11Å; F80-F82 PolarHBondContact O-N 2.53Å; F82-A84 PolarHBondContact O-N 3Å; F82-T85 PolarHBondContact O-N 2.88Å; F82-T85 PolarHBondContact O-OG1 2.7Å
83K95.8Very high95.7Very high144 Ų14462 Ų6263%0.62632%0.318SS*.G310 helixtrans-48.6-35.1180-176-176.2176.7-179.70113.6I78 T85 Y86I78-K83 VanDerWaalsContact O-CA 3.29Å; I78-K83 WeakPolarHBondContact O-CA 3.35Å; I78-K83 PolarHBondContact O-N 3.42Å; K83-T85 PolarHBondContact O-N 2.77Å; K83-Y86 WeakPolarHBondContact O-CB 3.21Å; K83-Y86 PolarHBondContact O-N 2.66Å; K83-Y86 VanDerWaalsContact O-N 3.13Å
84A96.5Very high95.7Very high106 Ų10667.6 Ų67.688%0.87633%0.333SS*.G310 helixtrans-62.2-22.2179.600000114F82F82-A84 PolarHBondContact O-N 3Å
85T95Very high95.6Very high50 Ų5068.3 Ų68.331%0.30734%0.337SS..G310 helixtrans-99.6-0.8179.262.90000113.3S28 C29 A30 F82 K83S28-T85 WeakPolarHBondContact CA-OG1 3.38Å; S28-T85 WeakPolarHBondContact OG-CB 3.38Å; C29-T85 PolarHBondContact N-OG1 2.67Å; C29-T85 PolarHBondContact SG-OG1 2.94Å; A30-T85 WeakPolarHBondContact CA-O 3.41Å; A30-T85 PolarHBondContact N-O 3.37Å; F82-T85 PolarHBondContact O-N 2.88Å; F82-T85 PolarHBondContact O-OG1 2.7Å; K83-T85 PolarHBondContact O-N 2.77Å
86Y95.7Very high95.5Very high43 Ų4371.9 Ų71.917%0.16935%0.353CS..  trans-81.1123.5-179.3174.5-116.6000110.8I78 Y79 K83 G88 D91I78-Y86 HydrophobicContact CG2-CD2 3.62Å; I78-Y86 HydrophobicContact CG2-CE2 4.03Å; I78-Y86 HydrophobicContact CG2-CG 4.03Å; Y79-Y86 HydrophobicContact CE1-CD1 4.5Å; Y79-Y86 AromaticContact CE1-CE1 3.95Å; Y79-Y86 HydrophobicContact CE1-CE1 3.95Å; K83-Y86 WeakPolarHBondContact O-CB 3.21Å; K83-Y86 PolarHBondContact O-N 2.66Å; K83-Y86 VanDerWaalsContact O-N 3.13Å; Y86-G88 PolarHBondContact O-N 3.37Å; Y86-G88 VanDerWaalsContact O-N 3.12Å; Y86-D91 HydrophobicContact CE2-CB 4.39Å; Y86-D91 PolarHBondContact OH-OD2 3.16Å
87D90.9Very high95.5Very high49 Ų4971.7 Ų71.726%0.26236%0.355SS..  trans-87.477179.4-169.1-9.7000111.9N89 H90 D91D87-N89 PolarHBondContact O-N 2.99Å; D87-N89 PolarHBondContact OD1-N 3Å; D87-H90 IonicContact OD1-CG 3.15Å; D87-H90 PolarHBondContact OD1-N 3.03Å; D87-H90 IonicContact OD1-ND1 3.8Å; D87-H90 PolarHBondContact OD1-ND1 2.86Å; D87-H90 IonicContact OD2-CE1 2.94Å; D87-H90 IonicContact OD2-CG 2.67Å; D87-H90 IonicContact OD2-ND1 3.81Å; D87-H90 PolarHBondContact OD2-ND1 3.05Å; D87-D91 WeakPolarHBondContact O-CB 3.44Å; D87-D91 PolarHBondContact O-N 3.04Å; D87-D91 VanDerWaalsContact O-N 3.08Å
88G91.2Very high95.5Very high37 Ų3771.7 Ų71.738%0.38136%0.355SS..THydrogen-bonded Turntrans-68.1-14.8176.100000114.4Y86Y86-G88 PolarHBondContact O-N 3.37Å; Y86-G88 VanDerWaalsContact O-N 3.12Å
89N91.8Very high95.5Very high145 Ų14573.9 Ų73.978%0.77537%0.367SS*.THydrogen-bonded Turntrans-80.4-34.8-179.3-69.8-26.1000111.7D87 T92D87-N89 PolarHBondContact O-N 2.99Å; D87-N89 PolarHBondContact OD1-N 3Å; N89-T92 WeakPolarHBondContact O-CG2 3.15Å
90H91.9Very high95.5Very high80 Ų8074.9 Ų74.937%0.3738%0.379SS..THydrogen-bonded Turntrans-93-31.5176-63.994.5000113D87 T92 L137 T141D87-H90 IonicContact OD1-CG 3.15Å; D87-H90 PolarHBondContact OD1-N 3.03Å; D87-H90 IonicContact OD1-ND1 3.8Å; D87-H90 PolarHBondContact OD1-ND1 2.86Å; D87-H90 IonicContact OD2-CE1 2.94Å; D87-H90 IonicContact OD2-CG 2.67Å; D87-H90 IonicContact OD2-ND1 3.81Å; D87-H90 PolarHBondContact OD2-ND1 3.05Å; H90-T92 VanDerWaalsContact C-N 3.29Å; H90-T92 PolarHBondContact O-N 3.41Å; H90-L137 HydrophobicContact CB-CD1 3.52Å; H90-T141 HydrophobicContact CB-CG2 3.98Å
91D94.9Very high95.6Very high0 Ų070.7 Ų70.70%037%0.367CS..  trans-71.891.5167.6-168.2-7.9000107.1S33 G34 R35 Y86 D87 L137S33-D91 WeakPolarHBondContact CA-OD2 3.17Å; S33-D91 WeakPolarHBondContact CB-OD2 3.43Å; S33-D91 VanDerWaalsContact OG-CG 3.28Å; S33-D91 PolarHBondContact OG-OD1 2.97Å; S33-D91 PolarHBondContact OG-OD2 3.41Å; G34-D91 PolarHBondContact N-OD2 3.48Å; R35-D91 VanDerWaalsContact CZ-O 3.27Å; R35-D91 IonicContact CZ-OD1 2.69Å; R35-D91 PolarHBondContact N-OD2 2.86Å; R35-D91 VanDerWaalsContact N-OD2 3.17Å; R35-D91 PolarHBondContact NH1-O 3.44Å; R35-D91 IonicContact NH1-OD1 3.68Å; R35-D91 PolarHBondContact NH1-OD1 2.63Å; R35-D91 PolarHBondContact NH2-O 2.92Å; R35-D91 VanDerWaalsContact NH2-O 3.16Å; Y86-D91 HydrophobicContact CE2-CB 4.39Å; Y86-D91 PolarHBondContact OH-OD2 3.16Å; D87-D91 WeakPolarHBondContact O-CB 3.44Å; D87-D91 PolarHBondContact O-N 3.04Å; D87-D91 VanDerWaalsContact O-N 3.08Å; D91-L137 HydrophobicContact CB-CD1 4.34Å
92T95.3Very high95.6Very high54 Ų5465.3 Ų65.333%0.33135%0.349SS..  trans-122.77.9179.175.40000114.6N89 H90 R94 K140N89-T92 WeakPolarHBondContact O-CG2 3.15Å; H90-T92 VanDerWaalsContact C-N 3.29Å; H90-T92 PolarHBondContact O-N 3.41Å; T92-R94 PolarHBondContact O-N 3.17Å; T92-K140 PolarHBondContact OG1-NZ 2.94Å
93F96.2Very high95.7Very high39 Ų3966.5 Ų66.517%0.17136%0.361CS..  trans-62.6130.2179.2-165.1-78000111.1R35 L95 L98 L132 P133 F136R35-F93 WeakPolarHBondContact CD-O 3.49Å; R35-F93 VanDerWaalsContact CZ-O 3.25Å; R35-F93 PolarHBondContact NE-O 3.05Å; R35-F93 PolarHBondContact NH1-O 3.33Å; F93-L95 PolarHBondContact O-N 3.19Å; F93-L98 HydrophobicContact CD1-CD1 4.41Å; F93-L98 HydrophobicContact CE1-CD1 3.78Å; F93-L98 HydrophobicContact CE1-CD2 3.78Å; F93-L98 HydrophobicContact CE1-CG 3.67Å; F93-L98 HydrophobicContact CZ-CD1 4.41Å; F93-L98 HydrophobicContact CZ-CD2 3.9Å; F93-L98 HydrophobicContact CZ-CG 4.3Å; F93-L132 HydrophobicContact CE2-CB 4.14Å; F93-L132 HydrophobicContact CZ-CB 4.12Å; F93-L132 HydrophobicContact CZ-CD1 4.47Å; F93-P133 HydrophobicContact CB-CB 3.83Å; F93-P133 HydrophobicContact CB-CG 4.14Å; F93-P133 HydrophobicContact CD1-CB 4.42Å; F93-P133 HydrophobicContact CD1-CG 3.8Å; F93-P133 HydrophobicContact CE1-CG 4.49Å; F93-P133 HydrophobicContact CG-CB 4.14Å; F93-P133 HydrophobicContact CG-CG 3.98Å; F93-F136 HydrophobicContact CB-CD1 4.15Å; F93-F136 HydrophobicContact CD2-CB 3.86Å; F93-F136 HydrophobicContact CD2-CD1 4.21Å; F93-F136 HydrophobicContact CD2-CD2 4.33Å; F93-F136 AromaticContact CD2-CG 3.89Å; F93-F136 HydrophobicContact CD2-CG 3.89Å
94R96.5Very high95.8Very high145 Ų14564.4 Ų64.455%0.54736%0.356SS..  trans-84.3106.6-178.6-76.3-176.363.3-169.14.2111T92 E96 F97T92-R94 PolarHBondContact O-N 3.17Å; R94-E96 WeakPolarHBondContact CB-OE2 3.43Å; R94-E96 IonicContact NE-OE2 2.77Å; R94-E96 PolarHBondContact O-N 3.06Å; R94-F97 HydrophobicContact CB-CD2 3.51Å; R94-F97 HydrophobicContact CB-CE2 3.73Å; R94-F97 HydrophobicContact CG-CE2 4.36Å; R94-F97 PolarHBondContact O-N 2.84Å
95L96.2Very high95.8Very high18 Ų1863 Ų639%0.09433%0.334CS..THydrogen-bonded Turntrans-66.1-22.9-172.5-172.261.9000112.6I38 A39 F93 F97 L98 L99I38-L95 HydrophobicContact CB-CD2 4.25Å; I38-L95 HydrophobicContact CG2-CD2 3.68Å; A39-L95 HydrophobicContact CB-CD1 3.98Å; F93-L95 PolarHBondContact O-N 3.19Å; L95-F97 PolarHBondContact O-N 2.87Å; L95-L98 HydrophobicContact CD1-CB 4.41Å; L95-L98 HydrophobicContact CD1-CD1 4.07Å; L95-L98 PolarHBondContact O-N 2.73Å; L95-L99 HydrophobicContact CD1-CG 4.5Å; L95-L99 HydrophobicContact CD2-CD1 3.92Å; L95-L99 HydrophobicContact CD2-CG 4.45Å; L95-L99 HydrophobicContact CG-CD1 3.78Å; L95-L99 HydrophobicContact CG-CG 3.95Å; L95-L99 PolarHBondContact O-N 3.24Å
96E96.9Very high95.9Very high102 Ų10260.9 Ų60.948%0.47732%0.321SS..Hα-helixtrans-58.9-34.5177.2-53.880.5-174.700111.7R94 L98 L99 V100R94-E96 WeakPolarHBondContact CB-OE2 3.43Å; R94-E96 IonicContact NE-OE2 2.77Å; R94-E96 PolarHBondContact O-N 3.06Å; E96-L98 PolarHBondContact O-N 3.26Å; E96-L99 PolarHBondContact O-N 3.24Å; E96-V100 WeakPolarHBondContact O-CB 3.35Å; E96-V100 PolarHBondContact O-N 3Å
97F96.8Very high96Very high125 Ų12563.1 Ų63.155%0.54834%0.335SS..Hα-helixtrans-71.5-8.4176.7-64.3-55.7000113.9R94 L95 P101R94-F97 HydrophobicContact CB-CD2 3.51Å; R94-F97 HydrophobicContact CB-CE2 3.73Å; R94-F97 HydrophobicContact CG-CE2 4.36Å; R94-F97 PolarHBondContact O-N 2.84Å; L95-F97 PolarHBondContact O-N 2.87Å; F97-P101 WeakPolarHBondContact O-CD 3.26Å; F97-P101 VanDerWaalsContact O-CG 3.3Å; F97-P101 WeakPolarHBondContact O-CG 3.34Å
98L97.6Very high96.3Very high12 Ų1267.2 Ų67.26%0.06336%0.356CS..Hα-helixtrans-100.7-49.6169.1-51.4-174.6000110.3F93 L95 E96 V100 C102 L126 V129 L132 P133F93-L98 HydrophobicContact CD1-CD1 4.41Å; F93-L98 HydrophobicContact CE1-CD1 3.78Å; F93-L98 HydrophobicContact CE1-CD2 3.78Å; F93-L98 HydrophobicContact CE1-CG 3.67Å; F93-L98 HydrophobicContact CZ-CD1 4.41Å; F93-L98 HydrophobicContact CZ-CD2 3.9Å; F93-L98 HydrophobicContact CZ-CG 4.3Å; L95-L98 HydrophobicContact CD1-CB 4.41Å; L95-L98 HydrophobicContact CD1-CD1 4.07Å; L95-L98 PolarHBondContact O-N 2.73Å; E96-L98 PolarHBondContact O-N 3.26Å; L98-V100 PolarHBondContact O-N 2.95Å; L98-C102 VanDerWaalsContact O-CB 3.27Å; L98-C102 WeakPolarHBondContact O-CB 3.41Å; L98-C102 PolarHBondContact O-N 3.15Å; L98-C102 VanDerWaalsContact O-N 3.08Å; L98-C102 PolarHBondContact O-SG 2.94Å; L98-L126 HydrophobicContact CB-CD1 4.21Å; L98-V129 HydrophobicContact CB-CG2 4.15Å; L98-V129 HydrophobicContact CD1-CG2 4.37Å; L98-V129 HydrophobicContact CD2-CB 4.26Å; L98-V129 HydrophobicContact CD2-CG2 4.14Å; L98-V129 HydrophobicContact CG-CG2 4.44Å; L98-L132 HydrophobicContact CD1-CB 4.41Å; L98-L132 HydrophobicContact CD2-CD1 3.84Å; L98-P133 HydrophobicContact CD1-CG 4.22Å
99L97.9Very high96.5Very high46 Ų4668.7 Ų68.724%0.24136%0.357CS..Hα-helixtrans-62.8-47-174.1-65.4173000112.4I42 L95 E96 A103 F122 L126I42-L99 HydrophobicContact CD1-CD1 4.31Å; I42-L99 HydrophobicContact CD1-CD2 3.93Å; I42-L99 HydrophobicContact CG2-CD2 4.45Å; L95-L99 HydrophobicContact CD1-CG 4.5Å; L95-L99 HydrophobicContact CD2-CD1 3.92Å; L95-L99 HydrophobicContact CD2-CG 4.45Å; L95-L99 HydrophobicContact CG-CD1 3.78Å; L95-L99 HydrophobicContact CG-CG 3.95Å; L95-L99 PolarHBondContact O-N 3.24Å; E96-L99 PolarHBondContact O-N 3.24Å; L99-A103 VanDerWaalsContact O-CB 3.25Å; L99-A103 WeakPolarHBondContact O-CB 3.36Å; L99-A103 PolarHBondContact O-N 2.89Å; L99-F122 HydrophobicContact CD2-CZ 4.01Å; L99-L126 HydrophobicContact CD2-CD1 3.83Å; L99-L126 HydrophobicContact CD2-CD2 3.68Å; L99-L126 HydrophobicContact CD2-CG 4.43Å
100V97.9Very high96.7Very high84 Ų8463.6 Ų63.651%0.50933%0.33SS..Hα-helixtrans-67.5-50.4-175.7175.10000111.3E96 L98 C102 A103 L104E96-V100 WeakPolarHBondContact O-CB 3.35Å; E96-V100 PolarHBondContact O-N 3Å; L98-V100 PolarHBondContact O-N 2.95Å; V100-C102 PolarHBondContact O-N 3.39Å; V100-A103 PolarHBondContact O-N 3.05Å; V100-L104 HydrophobicContact CG1-CD1 4.01Å; V100-L104 HydrophobicContact CG1-CG 4.39Å; V100-L104 WeakPolarHBondContact O-CG 3.33Å; V100-L104 PolarHBondContact O-N 3.31Å
101P98Very high96.9Very high67 Ų6764.2 Ų64.244%0.43533%0.333SS..Hα-helixtrans-62.2-40.4176.7-2739000113.5F97 A103 L104 L105F97-P101 WeakPolarHBondContact O-CD 3.26Å; F97-P101 VanDerWaalsContact O-CG 3.3Å; F97-P101 WeakPolarHBondContact O-CG 3.34Å; P101-A103 VanDerWaalsContact C-N 3.35Å; P101-A103 PolarHBondContact O-N 3.49Å; P101-L104 PolarHBondContact O-N 3.26Å; P101-L105 VanDerWaalsContact O-CB 3.23Å; P101-L105 WeakPolarHBondContact O-CB 3.13Å; P101-L105 PolarHBondContact O-N 3.22Å
102C98Very high96.8Very high12 Ų1272.2 Ų72.28%0.08136%0.363CS..Hα-helixtrans-64.9-38.3177.1-69.20000112.2L98 V100 A106 F122 L126L98-C102 VanDerWaalsContact O-CB 3.27Å; L98-C102 WeakPolarHBondContact O-CB 3.41Å; L98-C102 PolarHBondContact O-N 3.15Å; L98-C102 VanDerWaalsContact O-N 3.08Å; L98-C102 PolarHBondContact O-SG 2.94Å; V100-C102 PolarHBondContact O-N 3.39Å; C102-A106 WeakPolarHBondContact O-CB 3.35Å; C102-A106 PolarHBondContact O-N 3.42Å; C102-F122 HydrophobicContact CB-CD2 4.07Å; C102-F122 HydrophobicContact CB-CE2 3.98Å; C102-L126 HydrophobicContact CB-CB 4.39Å
103A97.9Very high96.8Very high39 Ų3976.9 Ų76.932%0.32238%0.379SS..Hα-helixtrans-67.2-46.7176.400000111.7L99 V100 P101 L105 A106 L107 F122L99-A103 VanDerWaalsContact O-CB 3.25Å; L99-A103 WeakPolarHBondContact O-CB 3.36Å; L99-A103 PolarHBondContact O-N 2.89Å; V100-A103 PolarHBondContact O-N 3.05Å; P101-A103 VanDerWaalsContact C-N 3.35Å; P101-A103 PolarHBondContact O-N 3.49Å; A103-L105 VanDerWaalsContact C-N 3.34Å; A103-L105 PolarHBondContact O-N 3.24Å; A103-A106 PolarHBondContact O-N 3.13Å; A103-L107 WeakPolarHBondContact O-CG 3.25Å; A103-L107 PolarHBondContact O-N 2.98Å; A103-L107 VanDerWaalsContact O-N 3.13Å; A103-F122 HydrophobicContact CB-CD2 4.07Å; A103-F122 HydrophobicContact CB-CE2 4Å
104L98Very high96.7Very high99 Ų9980.8 Ų80.852%0.51840%0.398SS..Hα-helixtrans-61-43.8175.7-70.2176.9000111.5V100 P101 A106 L107 I108V100-L104 HydrophobicContact CG1-CD1 4.01Å; V100-L104 HydrophobicContact CG1-CG 4.39Å; V100-L104 WeakPolarHBondContact O-CG 3.33Å; V100-L104 PolarHBondContact O-N 3.31Å; P101-L104 PolarHBondContact O-N 3.26Å; L104-A106 VanDerWaalsContact C-N 3.33Å; L104-A106 PolarHBondContact O-N 2.89Å; L104-L107 PolarHBondContact O-N 2.75Å; L104-I108 WeakPolarHBondContact O-CG1 3.46Å; L104-I108 PolarHBondContact O-N 3.39Å; L104-I108 VanDerWaalsContact O-N 3.15Å
105L97.5Very high96.7Very high78 Ų7879.1 Ų79.141%0.40840%0.404SS..Hα-helixtrans-63.2-38.9177.6-172.963.1000111.8P101 A103 L107 I108 V109 Y125P101-L105 VanDerWaalsContact O-CB 3.23Å; P101-L105 WeakPolarHBondContact O-CB 3.13Å; P101-L105 PolarHBondContact O-N 3.22Å; A103-L105 VanDerWaalsContact C-N 3.34Å; A103-L105 PolarHBondContact O-N 3.24Å; L105-L107 VanDerWaalsContact C-N 3.3Å; L105-L107 PolarHBondContact O-N 2.72Å; L105-I108 PolarHBondContact O-N 3.48Å; L105-V109 HydrophobicContact CD1-CB 4.34Å; L105-V109 HydrophobicContact CD1-CG2 4Å; L105-V109 PolarHBondContact O-N 3.36Å; L105-Y125 HydrophobicContact CB-CD2 4.05Å; L105-Y125 HydrophobicContact CB-CE2 4.12Å; L105-Y125 HydrophobicContact CD2-CD1 4.02Å; L105-Y125 HydrophobicContact CD2-CD2 3.85Å; L105-Y125 HydrophobicContact CD2-CE1 4.05Å; L105-Y125 HydrophobicContact CD2-CE2 3.87Å; L105-Y125 HydrophobicContact CD2-CG 3.95Å; L105-Y125 HydrophobicContact CG-CD2 3.86Å; L105-Y125 HydrophobicContact CG-CE2 3.58Å; L105-Y125 HydrophobicContact CG-CG 4.47Å
106A97.6Very high96.6Very high4 Ų481.4 Ų81.43%0.03342%0.418CS..Hα-helixtrans-63.6-33.917500000113C102 A103 L104 N110 L118 T121 F122 Y125C102-A106 WeakPolarHBondContact O-CB 3.35Å; C102-A106 PolarHBondContact O-N 3.42Å; A103-A106 PolarHBondContact O-N 3.13Å; L104-A106 VanDerWaalsContact C-N 3.33Å; L104-A106 PolarHBondContact O-N 2.89Å; A106-N110 WeakPolarHBondContact O-CB 3.39Å; A106-N110 PolarHBondContact O-ND2 3.03Å; A106-L118 VanDerWaalsContact O-CD2 3.31Å; A106-L118 WeakPolarHBondContact O-CD2 3.33Å; A106-T121 HydrophobicContact CB-CG2 4.02Å; A106-F122 HydrophobicContact CB-CB 3.85Å; A106-Y125 HydrophobicContact CB-CD2 4.19Å; A106-Y125 HydrophobicContact CB-CE2 4.34Å
107L97.3Very high96.5Very high91 Ų9178.8 Ų78.848%0.47641%0.406SS..Hα-helixtrans-71-32.4175.5-66.5173.5000112.8A103 L104 L105 N110 F113 L118A103-L107 WeakPolarHBondContact O-CG 3.25Å; A103-L107 PolarHBondContact O-N 2.98Å; A103-L107 VanDerWaalsContact O-N 3.13Å; L104-L107 PolarHBondContact O-N 2.75Å; L105-L107 VanDerWaalsContact C-N 3.3Å; L105-L107 PolarHBondContact O-N 2.72Å; L107-N110 PolarHBondContact O-ND2 2.66Å; L107-F113 HydrophobicContact CD2-CE2 4.43Å; L107-L118 HydrophobicContact CD2-CD1 4.15Å; L107-L118 HydrophobicContact CD2-CD2 4.39Å
108I96.7Very high96.6Very high135 Ų13574.1 Ų74.169%0.69239%0.387SS*.Hα-helixtrans-87.8-43.7-177.5-60.9163.2000111.8L104 L105L104-I108 WeakPolarHBondContact O-CG1 3.46Å; L104-I108 PolarHBondContact O-N 3.39Å; L104-I108 VanDerWaalsContact O-N 3.15Å; L105-I108 PolarHBondContact O-N 3.48Å
109V96.8Very high96.6Very high68 Ų6876.1 Ų76.141%0.41240%0.397SS..SBendtrans-122.794.8-173.1-173.80000109.6L105 T121 Y125L105-V109 HydrophobicContact CD1-CB 4.34Å; L105-V109 HydrophobicContact CD1-CG2 4Å; L105-V109 PolarHBondContact O-N 3.36Å; V109-T121 WeakPolarHBondContact O-CG2 3.46Å; V109-Y125 WeakPolarHBondContact CG1-OH 3.37Å; V109-Y125 PolarHBondContact O-OH 3.38Å
110N95.9Very high96.6Very high38 Ų3877 Ų7720%0.20340%0.397CS..  trans-141.2165.1177.355.484.3000110.4A106 L107 R112 F113 L118 T121A106-N110 WeakPolarHBondContact O-CB 3.39Å; A106-N110 PolarHBondContact O-ND2 3.03Å; L107-N110 PolarHBondContact O-ND2 2.66Å; N110-R112 PolarHBondContact OD1-N 3.33Å; N110-R112 PolarHBondContact OD1-O 2.96Å; N110-F113 PolarHBondContact OD1-N 3.33Å; N110-L118 HydrophobicContact CB-CD2 4.03Å; N110-T121 HydrophobicContact CB-CG2 4.17Å
111H94.3Very high96.6Very high93 Ų9373 Ų7343%0.43137%0.373SS..SBendtrans-76.2-36.8175.3-65.5-57.1000112.5E117 W120 D177H111-E117 HydrophobicContact CB-CG 4.42Å; H111-E117 IonicContact CD2-OE1 2.66Å; H111-E117 PolarHBondContact CD2-OE1 2.9Å; H111-E117 IonicContact CG-OE1 3.84Å; H111-W120 AromaticContact CD2-CZ3 3.81Å; H111-D177 IonicContact CE1-OD1 3.34Å; H111-D177 PolarHBondContact CE1-OD1 2.9Å; H111-D177 VanDerWaalsContact NE2-CG 3.27Å; H111-D177 IonicContact NE2-OD1 2.93Å; H111-D177 PolarHBondContact NE2-OD1 3.39Å; H111-D177 IonicContact NE2-OD2 2.7Å; H111-D177 PolarHBondContact NE2-OD2 2.81Å; H111-D177 VanDerWaalsContact NE2-OD2 3.15Å
112R94.5Very high96.6Very high167 Ų16771.1 Ų71.163%0.6336%0.358SS*.SBendtrans-150.2141.6179.7-56.7-178.5-173.9179.60.9110.7N110 Q114 E117N110-R112 PolarHBondContact OD1-N 3.33Å; N110-R112 PolarHBondContact OD1-O 2.96Å; R112-Q114 PolarHBondContact O-N 3.44Å; R112-E117 HydrophobicContact CB-CB 4.48Å; R112-E117 HydrophobicContact CB-CG 4.1Å; R112-E117 WeakPolarHBondContact O-CB 3.16Å; R112-E117 WeakPolarHBondContact O-CG 3.29Å
113F94.9Very high96.6Very high153 Ų15370.5 Ų70.567%0.67135%0.354SS*.SBendtrans-81.462.9178.2-153.2-97000112.1L107 N110 L118L107-F113 HydrophobicContact CD2-CE2 4.43Å; N110-F113 PolarHBondContact OD1-N 3.33Å; F113-L118 HydrophobicContact CD2-CD1 4.35Å; F113-L118 HydrophobicContact CD2-CD2 4.15Å; F113-L118 HydrophobicContact CE2-CD1 4.21Å; F113-L118 HydrophobicContact CE2-CD2 4.3Å; F113-L118 HydrophobicContact CZ-CD1 4.3Å
114Q94.8Very high96.6Very high120 Ų12069.1 Ų69.156%0.56134%0.341SS*.SBendtrans-122.3144.8175-68.3-177.1-15.900109.4R112 V116 E117 L118R112-Q114 PolarHBondContact O-N 3.44Å; Q114-V116 VanDerWaalsContact C-N 3.32Å; Q114-V116 PolarHBondContact O-N 3.37Å; Q114-E117 HydrophobicContact CB-CB 4.29Å; Q114-E117 WeakPolarHBondContact O-CB 3.35Å; Q114-E117 PolarHBondContact O-N 3.49Å; Q114-L118 WeakPolarHBondContact O-CG 3.41Å; Q114-L118 PolarHBondContact O-N 2.99Å
115V94.7Very high96.6Very high111 Ų11165.3 Ų65.367%0.67332%0.32SS*.Hα-helixtrans-53.7-46.7-173.5178.10000112.5E117 L118 L119V115-E117 VanDerWaalsContact C-N 3.34Å; V115-E117 PolarHBondContact O-N 2.99Å; V115-L118 PolarHBondContact O-N 3.38Å; V115-L119 HydrophobicContact CG1-CD1 4.12Å; V115-L119 HydrophobicContact CG1-CG 4.5Å; V115-L119 VanDerWaalsContact O-CG 3.29Å; V115-L119 WeakPolarHBondContact O-CG 3.43Å; V115-L119 PolarHBondContact O-N 2.93Å
116V95.1Very high96.7Very high66 Ų6661.6 Ų61.640%0.430%0.3SS..Hα-helixtrans-64-39.7179.8-179.40000111.6Q114 L119 W120Q114-V116 VanDerWaalsContact C-N 3.32Å; Q114-V116 PolarHBondContact O-N 3.37Å; V116-L119 PolarHBondContact O-N 3.45Å; V116-W120 WeakPolarHBondContact O-CB 3.35Å; V116-W120 PolarHBondContact O-N 3.21Å
117E95.3Very high96.7Very high46 Ų4661.4 Ų61.422%0.21530%0.299CS..Hα-helixtrans-70.3-37.7178.8-171.363.2-157.200112H111 R112 Q114 V115 W120 T121H111-E117 HydrophobicContact CB-CG 4.42Å; H111-E117 IonicContact CD2-OE1 2.66Å; H111-E117 PolarHBondContact CD2-OE1 2.9Å; H111-E117 IonicContact CG-OE1 3.84Å; R112-E117 HydrophobicContact CB-CB 4.48Å; R112-E117 HydrophobicContact CB-CG 4.1Å; R112-E117 WeakPolarHBondContact O-CB 3.16Å; R112-E117 WeakPolarHBondContact O-CG 3.29Å; Q114-E117 HydrophobicContact CB-CB 4.29Å; Q114-E117 WeakPolarHBondContact O-CB 3.35Å; Q114-E117 PolarHBondContact O-N 3.49Å; V115-E117 VanDerWaalsContact C-N 3.34Å; V115-E117 PolarHBondContact O-N 2.99Å; E117-W120 PolarHBondContact O-N 3.26Å; E117-T121 VanDerWaalsContact O-CB 3.29Å; E117-T121 WeakPolarHBondContact O-CB 3.47Å; E117-T121 PolarHBondContact O-N 3.17Å; E117-T121 PolarHBondContact O-OG1 3.09Å
118L97.4Very high96.7Very high27 Ų2757.3 Ų57.314%0.14128%0.278CS..Hα-helixtrans-64.7-43174.3-68.7174.2000111.2A106 L107 N110 F113 Q114 V115 T121 F122A106-L118 VanDerWaalsContact O-CD2 3.31Å; A106-L118 WeakPolarHBondContact O-CD2 3.33Å; L107-L118 HydrophobicContact CD2-CD1 4.15Å; L107-L118 HydrophobicContact CD2-CD2 4.39Å; N110-L118 HydrophobicContact CB-CD2 4.03Å; F113-L118 HydrophobicContact CD2-CD1 4.35Å; F113-L118 HydrophobicContact CD2-CD2 4.15Å; F113-L118 HydrophobicContact CE2-CD1 4.21Å; F113-L118 HydrophobicContact CE2-CD2 4.3Å; F113-L118 HydrophobicContact CZ-CD1 4.3Å; Q114-L118 WeakPolarHBondContact O-CG 3.41Å; Q114-L118 PolarHBondContact O-N 2.99Å; V115-L118 PolarHBondContact O-N 3.38Å; L118-T121 PolarHBondContact O-N 3.41Å; L118-F122 VanDerWaalsContact O-CB 3.26Å; L118-F122 WeakPolarHBondContact O-CB 3.41Å; L118-F122 PolarHBondContact O-N 3.43Å
119L97.6Very high96.8Very high55 Ų5552 Ų5229%0.28825%0.251SS..Hα-helixtrans-64.8-41.4175.1-70175.1000111.9T46 V49 V115 V116 S123T46-L119 HydrophobicContact CG2-CD2 4.08Å; V49-L119 HydrophobicContact CG2-CD1 4.07Å; V115-L119 HydrophobicContact CG1-CD1 4.12Å; V115-L119 HydrophobicContact CG1-CG 4.5Å; V115-L119 VanDerWaalsContact O-CG 3.29Å; V115-L119 WeakPolarHBondContact O-CG 3.43Å; V115-L119 PolarHBondContact O-N 2.93Å; V116-L119 PolarHBondContact O-N 3.45Å; L119-S123 WeakPolarHBondContact O-CB 3.3Å; L119-S123 PolarHBondContact O-N 2.94Å
120W97.8Very high96.8Very high64 Ų6448.7 Ų48.724%0.24223%0.232CC..Hα-helixtrans-61.2-50.1173.9178.488.3000111.1H111 V116 E117 F122 S123 I124 D177 I179H111-W120 AromaticContact CD2-CZ3 3.81Å; V116-W120 WeakPolarHBondContact O-CB 3.35Å; V116-W120 PolarHBondContact O-N 3.21Å; E117-W120 PolarHBondContact O-N 3.26Å; W120-F122 PolarHBondContact O-N 3.1Å; W120-S123 WeakPolarHBondContact O-CB 3.45Å; W120-S123 PolarHBondContact O-N 3.4Å; W120-S123 VanDerWaalsContact O-N 3.09Å; W120-S123 PolarHBondContact O-OG 2.99Å; W120-I124 HydrophobicContact CD2-CG1 4.11Å; W120-I124 HydrophobicContact CE3-CG1 4.25Å; W120-I124 HydrophobicContact CH2-CD1 4.41Å; W120-I124 HydrophobicContact CH2-CG1 3.87Å; W120-I124 HydrophobicContact CZ2-CD1 3.88Å; W120-I124 HydrophobicContact CZ2-CG1 3.73Å; W120-I124 HydrophobicContact CZ3-CG1 4.13Å; W120-I124 WeakPolarHBondContact O-CG1 3.49Å; W120-I124 PolarHBondContact O-N 3.39Å; W120-D177 VanDerWaalsContact CH2-OD2 3.31Å; W120-D177 WeakPolarHBondContact CH2-OD2 3.5Å; W120-I179 HydrophobicContact CZ3-CG2 4.41Å
121T98Very high96.8Very high0 Ų046.9 Ų46.90%022%0.222CC..Hα-helixtrans-59.8-46.3179.3-59.10000111.3A106 V109 N110 E117 L118 S123 I124 Y125 I179A106-T121 HydrophobicContact CB-CG2 4.02Å; V109-T121 WeakPolarHBondContact O-CG2 3.46Å; N110-T121 HydrophobicContact CB-CG2 4.17Å; E117-T121 VanDerWaalsContact O-CB 3.29Å; E117-T121 WeakPolarHBondContact O-CB 3.47Å; E117-T121 PolarHBondContact O-N 3.17Å; E117-T121 PolarHBondContact O-OG1 3.09Å; L118-T121 PolarHBondContact O-N 3.41Å; T121-S123 VanDerWaalsContact C-N 3.3Å; T121-S123 PolarHBondContact O-N 2.98Å; T121-I124 WeakPolarHBondContact O-CB 3.46Å; T121-I124 PolarHBondContact O-N 3.07Å; T121-I124 VanDerWaalsContact O-N 3.12Å; T121-Y125 HydrophobicContact CG2-CD2 4.01Å; T121-Y125 HydrophobicContact CG2-CE2 3.37Å; T121-Y125 PolarHBondContact O-N 3.37Å; T121-Y125 VanDerWaalsContact O-N 3.11Å; T121-I179 HydrophobicContact CG2-CD1 4.37Å; T121-I179 HydrophobicContact CG2-CG2 4.33Å
122F98.5Very high96.9Very high27 Ų2744.6 Ų44.612%0.11821%0.213CC..Hα-helixtrans-55.6-45.4173.3168.8-106.4000111.9I42 T46 L99 C102 A103 A106 L118 W120 I124 Y125 L126I42-F122 HydrophobicContact CG2-CE1 3.69Å; I42-F122 HydrophobicContact CG2-CZ 4.12Å; T46-F122 HydrophobicContact CG2-CD1 3.96Å; T46-F122 HydrophobicContact CG2-CE1 3.99Å; L99-F122 HydrophobicContact CD2-CZ 4.01Å; C102-F122 HydrophobicContact CB-CD2 4.07Å; C102-F122 HydrophobicContact CB-CE2 3.98Å; A103-F122 HydrophobicContact CB-CD2 4.07Å; A103-F122 HydrophobicContact CB-CE2 4Å; A106-F122 HydrophobicContact CB-CB 3.85Å; L118-F122 VanDerWaalsContact O-CB 3.26Å; L118-F122 WeakPolarHBondContact O-CB 3.41Å; L118-F122 PolarHBondContact O-N 3.43Å; W120-F122 PolarHBondContact O-N 3.1Å; F122-I124 VanDerWaalsContact C-N 3.27Å; F122-I124 PolarHBondContact O-N 3.12Å; F122-Y125 PolarHBondContact O-N 2.92Å; F122-L126 HydrophobicContact CE1-CD2 3.92Å; F122-L126 HydrophobicContact CE2-CB 4.48Å; F122-L126 HydrophobicContact CE2-CD2 4.49Å; F122-L126 HydrophobicContact CZ-CB 4.42Å; F122-L126 HydrophobicContact CZ-CD2 3.72Å; F122-L126 WeakPolarHBondContact O-CB 3.32Å; F122-L126 PolarHBondContact O-N 3.34Å
123S98.4Very high97Very high0 Ų036.6 Ų36.60%018%0.183CC..Hα-helixtrans-62.4-34.8178.684.90000112.4T46 R47 L119 W120 T121 E127T46-S123 WeakPolarHBondContact OG1-CB 3.35Å; R47-S123 WeakPolarHBondContact CB-OG 3.34Å; R47-S123 PolarHBondContact NE-OG 2.93Å; R47-S123 PolarHBondContact NH2-O 3.34Å; L119-S123 WeakPolarHBondContact O-CB 3.3Å; L119-S123 PolarHBondContact O-N 2.94Å; W120-S123 WeakPolarHBondContact O-CB 3.45Å; W120-S123 PolarHBondContact O-N 3.4Å; W120-S123 VanDerWaalsContact O-N 3.09Å; W120-S123 PolarHBondContact O-OG 2.99Å; T121-S123 VanDerWaalsContact C-N 3.3Å; T121-S123 PolarHBondContact O-N 2.98Å; S123-E127 VanDerWaalsContact O-CB 3.26Å; S123-E127 WeakPolarHBondContact O-CB 3.13Å; S123-E127 PolarHBondContact O-N 3.37Å
124I98.2Very high97Very high10 Ų1029.3 Ų29.35%0.05115%0.151CC..Hα-helixtrans-66.9-48.1177.4-66.4-59.2000110.2W120 T121 F122 S128 I179 A183W120-I124 HydrophobicContact CD2-CG1 4.11Å; W120-I124 HydrophobicContact CE3-CG1 4.25Å; W120-I124 HydrophobicContact CH2-CD1 4.41Å; W120-I124 HydrophobicContact CH2-CG1 3.87Å; W120-I124 HydrophobicContact CZ2-CD1 3.88Å; W120-I124 HydrophobicContact CZ2-CG1 3.73Å; W120-I124 HydrophobicContact CZ3-CG1 4.13Å; W120-I124 WeakPolarHBondContact O-CG1 3.49Å; W120-I124 PolarHBondContact O-N 3.39Å; T121-I124 WeakPolarHBondContact O-CB 3.46Å; T121-I124 PolarHBondContact O-N 3.07Å; T121-I124 VanDerWaalsContact O-N 3.12Å; F122-I124 VanDerWaalsContact C-N 3.27Å; F122-I124 PolarHBondContact O-N 3.12Å; I124-S128 PolarHBondContact O-N 3.31Å; I124-I179 HydrophobicContact CG2-CG2 4.05Å; I124-A183 HydrophobicContact CG2-CB 3.43Å; I124-A183 VanDerWaalsContact CG2-CB 3.43Å
125Y98.3Very high96.9Very high18 Ų1825.5 Ų25.57%0.07113%0.134CC..Hα-helixtrans-65.4-46.1178-62.2-36.9000112.1L105 A106 V109 T121 F122 E127 S128 I179 A183L105-Y125 HydrophobicContact CB-CD2 4.05Å; L105-Y125 HydrophobicContact CB-CE2 4.12Å; L105-Y125 HydrophobicContact CD2-CD1 4.02Å; L105-Y125 HydrophobicContact CD2-CD2 3.85Å; L105-Y125 HydrophobicContact CD2-CE1 4.05Å; L105-Y125 HydrophobicContact CD2-CE2 3.87Å; L105-Y125 HydrophobicContact CD2-CG 3.95Å; L105-Y125 HydrophobicContact CG-CD2 3.86Å; L105-Y125 HydrophobicContact CG-CE2 3.58Å; L105-Y125 HydrophobicContact CG-CG 4.47Å; A106-Y125 HydrophobicContact CB-CD2 4.19Å; A106-Y125 HydrophobicContact CB-CE2 4.34Å; V109-Y125 WeakPolarHBondContact CG1-OH 3.37Å; V109-Y125 PolarHBondContact O-OH 3.38Å; T121-Y125 HydrophobicContact CG2-CD2 4.01Å; T121-Y125 HydrophobicContact CG2-CE2 3.37Å; T121-Y125 PolarHBondContact O-N 3.37Å; T121-Y125 VanDerWaalsContact O-N 3.11Å; F122-Y125 PolarHBondContact O-N 2.92Å; Y125-E127 PolarHBondContact O-N 2.94Å; Y125-S128 WeakPolarHBondContact O-CB 3.22Å; Y125-S128 PolarHBondContact O-N 3.41Å; Y125-S128 PolarHBondContact O-OG 3.01Å; Y125-I179 HydrophobicContact CE1-CG2 3.73Å; Y125-A183 HydrophobicContact CD1-CB 4.4Å
126L98.6Very high96.9Very high0 Ų023.8 Ų23.80%012%0.117CC..Hα-helixtrans-63.4-42-179.1-178.961.3000111.8I42 V43 L98 L99 C102 F122 S128 V129 A130I42-L126 HydrophobicContact CB-CD2 3.99Å; I42-L126 HydrophobicContact CG2-CD2 3.59Å; V43-L126 HydrophobicContact CG2-CB 3.92Å; V43-L126 HydrophobicContact CG2-CD2 3.84Å; V43-L126 HydrophobicContact CG2-CG 3.72Å; L98-L126 HydrophobicContact CB-CD1 4.21Å; L99-L126 HydrophobicContact CD2-CD1 3.83Å; L99-L126 HydrophobicContact CD2-CD2 3.68Å; L99-L126 HydrophobicContact CD2-CG 4.43Å; C102-L126 HydrophobicContact CB-CB 4.39Å; F122-L126 HydrophobicContact CE1-CD2 3.92Å; F122-L126 HydrophobicContact CE2-CB 4.48Å; F122-L126 HydrophobicContact CE2-CD2 4.49Å; F122-L126 HydrophobicContact CZ-CB 4.42Å; F122-L126 HydrophobicContact CZ-CD2 3.72Å; F122-L126 WeakPolarHBondContact O-CB 3.32Å; F122-L126 PolarHBondContact O-N 3.34Å; L126-S128 PolarHBondContact O-N 3.36Å; L126-V129 CarbonylContact O-C 3.59Å; L126-V129 WeakPolarHBondContact O-CG2 3.32Å; L126-V129 PolarHBondContact O-N 2.73Å; L126-V129 VanDerWaalsContact O-N 3.14Å; L126-A130 WeakPolarHBondContact O-CB 3.33Å; L126-A130 PolarHBondContact O-N 3.01Å
127E98.2Very high96.8Very high1 Ų120.7 Ų20.71%0.00510%0.099CC..Hα-helixtrans-59.6-35.2177.8-170.9179.1-131.200112F40 V43 R47 S123 Y125 V129 A130 Y158 Q187F40-E127 HydrophobicContact CE1-CG 4.33Å; V43-E127 HydrophobicContact CG1-CB 3.82Å; V43-E127 HydrophobicContact CG1-CG 4.15Å; V43-E127 HydrophobicContact CG2-CB 3.89Å; R47-E127 IonicContact CZ-OE1 2.76Å; R47-E127 IonicContact CZ-OE2 3.77Å; R47-E127 IonicContact NH1-OE1 2.76Å; R47-E127 PolarHBondContact NH1-OE1 3.48Å; R47-E127 IonicContact NH1-OE2 3.8Å; R47-E127 PolarHBondContact NH1-OE2 3.35Å; R47-E127 VanDerWaalsContact NH2-CD 3.27Å; R47-E127 IonicContact NH2-OE1 3.84Å; R47-E127 IonicContact NH2-OE2 3.43Å; R47-E127 PolarHBondContact NH2-OE2 3.09Å; S123-E127 VanDerWaalsContact O-CB 3.26Å; S123-E127 WeakPolarHBondContact O-CB 3.13Å; S123-E127 PolarHBondContact O-N 3.37Å; Y125-E127 PolarHBondContact O-N 2.94Å; E127-V129 PolarHBondContact O-N 3.28Å; E127-V129 VanDerWaalsContact O-N 3.17Å; E127-A130 PolarHBondContact O-N 3.35Å; E127-Y158 PolarHBondContact OE1-OH 3.13Å; E127-Q187 PolarHBondContact O-NE2 3.19Å
128S97.2Very high96.6Very high5 Ų518.8 Ų18.84%0.0359%0.09CC..Hα-helixtrans-61.1-27.2-179.776.10000113.5I124 Y125 L126 A183 L190I124-S128 PolarHBondContact O-N 3.31Å; Y125-S128 WeakPolarHBondContact O-CB 3.22Å; Y125-S128 PolarHBondContact O-N 3.41Å; Y125-S128 PolarHBondContact O-OG 3.01Å; L126-S128 PolarHBondContact O-N 3.36Å; S128-A183 VanDerWaalsContact CB-O 3.25Å; S128-A183 WeakPolarHBondContact CB-O 3.4Å; S128-L190 VanDerWaalsContact O-CD1 3.29Å; S128-L190 WeakPolarHBondContact O-CD1 3.36Å
129V98Very high96.3Very high22 Ų2221.3 Ų21.313%0.13311%0.11CC..Hα-helixtrans-117.7-2.8-177.1-64.40000113.7L98 L126 E127 I131 L132 L186 L190L98-V129 HydrophobicContact CB-CG2 4.15Å; L98-V129 HydrophobicContact CD1-CG2 4.37Å; L98-V129 HydrophobicContact CD2-CB 4.26Å; L98-V129 HydrophobicContact CD2-CG2 4.14Å; L98-V129 HydrophobicContact CG-CG2 4.44Å; L126-V129 CarbonylContact O-C 3.59Å; L126-V129 WeakPolarHBondContact O-CG2 3.32Å; L126-V129 PolarHBondContact O-N 2.73Å; L126-V129 VanDerWaalsContact O-N 3.14Å; E127-V129 PolarHBondContact O-N 3.28Å; E127-V129 VanDerWaalsContact O-N 3.17Å; V129-I131 PolarHBondContact O-N 2.99Å; V129-L132 HydrophobicContact CB-CD1 3.85Å; V129-L132 HydrophobicContact CB-CG 4.33Å; V129-L132 HydrophobicContact CG1-CD1 4.18Å; V129-L132 WeakPolarHBondContact O-CB 3.36Å; V129-L132 WeakPolarHBondContact O-CG 2.98Å; V129-L132 PolarHBondContact O-N 3.03Å; V129-L186 HydrophobicContact CG1-CD2 4.36Å; V129-L190 HydrophobicContact CG1-CD1 4.38Å
130A97.8Very high95.9Very high0 Ų023.3 Ų23.30%012%0.116CC..THydrogen-bonded Turntrans-59.6-21.6-175.500000113.8S36 A39 F40 L126 E127 P133S36-A130 WeakPolarHBondContact CA-O 3.37Å; S36-A130 VanDerWaalsContact CB-O 3.31Å; S36-A130 WeakPolarHBondContact CB-O 3.43Å; S36-A130 PolarHBondContact OG-O 3.13Å; A39-A130 HydrophobicContact CB-CB 3.7Å; F40-A130 HydrophobicContact CD1-CB 3.86Å; F40-A130 HydrophobicContact CD2-CB 4.46Å; F40-A130 HydrophobicContact CE1-CB 3.61Å; F40-A130 HydrophobicContact CE2-CB 4.24Å; F40-A130 HydrophobicContact CG-CB 4.27Å; F40-A130 HydrophobicContact CZ-CB 3.8Å; L126-A130 WeakPolarHBondContact O-CB 3.33Å; L126-A130 PolarHBondContact O-N 3.01Å; E127-A130 PolarHBondContact O-N 3.35Å; A130-P133 WeakPolarHBondContact O-CD 3.46Å
131I95.8Very high95.5Very high0 Ų022.8 Ų22.80%012%0.12CC..THydrogen-bonded Turntrans-81.7-14.9178.1-159.164.6000114.1F40 V129 Q134 L135 L152 L155 Y191F40-I131 HydrophobicContact CE2-CD1 4.04Å; F40-I131 HydrophobicContact CZ-CB 4.39Å; F40-I131 HydrophobicContact CZ-CD1 4.24Å; V129-I131 PolarHBondContact O-N 2.99Å; I131-Q134 HydrophobicContact CD1-CB 3.88Å; I131-Q134 HydrophobicContact CD1-CG 4.16Å; I131-Q134 HydrophobicContact CG1-CB 4.35Å; I131-Q134 WeakPolarHBondContact O-CB 3.38Å; I131-Q134 PolarHBondContact O-N 3.13Å; I131-L135 HydrophobicContact CG1-CG 4.2Å; I131-L135 HydrophobicContact CG2-CD1 3.93Å; I131-L135 HydrophobicContact CG2-CG 4.35Å; I131-L135 PolarHBondContact O-N 3.14Å; I131-L152 HydrophobicContact CD1-CD2 3.63Å; I131-L152 HydrophobicContact CG1-CD2 4.22Å; I131-L155 HydrophobicContact CD1-CD2 3.99Å; I131-Y191 HydrophobicContact CB-CE2 4.39Å; I131-Y191 WeakPolarHBondContact CB-OH 3.46Å; I131-Y191 HydrophobicContact CD1-CE1 4.44Å; I131-Y191 WeakPolarHBondContact CD1-OH 3.36Å; I131-Y191 HydrophobicContact CG1-CE1 3.88Å; I131-Y191 WeakPolarHBondContact CG1-OH 3.43Å; I131-Y191 HydrophobicContact CG2-CE2 3.99Å
132L96.3Very high94.8Very high44 Ų4424 Ų2423%0.2313%0.133CC..Hα-helixtrans-54.1-42.7-175.6-71178.6000113.8F93 L98 V129 Q134 L135 F136 L190F93-L132 HydrophobicContact CE2-CB 4.14Å; F93-L132 HydrophobicContact CZ-CB 4.12Å; F93-L132 HydrophobicContact CZ-CD1 4.47Å; L98-L132 HydrophobicContact CD1-CB 4.41Å; L98-L132 HydrophobicContact CD2-CD1 3.84Å; V129-L132 HydrophobicContact CB-CD1 3.85Å; V129-L132 HydrophobicContact CB-CG 4.33Å; V129-L132 HydrophobicContact CG1-CD1 4.18Å; V129-L132 WeakPolarHBondContact O-CB 3.36Å; V129-L132 WeakPolarHBondContact O-CG 2.98Å; V129-L132 PolarHBondContact O-N 3.03Å; L132-Q134 VanDerWaalsContact C-N 3.32Å; L132-Q134 PolarHBondContact O-N 2.9Å; L132-L135 PolarHBondContact O-N 3.45Å; L132-F136 VanDerWaalsContact O-CB 3.25Å; L132-F136 WeakPolarHBondContact O-CB 3.41Å; L132-F136 PolarHBondContact O-N 3.02Å; L132-L190 HydrophobicContact CD2-CD1 3.89Å; L132-L190 HydrophobicContact CD2-CD2 3.85Å; L132-L190 HydrophobicContact CD2-CG 4.43Å; L132-L190 HydrophobicContact CG-CD1 4.19Å
133P96.4Very high93.8Very high0 Ų029 Ų290%016%0.157CC..Hα-helixtrans-57.7-40.2174.5-25.233.5000114S33 R35 S36 F93 L98 A130 F136 L137S33-P133 VanDerWaalsContact OG-CB 3.27Å; S33-P133 WeakPolarHBondContact OG-CB 3.5Å; R35-P133 HydrophobicContact CB-CB 3.9Å; R35-P133 HydrophobicContact CB-CG 4.2Å; S36-P133 WeakPolarHBondContact OG-CB 3.31Å; S36-P133 WeakPolarHBondContact OG-CD 3.39Å; F93-P133 HydrophobicContact CB-CB 3.83Å; F93-P133 HydrophobicContact CB-CG 4.14Å; F93-P133 HydrophobicContact CD1-CB 4.42Å; F93-P133 HydrophobicContact CD1-CG 3.8Å; F93-P133 HydrophobicContact CE1-CG 4.49Å; F93-P133 HydrophobicContact CG-CB 4.14Å; F93-P133 HydrophobicContact CG-CG 3.98Å; L98-P133 HydrophobicContact CD1-CG 4.22Å; A130-P133 WeakPolarHBondContact O-CD 3.46Å; P133-F136 PolarHBondContact O-N 2.96Å; P133-L137 WeakPolarHBondContact O-CB 3.35Å; P133-L137 PolarHBondContact O-N 3.44Å
134Q95.4Very high92.9Very high0 Ų029.5 Ų29.50%016%0.161CC..Hα-helixtrans-69-41.7177.2-178.563.569.800112.8G31 S36 I131 L132 F136 L137 I138 L152G31-Q134 PolarHBondContact O-NE2 3.16Å; S36-Q134 WeakPolarHBondContact OG-CB 3.41Å; S36-Q134 PolarHBondContact OG-N 2.9Å; I131-Q134 HydrophobicContact CD1-CB 3.88Å; I131-Q134 HydrophobicContact CD1-CG 4.16Å; I131-Q134 HydrophobicContact CG1-CB 4.35Å; I131-Q134 WeakPolarHBondContact O-CB 3.38Å; I131-Q134 PolarHBondContact O-N 3.13Å; L132-Q134 VanDerWaalsContact C-N 3.32Å; L132-Q134 PolarHBondContact O-N 2.9Å; Q134-F136 VanDerWaalsContact C-N 3.33Å; Q134-L137 PolarHBondContact O-N 3.49Å; Q134-I138 HydrophobicContact CG-CD1 4.33Å; Q134-I138 WeakPolarHBondContact O-CG1 3.31Å; Q134-I138 PolarHBondContact O-N 3.2Å; Q134-I138 VanDerWaalsContact O-N 3.09Å; Q134-L152 HydrophobicContact CG-CD1 4.45Å; Q134-L152 HydrophobicContact CG-CD2 3.93Å
135L93.1Very high92.2Very high39 Ų3933.2 Ų33.220%0.20418%0.178CC..Hα-helixtrans-65-40.7175.1-65.2178.5000111I131 L132 I138 S139 L190 F194I131-L135 HydrophobicContact CG1-CG 4.2Å; I131-L135 HydrophobicContact CG2-CD1 3.93Å; I131-L135 HydrophobicContact CG2-CG 4.35Å; I131-L135 PolarHBondContact O-N 3.14Å; L132-L135 PolarHBondContact O-N 3.45Å; L135-I138 PolarHBondContact O-N 3.02Å; L135-S139 WeakPolarHBondContact O-CB 3.15Å; L135-S139 PolarHBondContact O-N 3.45Å; L135-L190 WeakPolarHBondContact CD1-O 2.82Å; L135-F194 HydrophobicContact CD2-CB 4.4Å
136F93.2Very high91.4Very high75 Ų7535.7 Ų35.733%0.32920%0.195SC..Hα-helixtrans-64.2-40.3175.9-174.8-100.4000112.4F93 L132 P133 Q134 S139 K140F93-F136 HydrophobicContact CB-CD1 4.15Å; F93-F136 HydrophobicContact CD2-CB 3.86Å; F93-F136 HydrophobicContact CD2-CD1 4.21Å; F93-F136 HydrophobicContact CD2-CD2 4.33Å; F93-F136 AromaticContact CD2-CG 3.89Å; F93-F136 HydrophobicContact CD2-CG 3.89Å; L132-F136 VanDerWaalsContact O-CB 3.25Å; L132-F136 WeakPolarHBondContact O-CB 3.41Å; L132-F136 PolarHBondContact O-N 3.02Å; P133-F136 PolarHBondContact O-N 2.96Å; Q134-F136 VanDerWaalsContact C-N 3.33Å; F136-S139 PolarHBondContact O-N 3.26Å; F136-K140 HydrophobicContact CD1-CD 4.12Å; F136-K140 HydrophobicContact CE1-CD 3.57Å; F136-K140 HydrophobicContact CE1-CG 4.24Å; F136-K140 HydrophobicContact CZ-CD 4.04Å; F136-K140 HydrophobicContact CZ-CG 4.46Å; F136-K140 PolarHBondContact O-N 3.47Å
137L93.5Very high90.7Very high1 Ų139.4 Ų39.41%0.00521%0.214CC..Hα-helixtrans-58.5-50.7173.5176.866.5000110.9G31 H90 D91 P133 Q134 S139 K140 T141G31-L137 WeakPolarHBondContact O-CD2 3.35Å; H90-L137 HydrophobicContact CB-CD1 3.52Å; D91-L137 HydrophobicContact CB-CD1 4.34Å; P133-L137 WeakPolarHBondContact O-CB 3.35Å; P133-L137 PolarHBondContact O-N 3.44Å; Q134-L137 PolarHBondContact O-N 3.49Å; L137-S139 VanDerWaalsContact C-N 3.28Å; L137-S139 PolarHBondContact O-N 2.99Å; L137-K140 WeakPolarHBondContact O-CB 3.3Å; L137-K140 PolarHBondContact O-N 3.28Å; L137-T141 HydrophobicContact CD1-CG2 4Å; L137-T141 HydrophobicContact CG-CG2 4.47Å; L137-T141 PolarHBondContact O-N 3.47Å; L137-T141 PolarHBondContact O-OG1 2.94Å; L137-T141 VanDerWaalsContact O-OG1 3.12Å
138I92Very high90.3Very high7 Ų739.5 Ų39.54%0.03622%0.215CC..Hα-helixtrans-61.4-39.5179.2-67.4167.5000111Q134 L135 K140 T141 G142 A144 L152 F208 L210Q134-I138 HydrophobicContact CG-CD1 4.33Å; Q134-I138 WeakPolarHBondContact O-CG1 3.31Å; Q134-I138 PolarHBondContact O-N 3.2Å; Q134-I138 VanDerWaalsContact O-N 3.09Å; L135-I138 PolarHBondContact O-N 3.02Å; I138-K140 VanDerWaalsContact C-N 3.26Å; I138-K140 PolarHBondContact O-N 3.44Å; I138-T141 PolarHBondContact O-N 3.3Å; I138-G142 PolarHBondContact O-N 2.91Å; I138-A144 HydrophobicContact CD1-CB 4.04Å; I138-A144 HydrophobicContact CG1-CB 4.11Å; I138-A144 HydrophobicContact CG2-CB 4.2Å; I138-L152 HydrophobicContact CD1-CD1 3.46Å; I138-L152 VanDerWaalsContact CD1-CD1 3.46Å; I138-F208 HydrophobicContact CG2-CD1 4.26Å; I138-F208 HydrophobicContact CG2-CE1 3.68Å; I138-L210 HydrophobicContact CG2-CD1 4.5Å
139S89.4Confident89.9Confident80 Ų8039.3 Ų39.356%0.55921%0.214SC*.Hα-helixtrans-61.8-33.1174.3-174.50000113.2L135 F136 L137L135-S139 WeakPolarHBondContact O-CB 3.15Å; L135-S139 PolarHBondContact O-N 3.45Å; F136-S139 PolarHBondContact O-N 3.26Å; L137-S139 VanDerWaalsContact C-N 3.28Å; L137-S139 PolarHBondContact O-N 2.99Å
140K89.2Confident89.7Confident96 Ų9641.6 Ų41.642%0.41722%0.223SC..Hα-helixtrans-81-39.4178.2-80.8-169.9159.1-169.50113.3T92 F136 L137 I138T92-K140 PolarHBondContact OG1-NZ 2.94Å; F136-K140 HydrophobicContact CD1-CD 4.12Å; F136-K140 HydrophobicContact CE1-CD 3.57Å; F136-K140 HydrophobicContact CE1-CG 4.24Å; F136-K140 HydrophobicContact CZ-CD 4.04Å; F136-K140 HydrophobicContact CZ-CG 4.46Å; F136-K140 PolarHBondContact O-N 3.47Å; L137-K140 WeakPolarHBondContact O-CB 3.3Å; L137-K140 PolarHBondContact O-N 3.28Å; I138-K140 VanDerWaalsContact C-N 3.26Å; I138-K140 PolarHBondContact O-N 3.44Å
141T89.7Confident89.5Confident53 Ų5341.9 Ų41.933%0.32522%0.224SC..Hα-helixtrans-82.1-16.6-178.456.80000112.6H90 L137 I138 E143H90-T141 HydrophobicContact CB-CG2 3.98Å; L137-T141 HydrophobicContact CD1-CG2 4Å; L137-T141 HydrophobicContact CG-CG2 4.47Å; L137-T141 PolarHBondContact O-N 3.47Å; L137-T141 PolarHBondContact O-OG1 2.94Å; L137-T141 VanDerWaalsContact O-OG1 3.12Å; I138-T141 PolarHBondContact O-N 3.3Å; T141-E143 PolarHBondContact O-N 3Å; T141-E143 VanDerWaalsContact O-N 3.09Å; T141-E143 PolarHBondContact OG1-O 2.86Å; T141-E143 VanDerWaalsContact OG1-O 3.11Å
142G82.8Confident89.4Confident27 Ų2741.9 Ų41.928%0.27822%0.224SC..SBendtrans77.7-18178.300000114.5I138 A209 L210I138-G142 PolarHBondContact O-N 2.91Å; G142-A209 WeakPolarHBondContact O-CA 3.18Å; G142-L210 PolarHBondContact O-N 3.46Å
143E78.6Confident89.2Confident130 Ų13042.7 Ų42.761%0.60723%0.226SC*.EExtended strand (participates in β ladder)trans-135.8152.3-177.5-61.6-172.3166.200112.4T141 F208 A209T141-E143 PolarHBondContact O-N 3Å; T141-E143 VanDerWaalsContact O-N 3.09Å; T141-E143 PolarHBondContact OG1-O 2.86Å; T141-E143 VanDerWaalsContact OG1-O 3.11Å; E143-F208 WeakPolarHBondContact CA-O 3.27Å; E143-A209 HydrophobicContact CG-CB 4.36Å
144A78.6Confident89.2Confident12 Ų1243.6 Ų43.610%0.09923%0.232CC..EExtended strand (participates in β ladder)trans-127.8136.2168.100000110.2I138 F208I138-A144 HydrophobicContact CD1-CB 4.04Å; I138-A144 HydrophobicContact CG1-CB 4.11Å; I138-A144 HydrophobicContact CG2-CB 4.2Å; A144-F208 HydrophobicContact CB-CB 4.26Å; A144-F208 HydrophobicContact CB-CD1 3.68Å; A144-F208 HydrophobicContact CB-CE1 4.37Å; A144-F208 HydrophobicContact CB-CG 4.13Å; A144-F208 PolarHBondContact N-O 3.13Å; A144-F208 VanDerWaalsContact N-O 3.09Å
145E84.2Confident89.1Confident88 Ų8843.8 Ų43.841%0.41123%0.233SC..  trans-59.2140.1172.2-63.7178.7148.700110.5K22 I147 T148 S149K22-E145 WeakPolarHBondContact CE-OE2 3.41Å; K22-E145 IonicContact NZ-OE2 3.05Å; K22-E145 PolarHBondContact NZ-OE2 2.97Å; E145-I147 PolarHBondContact O-N 3.45Å; E145-I147 VanDerWaalsContact O-N 3.11Å; E145-T148 WeakPolarHBondContact O-CA 3.22Å; E145-T148 VanDerWaalsContact O-CB 3.29Å; E145-T148 WeakPolarHBondContact O-CB 3.3Å; E145-T148 PolarHBondContact O-N 3.4Å; E145-S149 PolarHBondContact O-N 3.31Å; E145-S149 PolarHBondContact O-OG 3.36Å
146T81.1Confident89.2Confident69 Ų6942 Ų4242%0.42322%0.223SC..Hα-helixtrans-51.9-39.6-178-54.50000113.4S149 H150 V202T146-S149 WeakPolarHBondContact O-CB 3.25Å; T146-S149 PolarHBondContact O-N 3.07Å; T146-H150 PolarHBondContact O-CD2 3.03Å; T146-H150 VanDerWaalsContact O-CD2 3.24Å; T146-H150 PolarHBondContact O-N 3.24Å; T146-V202 HydrophobicContact CG2-CG1 3.95Å
147I85.1Confident89.3Confident78 Ų7839.7 Ų39.740%0.422%0.217SC..Hα-helixtrans-66.3-39.9178.3-56.6175.8000111.2I18 K22 E145 S149 H150 Y151I18-I147 HydrophobicContact CG2-CG2 3.98Å; K22-I147 HydrophobicContact CB-CG2 3.69Å; K22-I147 HydrophobicContact CG-CB 4.09Å; K22-I147 HydrophobicContact CG-CG2 3.57Å; E145-I147 PolarHBondContact O-N 3.45Å; E145-I147 VanDerWaalsContact O-N 3.11Å; I147-S149 VanDerWaalsContact C-N 3.26Å; I147-S149 PolarHBondContact O-N 3.19Å; I147-H150 PolarHBondContact O-N 3.27Å; I147-Y151 PolarHBondContact O-N 2.8Å
148T88.4Confident89.4Confident4 Ų439.8 Ų39.83%0.02522%0.217CC..Hα-helixtrans-62.7-37.6173.9-57.90000110.3L32 E145 H150 Y151 L152L32-T148 HydrophobicContact CD2-CG2 3.81Å; E145-T148 WeakPolarHBondContact O-CA 3.22Å; E145-T148 VanDerWaalsContact O-CB 3.29Å; E145-T148 WeakPolarHBondContact O-CB 3.3Å; E145-T148 PolarHBondContact O-N 3.4Å; T148-H150 PolarHBondContact O-N 3.21Å; T148-Y151 HydrophobicContact CG2-CD1 4.45Å; T148-Y151 WeakPolarHBondContact O-CB 3.41Å; T148-Y151 PolarHBondContact O-N 3.5Å; T148-L152 HydrophobicContact CG2-CD1 4.3Å; T148-L152 WeakPolarHBondContact O-CG 3.43Å; T148-L152 PolarHBondContact O-N 3Å
149S90.2Very high89.4Confident0 Ų039.9 Ų39.90%022%0.217CC..Hα-helixtrans-63.7-39.7174.6-45.40000112.6E145 T146 I147 L152 F153 F194E145-S149 PolarHBondContact O-N 3.31Å; E145-S149 PolarHBondContact O-OG 3.36Å; T146-S149 WeakPolarHBondContact O-CB 3.25Å; T146-S149 PolarHBondContact O-N 3.07Å; I147-S149 VanDerWaalsContact C-N 3.26Å; I147-S149 PolarHBondContact O-N 3.19Å; S149-L152 PolarHBondContact O-N 3.38Å; S149-F153 WeakPolarHBondContact O-CB 3.49Å; S149-F153 PolarHBondContact O-N 2.93Å; S149-F194 VanDerWaalsContact O-CZ 3.32Å; S149-F194 WeakPolarHBondContact O-CZ 3.41Å
150H92.7Very high89.6Confident71 Ų7137.2 Ų37.233%0.32920%0.202SC..Hα-helixtrans-62.8-43.1173.6-66.3-51000112.5T146 I147 T148 L152 F153 S154 Y198T146-H150 PolarHBondContact O-CD2 3.03Å; T146-H150 VanDerWaalsContact O-CD2 3.24Å; T146-H150 PolarHBondContact O-N 3.24Å; I147-H150 PolarHBondContact O-N 3.27Å; T148-H150 PolarHBondContact O-N 3.21Å; H150-L152 PolarHBondContact O-N 2.9Å; H150-F153 PolarHBondContact O-N 3.11Å; H150-S154 PolarHBondContact O-N 2.95Å; H150-S154 PolarHBondContact O-OG 3.27Å; H150-Y198 PolarHBondContact CE1-OH 2.92Å; H150-Y198 VanDerWaalsContact CE1-OH 3.31Å; H150-Y198 AromaticContact ND1-CE2 3.7Å; H150-Y198 AromaticContact ND1-CZ 3.64Å; H150-Y198 PolarHBondContact ND1-OH 3.42Å
151Y93.5Very high89.9Confident6 Ų634.5 Ų34.52%0.02419%0.192CC..Hα-helixtrans-55.4-51.5173.6150.1-112.1000111.5A15 L19 Q37 I147 T148 F153 S154 L155A15-Y151 HydrophobicContact CB-CD2 4.02Å; A15-Y151 HydrophobicContact CB-CE2 4.36Å; A15-Y151 WeakPolarHBondContact O-CD2 3.25Å; L19-Y151 HydrophobicContact CB-CD2 3.91Å; L19-Y151 HydrophobicContact CB-CE2 4.22Å; L19-Y151 HydrophobicContact CB-CG 4.32Å; L19-Y151 HydrophobicContact CD1-CD1 4.27Å; L19-Y151 HydrophobicContact CD1-CE1 4.35Å; L19-Y151 HydrophobicContact CD1-CG 4.35Å; L19-Y151 HydrophobicContact CD2-CD2 4.42Å; L19-Y151 HydrophobicContact CD2-CE2 3.92Å; L19-Y151 HydrophobicContact CG-CE2 4.49Å; Q37-Y151 PolarHBondContact NE2-OH 3.18Å; Q37-Y151 VanDerWaalsContact NE2-OH 3.12Å; I147-Y151 PolarHBondContact O-N 2.8Å; T148-Y151 HydrophobicContact CG2-CD1 4.45Å; T148-Y151 WeakPolarHBondContact O-CB 3.41Å; T148-Y151 PolarHBondContact O-N 3.5Å; Y151-F153 VanDerWaalsContact C-N 3.32Å; Y151-F153 PolarHBondContact O-N 3.3Å; Y151-S154 PolarHBondContact O-N 3.38Å; Y151-L155 HydrophobicContact CE2-CB 4.32Å; Y151-L155 HydrophobicContact CE2-CD2 3.82Å; Y151-L155 WeakPolarHBondContact O-CB 3.27Å; Y151-L155 PolarHBondContact O-N 3.44Å; Y151-L155 WeakPolarHBondContact OH-CD2 3.4Å
152L93.3Very high90.1Very high0 Ų033.9 Ų33.90%018%0.184CC..Hα-helixtrans-63.7-38.3-179.5-71.7174.7000112.3I131 Q134 I138 T148 S149 H150 L155 G156 Y191 F194I131-L152 HydrophobicContact CD1-CD2 3.63Å; I131-L152 HydrophobicContact CG1-CD2 4.22Å; Q134-L152 HydrophobicContact CG-CD1 4.45Å; Q134-L152 HydrophobicContact CG-CD2 3.93Å; I138-L152 HydrophobicContact CD1-CD1 3.46Å; I138-L152 VanDerWaalsContact CD1-CD1 3.46Å; T148-L152 HydrophobicContact CG2-CD1 4.3Å; T148-L152 WeakPolarHBondContact O-CG 3.43Å; T148-L152 PolarHBondContact O-N 3Å; S149-L152 PolarHBondContact O-N 3.38Å; H150-L152 PolarHBondContact O-N 2.9Å; L152-L155 PolarHBondContact O-N 3.06Å; L152-G156 PolarHBondContact O-N 2.97Å; L152-Y191 HydrophobicContact CD2-CE1 4.44Å; L152-F194 HydrophobicContact CB-CD1 4.1Å; L152-F194 HydrophobicContact CB-CD2 4.38Å; L152-F194 HydrophobicContact CB-CE1 3.48Å; L152-F194 VanDerWaalsContact CB-CE1 3.48Å; L152-F194 HydrophobicContact CB-CE2 3.79Å; L152-F194 HydrophobicContact CB-CZ 3.32Å; L152-F194 HydrophobicContact CD1-CD2 3.98Å; L152-F194 HydrophobicContact CD1-CE2 3.5Å; L152-F194 VanDerWaalsContact CD1-CE2 3.5Å; L152-F194 HydrophobicContact CD1-CZ 3.94Å; L152-F194 HydrophobicContact CG-CE2 4.3Å; L152-F194 HydrophobicContact CG-CZ 4.26Å
153F93.9Very high90.6Very high60 Ų6034.3 Ų34.326%0.26318%0.18SC..Hα-helixtrans-63.7-47.7176.2-178.1-96.8000111.5S149 H150 Y151 L155 G156 S157 F194 F195 Y198S149-F153 WeakPolarHBondContact O-CB 3.49Å; S149-F153 PolarHBondContact O-N 2.93Å; H150-F153 PolarHBondContact O-N 3.11Å; Y151-F153 VanDerWaalsContact C-N 3.32Å; Y151-F153 PolarHBondContact O-N 3.3Å; F153-L155 VanDerWaalsContact C-N 3.3Å; F153-L155 PolarHBondContact O-N 3.3Å; F153-G156 PolarHBondContact O-N 3.44Å; F153-S157 VanDerWaalsContact O-CB 3.23Å; F153-S157 WeakPolarHBondContact O-CB 3.32Å; F153-S157 PolarHBondContact O-N 3.42Å; F153-S157 PolarHBondContact O-OG 3.3Å; F153-F194 HydrophobicContact CB-CE1 4.14Å; F153-F195 AromaticContact CD2-CD1 3.74Å; F153-F195 HydrophobicContact CD2-CD1 3.74Å; F153-F195 AromaticContact CD2-CE1 3.97Å; F153-F195 HydrophobicContact CD2-CE1 3.97Å; F153-F195 HydrophobicContact CE2-CD1 4.05Å; F153-F195 HydrophobicContact CE2-CE1 4.32Å; F153-Y198 HydrophobicContact CB-CD1 4.22Å; F153-Y198 HydrophobicContact CB-CD2 4.17Å; F153-Y198 HydrophobicContact CB-CE1 3.99Å; F153-Y198 HydrophobicContact CB-CE2 3.94Å; F153-Y198 HydrophobicContact CB-CG 4.3Å; F153-Y198 AromaticContact CD1-CE1 3.97Å; F153-Y198 HydrophobicContact CD1-CE1 3.97Å; F153-Y198 AromaticContact CD2-CD1 3.27Å; F153-Y198 HydrophobicContact CD2-CD1 3.27Å; F153-Y198 AromaticContact CD2-CE1 3.4Å; F153-Y198 HydrophobicContact CD2-CE1 3.4Å; F153-Y198 AromaticContact CD2-CG 3.92Å; F153-Y198 HydrophobicContact CD2-CG 3.92Å; F153-Y198 HydrophobicContact CE1-CE1 4.33Å; F153-Y198 AromaticContact CE2-CD1 3.74Å; F153-Y198 HydrophobicContact CE2-CD1 3.74Å; F153-Y198 AromaticContact CE2-CE1 3.82Å; F153-Y198 HydrophobicContact CE2-CE1 3.82Å; F153-Y198 AromaticContact CG-CD1 3.8Å; F153-Y198 HydrophobicContact CG-CD1 3.8Å; F153-Y198 AromaticContact CG-CE1 3.49Å; F153-Y198 HydrophobicContact CG-CE1 3.49Å; F153-Y198 VanDerWaalsContact CG-CE1 3.49Å; F153-Y198 HydrophobicContact CG-CE2 4.36Å; F153-Y198 HydrophobicContact CG-CG 4.35Å; F153-Y198 AromaticContact CG-CZ 3.78Å; F153-Y198 HydrophobicContact CZ-CE1 4.26Å
154S94.8Very high91.4Very high20 Ų2031.9 Ų31.914%0.1417%0.17CC..Hα-helixtrans-62.7-37.7175.7-64.80000112.2S11 H150 Y151 Y158S11-S154 PolarHBondContact OG-O 3.14Å; H150-S154 PolarHBondContact O-N 2.95Å; H150-S154 PolarHBondContact O-OG 3.27Å; Y151-S154 PolarHBondContact O-N 3.38Å; S154-Y158 PolarHBondContact O-N 3.46Å
155L94.5Very high92.2Very high4 Ų431.5 Ų31.52%0.02117%0.167CC..Hα-helixtrans-70.6-42.3178.3-167.368.8000112A15 F40 I131 Y151 L152 F153 Y158 Y191A15-L155 HydrophobicContact CB-CB 3.94Å; A15-L155 HydrophobicContact CB-CD1 4.1Å; F40-L155 HydrophobicContact CE2-CD2 3.99Å; F40-L155 HydrophobicContact CZ-CD2 3.76Å; I131-L155 HydrophobicContact CD1-CD2 3.99Å; Y151-L155 HydrophobicContact CE2-CB 4.32Å; Y151-L155 HydrophobicContact CE2-CD2 3.82Å; Y151-L155 WeakPolarHBondContact O-CB 3.27Å; Y151-L155 PolarHBondContact O-N 3.44Å; Y151-L155 WeakPolarHBondContact OH-CD2 3.4Å; L152-L155 PolarHBondContact O-N 3.06Å; F153-L155 VanDerWaalsContact C-N 3.3Å; F153-L155 PolarHBondContact O-N 3.3Å; L155-Y158 HydrophobicContact CD1-CD1 3.89Å; L155-Y158 HydrophobicContact CD1-CE1 3.53Å; L155-Y158 HydrophobicContact CG-CD1 4.37Å; L155-Y158 HydrophobicContact CG-CE1 4.01Å; L155-Y158 WeakPolarHBondContact O-CD1 3.41Å; L155-Y158 WeakPolarHBondContact O-CE1 3.34Å; L155-Y191 WeakPolarHBondContact CD2-OH 3.42Å; L155-Y191 WeakPolarHBondContact CG-OH 3.37Å
156G94.4Very high92.7Very high0 Ų028.6 Ų28.60%015%0.152CC..Hα-helixtrans-65.7-42.2173.600000111.5L152 F153 Y158 R159 G160 F195L152-G156 PolarHBondContact O-N 2.97Å; F153-G156 PolarHBondContact O-N 3.44Å; G156-Y158 VanDerWaalsContact C-N 3.26Å; G156-Y158 PolarHBondContact O-N 2.93Å; G156-R159 PolarHBondContact O-N 2.68Å; G156-R159 VanDerWaalsContact O-N 3.11Å; G156-G160 PolarHBondContact O-N 2.95Å; G156-F195 VanDerWaalsContact C-CZ 3.41Å
157S94.8Very high93.3Very high27 Ų2729.4 Ų29.419%0.18915%0.153CC..Hα-helixtrans-61.6-33-174.5-65.10000112.6F153 R159 G160 L161F153-S157 VanDerWaalsContact O-CB 3.23Å; F153-S157 WeakPolarHBondContact O-CB 3.32Å; F153-S157 PolarHBondContact O-N 3.42Å; F153-S157 PolarHBondContact O-OG 3.3Å; S157-R159 VanDerWaalsContact C-N 3.27Å; S157-R159 PolarHBondContact O-N 2.85Å; S157-G160 PolarHBondContact O-N 3.47Å; S157-L161 WeakPolarHBondContact O-CG 3.43Å; S157-L161 PolarHBondContact O-N 3.5Å
158Y95.4Very high93.8Very high4 Ų430.1 Ų30.12%0.01615%0.151CC..Hα-helixtrans-61.1-38177.893.4-107000111.7G8 H12 E127 S154 L155 G156 L161 Y162 Q187G8-Y158 VanDerWaalsContact O-CB 3.25Å; G8-Y158 WeakPolarHBondContact O-CB 3.39Å; H12-Y158 HydrophobicContact CB-CD1 4Å; H12-Y158 HydrophobicContact CB-CD2 4.41Å; H12-Y158 HydrophobicContact CB-CG 3.9Å; H12-Y158 AromaticContact CD2-CD1 4Å; H12-Y158 AromaticContact CG-CD1 3.86Å; E127-Y158 PolarHBondContact OE1-OH 3.13Å; S154-Y158 PolarHBondContact O-N 3.46Å; L155-Y158 HydrophobicContact CD1-CD1 3.89Å; L155-Y158 HydrophobicContact CD1-CE1 3.53Å; L155-Y158 HydrophobicContact CG-CD1 4.37Å; L155-Y158 HydrophobicContact CG-CE1 4.01Å; L155-Y158 WeakPolarHBondContact O-CD1 3.41Å; L155-Y158 WeakPolarHBondContact O-CE1 3.34Å; G156-Y158 VanDerWaalsContact C-N 3.26Å; G156-Y158 PolarHBondContact O-N 2.93Å; Y158-L161 PolarHBondContact O-N 3.21Å; Y158-Y162 HydrophobicContact CD2-CD2 4.15Å; Y158-Y162 HydrophobicContact CD2-CE2 4.45Å; Y158-Y162 VanDerWaalsContact O-CD2 3.29Å; Y158-Y162 WeakPolarHBondContact O-CD2 2.87Å; Y158-Y162 PolarHBondContact O-N 3.09Å; Y158-Q187 PolarHBondContact OH-NE2 2.97Å
159R92.6Very high94Very high9 Ų932.4 Ų32.43%0.03416%0.159CC..Hα-helixtrans-71.2-40.2177.9-67.2-58.6-67.2-179.3-21.2112.9G156 S157 L161 Y162 I163 Q187G156-R159 PolarHBondContact O-N 2.68Å; G156-R159 VanDerWaalsContact O-N 3.11Å; S157-R159 VanDerWaalsContact C-N 3.27Å; S157-R159 PolarHBondContact O-N 2.85Å; R159-L161 VanDerWaalsContact C-N 3.28Å; R159-L161 PolarHBondContact O-N 3.48Å; R159-Y162 WeakPolarHBondContact O-CA 3.36Å; R159-Y162 WeakPolarHBondContact O-CB 3.29Å; R159-Y162 PolarHBondContact O-N 3.49Å; R159-I163 PolarHBondContact O-N 3.38Å; R159-Q187 HydrophobicContact CG-CB 4.37Å; R159-Q187 HydrophobicContact CG-CG 3.96Å
160G93.6Very high94.2Very high24 Ų2438.2 Ų38.225%0.24718%0.182CC..Hα-helixtrans-55.8-45.1171.500000111.8G156 S157 Y162 I163 L164G156-G160 PolarHBondContact O-N 2.95Å; S157-G160 PolarHBondContact O-N 3.47Å; G160-Y162 VanDerWaalsContact C-N 3.33Å; G160-Y162 PolarHBondContact O-N 3.29Å; G160-I163 WeakPolarHBondContact O-CB 3.41Å; G160-I163 PolarHBondContact O-N 2.88Å; G160-L164 PolarHBondContact O-N 3.43Å
161L95.6Very high94.3Very high39 Ų3943.2 Ų43.220%0.20420%0.199CC..Hα-helixtrans-65.5-34.1175.5-70164.7000112.6L7 S157 Y158 R159 L164 N165L7-L161 HydrophobicContact CB-CD1 4Å; L7-L161 HydrophobicContact CB-CD2 4.27Å; S157-L161 WeakPolarHBondContact O-CG 3.43Å; S157-L161 PolarHBondContact O-N 3.5Å; Y158-L161 PolarHBondContact O-N 3.21Å; R159-L161 VanDerWaalsContact C-N 3.28Å; R159-L161 PolarHBondContact O-N 3.48Å; L161-L164 HydrophobicContact CD2-CD1 4.45Å; L161-L164 PolarHBondContact O-N 3.06Å; L161-N165 PolarHBondContact O-N 2.98Å
162Y94.1Very high94.4Very high39 Ų3947 Ų4715%0.15322%0.223CC..Hα-helixtrans-67.6-34.9174.4-98.8-106.8000113D9 Y158 R159 G160 N165 W166D9-Y162 WeakPolarHBondContact OD1-CE2 3.39Å; D9-Y162 PolarHBondContact OD1-OH 2.87Å; Y158-Y162 HydrophobicContact CD2-CD2 4.15Å; Y158-Y162 HydrophobicContact CD2-CE2 4.45Å; Y158-Y162 VanDerWaalsContact O-CD2 3.29Å; Y158-Y162 WeakPolarHBondContact O-CD2 2.87Å; Y158-Y162 PolarHBondContact O-N 3.09Å; R159-Y162 WeakPolarHBondContact O-CA 3.36Å; R159-Y162 WeakPolarHBondContact O-CB 3.29Å; R159-Y162 PolarHBondContact O-N 3.49Å; G160-Y162 VanDerWaalsContact C-N 3.33Å; G160-Y162 PolarHBondContact O-N 3.29Å; Y162-N165 WeakPolarHBondContact O-CB 3.41Å; Y162-N165 PolarHBondContact O-N 3.09Å; Y162-W166 HydrophobicContact CD1-CZ2 4.1Å; Y162-W166 VanDerWaalsContact O-CD2 3.25Å; Y162-W166 PolarHBondContact O-N 2.74Å
163I94.1Very high94.4Very high37 Ų3751.9 Ų51.919%0.1925%0.246CC..Hα-helixtrans-60-47.7170.9-68.3170.6000110.3R159 G160 N165 W166 I167 V185 T188R159-I163 PolarHBondContact O-N 3.38Å; G160-I163 WeakPolarHBondContact O-CB 3.41Å; G160-I163 PolarHBondContact O-N 2.88Å; I163-N165 VanDerWaalsContact C-N 3.28Å; I163-N165 PolarHBondContact O-N 3.11Å; I163-W166 HydrophobicContact CB-CE3 4.28Å; I163-W166 HydrophobicContact CB-CZ3 4.45Å; I163-W166 HydrophobicContact CG1-CE3 3.89Å; I163-W166 HydrophobicContact CG1-CZ3 3.61Å; I163-W166 PolarHBondContact O-N 3.23Å; I163-I167 HydrophobicContact CG2-CD1 4.14Å; I163-I167 WeakPolarHBondContact O-CG1 3.28Å; I163-I167 PolarHBondContact O-N 3.28Å; I163-V185 HydrophobicContact CD1-CG2 4.17Å; I163-T188 HydrophobicContact CD1-CG2 4.15Å; I163-T188 VanDerWaalsContact CD1-OG1 3.25Å; I163-T188 WeakPolarHBondContact CD1-OG1 3.15Å
164L95.2Very high94.3Very high78 Ų7855.5 Ų55.541%0.40827%0.268SS..Hα-helixtrans-60.1-39.1175.7-61.2-179.6000112F4 G160 L161 I167 Y168F4-L164 HydrophobicContact CB-CB 4.24Å; F4-L164 HydrophobicContact CD1-CB 3.73Å; F4-L164 HydrophobicContact CD1-CD1 3.99Å; F4-L164 HydrophobicContact CE1-CB 4.19Å; F4-L164 HydrophobicContact CE1-CD1 4.1Å; F4-L164 HydrophobicContact CG-CB 3.91Å; G160-L164 PolarHBondContact O-N 3.43Å; L161-L164 HydrophobicContact CD2-CD1 4.45Å; L161-L164 PolarHBondContact O-N 3.06Å; L164-I167 PolarHBondContact O-N 3.02Å; L164-Y168 WeakPolarHBondContact O-CB 3.5Å; L164-Y168 PolarHBondContact O-N 3.14Å
165N95.1Very high94.2Very high4 Ų459.2 Ų59.22%0.02128%0.28CS..Hα-helixtrans-61.1-41.6172.4157.377.2000112.4N2 F4 R5 L161 Y162 I163 Y168 R169N2-N165 PolarHBondContact ND2-OD1 3.12Å; N2-N165 PolarHBondContact OD1-OD1 2.93Å; F4-N165 HydrophobicContact CB-CB 3.82Å; R5-N165 HydrophobicContact CB-CB 4.27Å; L161-N165 PolarHBondContact O-N 2.98Å; Y162-N165 WeakPolarHBondContact O-CB 3.41Å; Y162-N165 PolarHBondContact O-N 3.09Å; I163-N165 VanDerWaalsContact C-N 3.28Å; I163-N165 PolarHBondContact O-N 3.11Å; N165-Y168 PolarHBondContact O-N 2.76Å; N165-R169 WeakPolarHBondContact O-CB 3.35Å; N165-R169 VanDerWaalsContact O-CG 3.31Å; N165-R169 WeakPolarHBondContact O-CG 3.31Å; N165-R169 PolarHBondContact O-N 3.37Å
166W94.6Very high94Very high27 Ų2765.8 Ų65.810%0.10231%0.305CS..Hα-helixtrans-66.6-41177.8-62.3-41.6000112.2Y162 I163 Y168 R169 Y170 A180 I181Y162-W166 HydrophobicContact CD1-CZ2 4.1Å; Y162-W166 VanDerWaalsContact O-CD2 3.25Å; Y162-W166 PolarHBondContact O-N 2.74Å; I163-W166 HydrophobicContact CB-CE3 4.28Å; I163-W166 HydrophobicContact CB-CZ3 4.45Å; I163-W166 HydrophobicContact CG1-CE3 3.89Å; I163-W166 HydrophobicContact CG1-CZ3 3.61Å; I163-W166 PolarHBondContact O-N 3.23Å; W166-Y168 VanDerWaalsContact C-N 3.33Å; W166-Y168 PolarHBondContact O-N 3.32Å; W166-R169 PolarHBondContact O-N 3.17Å; W166-Y170 WeakPolarHBondContact O-CB 3.32Å; W166-Y170 PolarHBondContact O-N 3.02Å; W166-A180 WeakPolarHBondContact CH2-O 3.34Å; W166-A180 HydrophobicContact CZ2-CB 4.19Å; W166-I181 HydrophobicContact CB-CD1 4.3Å; W166-I181 HydrophobicContact CB-CG1 3.97Å; W166-I181 HydrophobicContact CD2-CG1 3.82Å; W166-I181 HydrophobicContact CE3-CB 4.24Å; W166-I181 HydrophobicContact CE3-CG1 3.84Å; W166-I181 HydrophobicContact CG-CG1 3.87Å
167I94.2Very high94Very high86 Ų8666.5 Ų66.544%0.44131%0.309SS..Hα-helixtrans-57.5-49.4173-65.1169.7000109.8I163 L164 R169 Y170 Y171I163-I167 HydrophobicContact CG2-CD1 4.14Å; I163-I167 WeakPolarHBondContact O-CG1 3.28Å; I163-I167 PolarHBondContact O-N 3.28Å; L164-I167 PolarHBondContact O-N 3.02Å; I167-R169 PolarHBondContact O-N 3.46Å; I167-Y170 WeakPolarHBondContact O-CB 3.36Å; I167-Y170 PolarHBondContact O-N 3.15Å; I167-Y171 HydrophobicContact CG2-CD2 3.87Å; I167-Y171 HydrophobicContact CG2-CE2 3.72Å; I167-Y171 VanDerWaalsContact O-CD2 3.23Å; I167-Y171 WeakPolarHBondContact O-CD2 3.49Å; I167-Y171 PolarHBondContact O-N 3.12Å
168Y94.7Very high94Very high94 Ų9470.9 Ų70.937%0.36933%0.33SS..Hα-helixtrans-58.3-45.9177.1179.3-86.8000112.5N2 F4 L164 N165 W166 Y170 Y171 V172N2-Y168 HydrophobicContact CB-CD1 3.98Å; N2-Y168 HydrophobicContact CB-CE1 3.82Å; N2-Y168 WeakPolarHBondContact ND2-CD1 3.26Å; F4-Y168 HydrophobicContact CD2-CD2 4.42Å; F4-Y168 HydrophobicContact CD2-CG 4.32Å; F4-Y168 HydrophobicContact CE2-CD2 4.05Å; F4-Y168 HydrophobicContact CE2-CG 4.36Å; L164-Y168 WeakPolarHBondContact O-CB 3.5Å; L164-Y168 PolarHBondContact O-N 3.14Å; N165-Y168 PolarHBondContact O-N 2.76Å; W166-Y168 VanDerWaalsContact C-N 3.33Å; W166-Y168 PolarHBondContact O-N 3.32Å; Y168-Y170 VanDerWaalsContact C-N 3.32Å; Y168-Y170 PolarHBondContact O-N 3.33Å; Y168-Y171 PolarHBondContact O-N 3.35Å; Y168-V172 HydrophobicContact CD1-CB 4.46Å; Y168-V172 HydrophobicContact CD1-CG2 4.36Å; Y168-V172 HydrophobicContact CD2-CG2 4.15Å; Y168-V172 HydrophobicContact CE1-CB 4.05Å; Y168-V172 HydrophobicContact CE1-CG1 4.24Å; Y168-V172 HydrophobicContact CE1-CG2 4.01Å; Y168-V172 HydrophobicContact CE2-CG2 3.8Å; Y168-V172 HydrophobicContact CG-CG2 4.42Å; Y168-V172 WeakPolarHBondContact O-CB 3.49Å; Y168-V172 WeakPolarHBondContact O-CG2 3.49Å; Y168-V172 PolarHBondContact O-N 2.9Å
169R93.8Very high94Very high51 Ų5171.3 Ų71.319%0.19233%0.332CS..Hα-helixtrans-67.3-31.9179.9-71.4-172.573.3-159.1-4.3112.7N165 W166 I167 Q173 N174 Y175N165-R169 WeakPolarHBondContact O-CB 3.35Å; N165-R169 VanDerWaalsContact O-CG 3.31Å; N165-R169 WeakPolarHBondContact O-CG 3.31Å; N165-R169 PolarHBondContact O-N 3.37Å; W166-R169 PolarHBondContact O-N 3.17Å; I167-R169 PolarHBondContact O-N 3.46Å; R169-Q173 CarbonylContact O-C 3.46Å; R169-Q173 VanDerWaalsContact O-CA 3.31Å; R169-Q173 WeakPolarHBondContact O-CA 3.31Å; R169-Q173 VanDerWaalsContact O-CB 3.25Å; R169-Q173 WeakPolarHBondContact O-CB 3.2Å; R169-Q173 PolarHBondContact O-N 2.93Å; R169-N174 PolarHBondContact O-N 3.47Å; R169-Y175 CarbonylContact C-O 3.56Å; R169-Y175 VanDerWaalsContact NH1-CD1 3.35Å; R169-Y175 PolarHBondContact O-N 2.73Å
170Y94.5Very high94.1Very high123 Ų12371.3 Ų71.348%0.48233%0.334SS..Hα-helixtrans-62.4-52.6173.5-179.9-105.5000110.7W166 I167 Y168 N174 Y175 Y176W166-Y170 WeakPolarHBondContact O-CB 3.32Å; W166-Y170 PolarHBondContact O-N 3.02Å; I167-Y170 WeakPolarHBondContact O-CB 3.36Å; I167-Y170 PolarHBondContact O-N 3.15Å; Y168-Y170 VanDerWaalsContact C-N 3.32Å; Y168-Y170 PolarHBondContact O-N 3.33Å; Y170-N174 VanDerWaalsContact O-CA 3.25Å; Y170-N174 WeakPolarHBondContact O-CA 3.36Å; Y170-N174 PolarHBondContact O-N 3.49Å; Y170-N174 VanDerWaalsContact O-N 3.07Å; Y170-Y175 PolarHBondContact N-O 3.44Å; Y170-Y176 HydrophobicContact CD2-CD1 4.17Å; Y170-Y176 HydrophobicContact CD2-CG 4.49Å; Y170-Y176 HydrophobicContact CE2-CD1 4.19Å
171Y94.8Very high94.2Very high175 Ų17572.5 Ų72.569%0.68633%0.334SS*.Hα-helixtrans-70.4-38.5-178-74.3-69.9000114.4I167 Y168I167-Y171 HydrophobicContact CG2-CD2 3.87Å; I167-Y171 HydrophobicContact CG2-CE2 3.72Å; I167-Y171 VanDerWaalsContact O-CD2 3.23Å; I167-Y171 WeakPolarHBondContact O-CD2 3.49Å; I167-Y171 PolarHBondContact O-N 3.12Å; Y168-Y171 PolarHBondContact O-N 3.35Å
172V95.2Very high94.2Very high87 Ų8773.9 Ų73.953%0.52735%0.347SS..Hα-helixtrans-92.7-30-1731790000112.6Y168Y168-V172 HydrophobicContact CD1-CB 4.46Å; Y168-V172 HydrophobicContact CD1-CG2 4.36Å; Y168-V172 HydrophobicContact CD2-CG2 4.15Å; Y168-V172 HydrophobicContact CE1-CB 4.05Å; Y168-V172 HydrophobicContact CE1-CG1 4.24Å; Y168-V172 HydrophobicContact CE1-CG2 4.01Å; Y168-V172 HydrophobicContact CE2-CG2 3.8Å; Y168-V172 HydrophobicContact CG-CG2 4.42Å; Y168-V172 WeakPolarHBondContact O-CB 3.49Å; Y168-V172 WeakPolarHBondContact O-CG2 3.49Å; Y168-V172 PolarHBondContact O-N 2.9Å
173Q92.8Very high94.3Very high102 Ų10272.2 Ų72.248%0.47734%0.341SS..Hα-helixtrans-120.3-1.5-171.6-52.6179.3-21.900113.4R169 Y175R169-Q173 CarbonylContact O-C 3.46Å; R169-Q173 VanDerWaalsContact O-CA 3.31Å; R169-Q173 WeakPolarHBondContact O-CA 3.31Å; R169-Q173 VanDerWaalsContact O-CB 3.25Å; R169-Q173 WeakPolarHBondContact O-CB 3.2Å; R169-Q173 PolarHBondContact O-N 2.93Å; Q173-Y175 PolarHBondContact O-N 3.16Å; Q173-Y175 VanDerWaalsContact O-N 3.11Å
174N92.4Very high94.3Very high135 Ų13570.5 Ų70.572%0.72233%0.332SS*.  trans49.632.3-170.7-68.5-50.1000112.9R169 Y170R169-N174 PolarHBondContact O-N 3.47Å; Y170-N174 VanDerWaalsContact O-CA 3.25Å; Y170-N174 WeakPolarHBondContact O-CA 3.36Å; Y170-N174 PolarHBondContact O-N 3.49Å; Y170-N174 VanDerWaalsContact O-N 3.07Å
175Y91.1Very high94.4Very high99 Ų9969.7 Ų69.739%0.38833%0.331SS..  trans-108.4127.8-177.9178-84.7000110.4R169 Y170 Q173 D177R169-Y175 CarbonylContact C-O 3.56Å; R169-Y175 VanDerWaalsContact NH1-CD1 3.35Å; R169-Y175 PolarHBondContact O-N 2.73Å; Y170-Y175 PolarHBondContact N-O 3.44Å; Q173-Y175 PolarHBondContact O-N 3.16Å; Q173-Y175 VanDerWaalsContact O-N 3.11Å; Y175-D177 HydrophobicContact CE1-CB 4.36Å
176Y91.8Very high94.4Very high141 Ų14173.3 Ų73.355%0.55335%0.35SS*.  trans-141.5146.3172.861.2-84000110.7Y170 L178Y170-Y176 HydrophobicContact CD2-CD1 4.17Å; Y170-Y176 HydrophobicContact CD2-CG 4.49Å; Y170-Y176 HydrophobicContact CE2-CD1 4.19Å; Y176-L178 HydrophobicContact CD2-CD2 4.33Å; Y176-L178 HydrophobicContact CD2-CG 4.13Å; Y176-L178 HydrophobicContact CE2-CG 4.39Å
177D93.5Very high94.5Very high15 Ų1572 Ų728%0.0835%0.345CS..  trans-130.9104.2173.1-178.7-25.8000107.7H111 W120 Y175 I179 A180 I181H111-D177 IonicContact CE1-OD1 3.34Å; H111-D177 PolarHBondContact CE1-OD1 2.9Å; H111-D177 VanDerWaalsContact NE2-CG 3.27Å; H111-D177 IonicContact NE2-OD1 2.93Å; H111-D177 PolarHBondContact NE2-OD1 3.39Å; H111-D177 IonicContact NE2-OD2 2.7Å; H111-D177 PolarHBondContact NE2-OD2 2.81Å; H111-D177 VanDerWaalsContact NE2-OD2 3.15Å; W120-D177 VanDerWaalsContact CH2-OD2 3.31Å; W120-D177 WeakPolarHBondContact CH2-OD2 3.5Å; Y175-D177 HydrophobicContact CE1-CB 4.36Å; D177-I179 VanDerWaalsContact C-N 3.26Å; D177-I179 PolarHBondContact O-N 2.89Å; D177-I179 WeakPolarHBondContact OD1-CB 3.38Å; D177-I179 PolarHBondContact OD1-N 3.48Å; D177-A180 HydrophobicContact CB-CB 4.03Å; D177-A180 PolarHBondContact O-N 3.16Å; D177-A180 PolarHBondContact OD1-N 3.3Å; D177-A180 VanDerWaalsContact OD1-N 3.14Å; D177-I181 WeakPolarHBondContact O-CB 3.48Å; D177-I181 WeakPolarHBondContact O-CD1 3.18Å; D177-I181 WeakPolarHBondContact O-CG1 3.39Å; D177-I181 PolarHBondContact O-N 2.62Å
178L94.4Very high94.5Very high120 Ų12069 Ų6963%0.62833%0.331SS*.Hα-helixtrans-64.3-31.3-174-68.8175.5000112.6Y176 S182Y176-L178 HydrophobicContact CD2-CD2 4.33Å; Y176-L178 HydrophobicContact CD2-CG 4.13Å; Y176-L178 HydrophobicContact CE2-CG 4.39Å; L178-S182 VanDerWaalsContact O-CB 3.25Å; L178-S182 WeakPolarHBondContact O-CB 3.28Å; L178-S182 PolarHBondContact O-N 3.3Å; L178-S182 PolarHBondContact O-OG 3.47Å
179I95.2Very high94.6Very high13 Ų1369.7 Ų69.77%0.06734%0.34CS..Hα-helixtrans-67.4-51177.8-66.1-179.7000108.8W120 T121 I124 Y125 D177 I181 S182 A183W120-I179 HydrophobicContact CZ3-CG2 4.41Å; T121-I179 HydrophobicContact CG2-CD1 4.37Å; T121-I179 HydrophobicContact CG2-CG2 4.33Å; I124-I179 HydrophobicContact CG2-CG2 4.05Å; Y125-I179 HydrophobicContact CE1-CG2 3.73Å; D177-I179 VanDerWaalsContact C-N 3.26Å; D177-I179 PolarHBondContact O-N 2.89Å; D177-I179 WeakPolarHBondContact OD1-CB 3.38Å; D177-I179 PolarHBondContact OD1-N 3.48Å; I179-I181 PolarHBondContact O-N 2.89Å; I179-S182 PolarHBondContact O-OG 2.76Å; I179-S182 VanDerWaalsContact O-OG 3.14Å; I179-A183 VanDerWaalsContact O-CB 3.32Å; I179-A183 WeakPolarHBondContact O-CB 3.45Å; I179-A183 PolarHBondContact O-N 2.83Å; I179-A183 VanDerWaalsContact O-N 3.12Å
180A95Very high94.7Very high9 Ų969.7 Ų69.77%0.07434%0.343CS..Hα-helixtrans-63.4-42.5179.600000112.4W166 D177 G184W166-A180 WeakPolarHBondContact CH2-O 3.34Å; W166-A180 HydrophobicContact CZ2-CB 4.19Å; D177-A180 HydrophobicContact CB-CB 4.03Å; D177-A180 PolarHBondContact O-N 3.16Å; D177-A180 PolarHBondContact OD1-N 3.3Å; D177-A180 VanDerWaalsContact OD1-N 3.14Å; A180-G184 PolarHBondContact O-N 2.94Å
181I95.6Very high94.6Very high49 Ų4963.9 Ų63.925%0.25132%0.321SS..Hα-helixtrans-65.3-51.7-179.5-68.6166000110.8W166 D177 I179 A183 G184 V185W166-I181 HydrophobicContact CB-CD1 4.3Å; W166-I181 HydrophobicContact CB-CG1 3.97Å; W166-I181 HydrophobicContact CD2-CG1 3.82Å; W166-I181 HydrophobicContact CE3-CB 4.24Å; W166-I181 HydrophobicContact CE3-CG1 3.84Å; W166-I181 HydrophobicContact CG-CG1 3.87Å; D177-I181 WeakPolarHBondContact O-CB 3.48Å; D177-I181 WeakPolarHBondContact O-CD1 3.18Å; D177-I181 WeakPolarHBondContact O-CG1 3.39Å; D177-I181 PolarHBondContact O-N 2.62Å; I179-I181 PolarHBondContact O-N 2.89Å; I181-A183 PolarHBondContact O-N 3.43Å; I181-G184 PolarHBondContact O-N 3.06Å; I181-V185 HydrophobicContact CG2-CG2 4.45Å; I181-V185 WeakPolarHBondContact O-CG2 2.99Å; I181-V185 PolarHBondContact O-N 3.49Å
182S95.7Very high94.5Very high68 Ų6858.4 Ų58.448%0.47631%0.307SS..Hα-helixtrans-61.9-46.2-177.8580000112.1L178 I179 G184 V185 L186L178-S182 VanDerWaalsContact O-CB 3.25Å; L178-S182 WeakPolarHBondContact O-CB 3.28Å; L178-S182 PolarHBondContact O-N 3.3Å; L178-S182 PolarHBondContact O-OG 3.47Å; I179-S182 PolarHBondContact O-OG 2.76Å; I179-S182 VanDerWaalsContact O-OG 3.14Å; S182-G184 VanDerWaalsContact C-N 3.32Å; S182-G184 PolarHBondContact O-N 3.32Å; S182-V185 PolarHBondContact O-N 3.14Å; S182-L186 PolarHBondContact O-N 3.47Å
183A96.4Very high94.2Very high4 Ų459.2 Ų59.23%0.03331%0.309CS..Hα-helixtrans-63.4-36.6175.800000112.2I124 Y125 S128 I179 I181 Q187I124-A183 HydrophobicContact CG2-CB 3.43Å; I124-A183 VanDerWaalsContact CG2-CB 3.43Å; Y125-A183 HydrophobicContact CD1-CB 4.4Å; S128-A183 VanDerWaalsContact CB-O 3.25Å; S128-A183 WeakPolarHBondContact CB-O 3.4Å; I179-A183 VanDerWaalsContact O-CB 3.32Å; I179-A183 WeakPolarHBondContact O-CB 3.45Å; I179-A183 PolarHBondContact O-N 2.83Å; I179-A183 VanDerWaalsContact O-N 3.12Å; I181-A183 PolarHBondContact O-N 3.43Å; A183-Q187 WeakPolarHBondContact O-CB 3.39Å; A183-Q187 PolarHBondContact O-N 2.75Å
184G95.3Very high94.1Very high0 Ų054.7 Ų54.70%029%0.288CS..Hα-helixtrans-70.3-37.1176.100000115A180 I181 S182 Q187 T188A180-G184 PolarHBondContact O-N 2.94Å; I181-G184 PolarHBondContact O-N 3.06Å; S182-G184 VanDerWaalsContact C-N 3.32Å; S182-G184 PolarHBondContact O-N 3.32Å; G184-Q187 PolarHBondContact O-N 3.3Å; G184-T188 WeakPolarHBondContact O-CB 3.19Å; G184-T188 PolarHBondContact O-N 3.18Å; G184-T188 PolarHBondContact O-OG1 2.89Å
185V95.7Very high94Very high62 Ų6250 Ų5038%0.37626%0.26SS..Hα-helixtrans-62.7-50.4171.7171.30000109.6I163 I181 S182 Q187 T188 L189I163-V185 HydrophobicContact CD1-CG2 4.17Å; I181-V185 HydrophobicContact CG2-CG2 4.45Å; I181-V185 WeakPolarHBondContact O-CG2 2.99Å; I181-V185 PolarHBondContact O-N 3.49Å; S182-V185 PolarHBondContact O-N 3.14Å; V185-Q187 VanDerWaalsContact C-N 3.32Å; V185-Q187 PolarHBondContact O-N 3.4Å; V185-T188 PolarHBondContact O-N 3.3Å; V185-T188 VanDerWaalsContact O-N 3.16Å; V185-L189 HydrophobicContact CG1-CD1 4Å; V185-L189 HydrophobicContact CG1-CG 4.36Å; V185-L189 WeakPolarHBondContact O-CG 3.21Å; V185-L189 PolarHBondContact O-N 3.49Å
186L96.5Very high94.1Very high80 Ų8052.5 Ų52.542%0.41927%0.271SS..Hα-helixtrans-54.2-49.1176.1176.662.6000111.6V129 S182 T188 L189 L190V129-L186 HydrophobicContact CG1-CD2 4.36Å; S182-L186 PolarHBondContact O-N 3.47Å; L186-T188 VanDerWaalsContact C-N 3.34Å; L186-T188 PolarHBondContact O-N 3.47Å; L186-L189 PolarHBondContact O-N 3.21Å; L186-L190 PolarHBondContact O-N 3.49Å; L186-L190 VanDerWaalsContact O-N 3.11Å
187Q96.2Very high93.9Very high0 Ų046.2 Ų46.20%025%0.246CC..Hα-helixtrans-59-46179.1-164.3173.9-6.200111.7E127 Y158 R159 A183 G184 V185 L189 L190 Y191E127-Q187 PolarHBondContact O-NE2 3.19Å; Y158-Q187 PolarHBondContact OH-NE2 2.97Å; R159-Q187 HydrophobicContact CG-CB 4.37Å; R159-Q187 HydrophobicContact CG-CG 3.96Å; A183-Q187 WeakPolarHBondContact O-CB 3.39Å; A183-Q187 PolarHBondContact O-N 2.75Å; G184-Q187 PolarHBondContact O-N 3.3Å; V185-Q187 VanDerWaalsContact C-N 3.32Å; V185-Q187 PolarHBondContact O-N 3.4Å; Q187-L189 VanDerWaalsContact C-N 3.32Å; Q187-L189 PolarHBondContact O-N 2.88Å; Q187-L190 PolarHBondContact O-N 2.83Å; Q187-Y191 HydrophobicContact CG-CE2 4.15Å; Q187-Y191 WeakPolarHBondContact O-CD2 3.16Å; Q187-Y191 PolarHBondContact O-N 3.05Å
188T94.9Very high93.7Very high23 Ų2346.5 Ų46.514%0.14125%0.246CC..Hα-helixtrans-64.4-39.2-179.6-55.30000111.4I163 G184 V185 L186 L190 Y191 C192I163-T188 HydrophobicContact CD1-CG2 4.15Å; I163-T188 VanDerWaalsContact CD1-OG1 3.25Å; I163-T188 WeakPolarHBondContact CD1-OG1 3.15Å; G184-T188 WeakPolarHBondContact O-CB 3.19Å; G184-T188 PolarHBondContact O-N 3.18Å; G184-T188 PolarHBondContact O-OG1 2.89Å; V185-T188 PolarHBondContact O-N 3.3Å; V185-T188 VanDerWaalsContact O-N 3.16Å; L186-T188 VanDerWaalsContact C-N 3.34Å; L186-T188 PolarHBondContact O-N 3.47Å; T188-L190 VanDerWaalsContact C-N 3.3Å; T188-L190 PolarHBondContact O-N 2.69Å; T188-Y191 PolarHBondContact O-N 3.24Å; T188-C192 PolarHBondContact O-N 3.3Å
189L95.9Very high93.5Very high107 Ų10745.1 Ų45.156%0.5624%0.239SC*.Hα-helixtrans-60.5-38.7175.6-71.4173.8000112.3V185 L186 Q187 Y191 C192V185-L189 HydrophobicContact CG1-CD1 4Å; V185-L189 HydrophobicContact CG1-CG 4.36Å; V185-L189 WeakPolarHBondContact O-CG 3.21Å; V185-L189 PolarHBondContact O-N 3.49Å; L186-L189 PolarHBondContact O-N 3.21Å; Q187-L189 VanDerWaalsContact C-N 3.32Å; Q187-L189 PolarHBondContact O-N 2.88Å; L189-Y191 PolarHBondContact O-N 3.06Å; L189-C192 WeakPolarHBondContact O-CB 3.29Å; L189-C192 PolarHBondContact O-N 2.9Å; L189-C192 VanDerWaalsContact O-N 3.09Å
190L95Very high93.3Very high52 Ų5246.5 Ų46.527%0.27225%0.248SC..Hα-helixtrans-64.1-23.3175.8-68.6176.1000113.3S128 V129 L132 L135 L186 Q187 T188S128-L190 VanDerWaalsContact O-CD1 3.29Å; S128-L190 WeakPolarHBondContact O-CD1 3.36Å; V129-L190 HydrophobicContact CG1-CD1 4.38Å; L132-L190 HydrophobicContact CD2-CD1 3.89Å; L132-L190 HydrophobicContact CD2-CD2 3.85Å; L132-L190 HydrophobicContact CD2-CG 4.43Å; L132-L190 HydrophobicContact CG-CD1 4.19Å; L135-L190 WeakPolarHBondContact CD1-O 2.82Å; L186-L190 PolarHBondContact O-N 3.49Å; L186-L190 VanDerWaalsContact O-N 3.11Å; Q187-L190 PolarHBondContact O-N 2.83Å; T188-L190 VanDerWaalsContact C-N 3.3Å; T188-L190 PolarHBondContact O-N 2.69Å
191Y93Very high92.9Very high0 Ų049.6 Ų49.60%026%0.258CS..Hα-helixtrans-88.9-9.3174.5-75.7-84.1000114I131 L152 L155 Q187 T188 L189 D193 F194 F195I131-Y191 HydrophobicContact CB-CE2 4.39Å; I131-Y191 WeakPolarHBondContact CB-OH 3.46Å; I131-Y191 HydrophobicContact CD1-CE1 4.44Å; I131-Y191 WeakPolarHBondContact CD1-OH 3.36Å; I131-Y191 HydrophobicContact CG1-CE1 3.88Å; I131-Y191 WeakPolarHBondContact CG1-OH 3.43Å; I131-Y191 HydrophobicContact CG2-CE2 3.99Å; L152-Y191 HydrophobicContact CD2-CE1 4.44Å; L155-Y191 WeakPolarHBondContact CD2-OH 3.42Å; L155-Y191 WeakPolarHBondContact CG-OH 3.37Å; Q187-Y191 HydrophobicContact CG-CE2 4.15Å; Q187-Y191 WeakPolarHBondContact O-CD2 3.16Å; Q187-Y191 PolarHBondContact O-N 3.05Å; T188-Y191 PolarHBondContact O-N 3.24Å; L189-Y191 PolarHBondContact O-N 3.06Å; Y191-D193 PolarHBondContact O-N 3.08Å; Y191-F194 HydrophobicContact CD1-CD1 4.41Å; Y191-F194 WeakPolarHBondContact O-CB 3.43Å; Y191-F194 PolarHBondContact O-N 3.3Å; Y191-F195 HydrophobicContact CG-CZ 4.38Å; Y191-F195 WeakPolarHBondContact O-CD2 3.24Å; Y191-F195 WeakPolarHBondContact O-CG 3.38Å; Y191-F195 PolarHBondContact O-N 2.9Å
192C92.9Very high92.6Very high61 Ų6147.9 Ų47.941%0.41225%0.249SC..Hα-helixtrans-57.6-47.6-172.1-77.90000113.4T188 L189 F195 Y196T188-C192 PolarHBondContact O-N 3.3Å; L189-C192 WeakPolarHBondContact O-CB 3.29Å; L189-C192 PolarHBondContact O-N 2.9Å; L189-C192 VanDerWaalsContact O-N 3.09Å; C192-F195 PolarHBondContact O-N 2.85Å; C192-Y196 PolarHBondContact O-N 3.45Å
193D89Confident92.1Very high103 Ų10349.7 Ų49.755%0.55125%0.253SS*.Hα-helixtrans-65.5-41.7179.1-173.437.8000111.5Y191 F195 Y196 L197Y191-D193 PolarHBondContact O-N 3.08Å; D193-F195 VanDerWaalsContact C-N 3.34Å; D193-F195 PolarHBondContact O-N 3.19Å; D193-Y196 WeakPolarHBondContact O-CB 3.35Å; D193-Y196 PolarHBondContact O-N 3Å; D193-L197 WeakPolarHBondContact O-CG 3.34Å; D193-L197 PolarHBondContact O-N 3.01Å
194F90.1Very high91.7Very high8 Ų856.7 Ų56.74%0.03528%0.283CS..Hα-helixtrans-58.2-44.4173.6176-90.9000112L135 S149 L152 F153 Y191 L197 Y198 F208L135-F194 HydrophobicContact CD2-CB 4.4Å; S149-F194 VanDerWaalsContact O-CZ 3.32Å; S149-F194 WeakPolarHBondContact O-CZ 3.41Å; L152-F194 HydrophobicContact CB-CD1 4.1Å; L152-F194 HydrophobicContact CB-CD2 4.38Å; L152-F194 HydrophobicContact CB-CE1 3.48Å; L152-F194 VanDerWaalsContact CB-CE1 3.48Å; L152-F194 HydrophobicContact CB-CE2 3.79Å; L152-F194 HydrophobicContact CB-CZ 3.32Å; L152-F194 HydrophobicContact CD1-CD2 3.98Å; L152-F194 HydrophobicContact CD1-CE2 3.5Å; L152-F194 VanDerWaalsContact CD1-CE2 3.5Å; L152-F194 HydrophobicContact CD1-CZ 3.94Å; L152-F194 HydrophobicContact CG-CE2 4.3Å; L152-F194 HydrophobicContact CG-CZ 4.26Å; F153-F194 HydrophobicContact CB-CE1 4.14Å; Y191-F194 HydrophobicContact CD1-CD1 4.41Å; Y191-F194 WeakPolarHBondContact O-CB 3.43Å; Y191-F194 PolarHBondContact O-N 3.3Å; F194-L197 PolarHBondContact O-N 3.43Å; F194-Y198 HydrophobicContact CE1-CD2 4.4Å; F194-Y198 HydrophobicContact CE1-CG 4.44Å; F194-Y198 HydrophobicContact CZ-CD2 4.15Å; F194-Y198 VanDerWaalsContact O-CB 3.24Å; F194-Y198 WeakPolarHBondContact O-CB 3.21Å; F194-Y198 PolarHBondContact O-N 3.4Å; F194-F208 AromaticContact CD2-CE2 3.66Å; F194-F208 HydrophobicContact CD2-CE2 3.66Å; F194-F208 AromaticContact CD2-CZ 3.63Å; F194-F208 HydrophobicContact CD2-CZ 3.63Å; F194-F208 HydrophobicContact CE2-CD2 4.14Å; F194-F208 AromaticContact CE2-CE2 3.51Å; F194-F208 HydrophobicContact CE2-CE2 3.51Å; F194-F208 AromaticContact CE2-CZ 3.81Å; F194-F208 HydrophobicContact CE2-CZ 3.81Å; F194-F208 HydrophobicContact CZ-CE2 4.33Å
195F91.5Very high91.2Very high35 Ų3560.2 Ų60.215%0.15432%0.318CS..Hα-helixtrans-63.3-42.8177.1-67.7-38.6000112.4F153 G156 Y191 C192 D193 L197 Y198 I199F153-F195 AromaticContact CD2-CD1 3.74Å; F153-F195 HydrophobicContact CD2-CD1 3.74Å; F153-F195 AromaticContact CD2-CE1 3.97Å; F153-F195 HydrophobicContact CD2-CE1 3.97Å; F153-F195 HydrophobicContact CE2-CD1 4.05Å; F153-F195 HydrophobicContact CE2-CE1 4.32Å; G156-F195 VanDerWaalsContact C-CZ 3.41Å; Y191-F195 HydrophobicContact CG-CZ 4.38Å; Y191-F195 WeakPolarHBondContact O-CD2 3.24Å; Y191-F195 WeakPolarHBondContact O-CG 3.38Å; Y191-F195 PolarHBondContact O-N 2.9Å; C192-F195 PolarHBondContact O-N 2.85Å; D193-F195 VanDerWaalsContact C-N 3.34Å; D193-F195 PolarHBondContact O-N 3.19Å; F195-L197 VanDerWaalsContact C-N 3.34Å; F195-L197 PolarHBondContact O-N 2.62Å; F195-Y198 PolarHBondContact O-N 3.41Å; F195-I199 WeakPolarHBondContact O-CB 3.32Å; F195-I199 VanDerWaalsContact O-CG1 3.27Å; F195-I199 WeakPolarHBondContact O-CG1 3.36Å; F195-I199 PolarHBondContact O-N 2.77Å
196Y91.6Very high90.6Very high153 Ų15363.8 Ų63.860%0.633%0.329SS*.Hα-helixtrans-57.8-49.1176.9173.7-103.5000111C192 D193 I199 T200C192-Y196 PolarHBondContact O-N 3.45Å; D193-Y196 WeakPolarHBondContact O-CB 3.35Å; D193-Y196 PolarHBondContact O-N 3Å; Y196-I199 PolarHBondContact O-N 3.22Å; Y196-T200 HydrophobicContact CD2-CG2 4.11Å; Y196-T200 HydrophobicContact CE2-CG2 3.79Å; Y196-T200 WeakPolarHBondContact O-CB 3.3Å; Y196-T200 VanDerWaalsContact O-CG2 3.28Å; Y196-T200 WeakPolarHBondContact O-CG2 3.41Å; Y196-T200 PolarHBondContact O-N 2.89Å; Y196-T200 PolarHBondContact O-OG1 3.45Å
197L87.9Confident89.8Confident9 Ų963.1 Ų63.15%0.04734%0.335CS..Hα-helixtrans-66.1-40.6178.2-69.3169.8000112.6D193 F194 F195 T200 R201 F208 L210D193-L197 WeakPolarHBondContact O-CG 3.34Å; D193-L197 PolarHBondContact O-N 3.01Å; F194-L197 PolarHBondContact O-N 3.43Å; F195-L197 VanDerWaalsContact C-N 3.34Å; F195-L197 PolarHBondContact O-N 2.62Å; L197-T200 PolarHBondContact O-OG1 3.12Å; L197-R201 VanDerWaalsContact O-CB 3.3Å; L197-R201 WeakPolarHBondContact O-CB 3.48Å; L197-R201 PolarHBondContact O-N 3.13Å; L197-F208 HydrophobicContact CB-CD2 4.27Å; L197-F208 HydrophobicContact CB-CE2 3.47Å; L197-F208 VanDerWaalsContact CB-CE2 3.47Å; L197-F208 HydrophobicContact CB-CZ 3.8Å; L197-F208 HydrophobicContact CD1-CE1 4.4Å; L197-F208 HydrophobicContact CD1-CE2 4.29Å; L197-F208 HydrophobicContact CD1-CZ 3.73Å; L197-F208 HydrophobicContact CG-CZ 4.45Å; L197-L210 HydrophobicContact CD1-CD2 3.4Å
198Y89.1Confident89Confident20 Ų2063.3 Ų63.38%0.07834%0.336CS..Iπ-helixtrans-60.9-48.1177.1179.4-92.3000111.8H150 F153 F194 F195 V202 I203H150-Y198 PolarHBondContact CE1-OH 2.92Å; H150-Y198 VanDerWaalsContact CE1-OH 3.31Å; H150-Y198 AromaticContact ND1-CE2 3.7Å; H150-Y198 AromaticContact ND1-CZ 3.64Å; H150-Y198 PolarHBondContact ND1-OH 3.42Å; F153-Y198 HydrophobicContact CB-CD1 4.22Å; F153-Y198 HydrophobicContact CB-CD2 4.17Å; F153-Y198 HydrophobicContact CB-CE1 3.99Å; F153-Y198 HydrophobicContact CB-CE2 3.94Å; F153-Y198 HydrophobicContact CB-CG 4.3Å; F153-Y198 AromaticContact CD1-CE1 3.97Å; F153-Y198 HydrophobicContact CD1-CE1 3.97Å; F153-Y198 AromaticContact CD2-CD1 3.27Å; F153-Y198 HydrophobicContact CD2-CD1 3.27Å; F153-Y198 AromaticContact CD2-CE1 3.4Å; F153-Y198 HydrophobicContact CD2-CE1 3.4Å; F153-Y198 AromaticContact CD2-CG 3.92Å; F153-Y198 HydrophobicContact CD2-CG 3.92Å; F153-Y198 HydrophobicContact CE1-CE1 4.33Å; F153-Y198 AromaticContact CE2-CD1 3.74Å; F153-Y198 HydrophobicContact CE2-CD1 3.74Å; F153-Y198 AromaticContact CE2-CE1 3.82Å; F153-Y198 HydrophobicContact CE2-CE1 3.82Å; F153-Y198 AromaticContact CG-CD1 3.8Å; F153-Y198 HydrophobicContact CG-CD1 3.8Å; F153-Y198 AromaticContact CG-CE1 3.49Å; F153-Y198 HydrophobicContact CG-CE1 3.49Å; F153-Y198 VanDerWaalsContact CG-CE1 3.49Å; F153-Y198 HydrophobicContact CG-CE2 4.36Å; F153-Y198 HydrophobicContact CG-CG 4.35Å; F153-Y198 AromaticContact CG-CZ 3.78Å; F153-Y198 HydrophobicContact CZ-CE1 4.26Å; F194-Y198 HydrophobicContact CE1-CD2 4.4Å; F194-Y198 HydrophobicContact CE1-CG 4.44Å; F194-Y198 HydrophobicContact CZ-CD2 4.15Å; F194-Y198 VanDerWaalsContact O-CB 3.24Å; F194-Y198 WeakPolarHBondContact O-CB 3.21Å; F194-Y198 PolarHBondContact O-N 3.4Å; F195-Y198 PolarHBondContact O-N 3.41Å; Y198-V202 HydrophobicContact CD2-CB 3.8Å; Y198-V202 HydrophobicContact CD2-CG1 3.98Å; Y198-V202 HydrophobicContact CD2-CG2 4.03Å; Y198-V202 HydrophobicContact CE2-CB 4.07Å; Y198-V202 HydrophobicContact CE2-CG1 3.74Å; Y198-V202 HydrophobicContact CG-CB 4.33Å; Y198-V202 WeakPolarHBondContact O-CA 3.42Å; Y198-V202 WeakPolarHBondContact O-CB 3.37Å; Y198-V202 PolarHBondContact O-N 3.42Å; Y198-I203 HydrophobicContact CD1-CD1 4.16Å; Y198-I203 HydrophobicContact CD1-CG1 4.09Å; Y198-I203 HydrophobicContact CE1-CD1 3.92Å; Y198-I203 HydrophobicContact CE1-CG1 3.78Å; Y198-I203 PolarHBondContact O-N 3.38Å
199I90.9Very high88.1Confident91 Ų9163.3 Ų63.347%0.46734%0.338SS..Iπ-helixtrans-67.9-41.9-179.2-67.4167.6000111.2F195 Y196 I203F195-I199 WeakPolarHBondContact O-CB 3.32Å; F195-I199 VanDerWaalsContact O-CG1 3.27Å; F195-I199 WeakPolarHBondContact O-CG1 3.36Å; F195-I199 PolarHBondContact O-N 2.77Å; Y196-I199 PolarHBondContact O-N 3.22Å; I199-I203 HydrophobicContact CB-CD1 4.3Å; I199-I203 HydrophobicContact CG1-CD1 4.03Å; I199-I203 HydrophobicContact CG2-CD1 4.45Å
200T90.6Very high87.1Confident43 Ų4360.5 Ų60.526%0.26432%0.323SS..Iπ-helixtrans-79.8-29.5-17556.50000113.7Y196 L197 K204Y196-T200 HydrophobicContact CD2-CG2 4.11Å; Y196-T200 HydrophobicContact CE2-CG2 3.79Å; Y196-T200 WeakPolarHBondContact O-CB 3.3Å; Y196-T200 VanDerWaalsContact O-CG2 3.28Å; Y196-T200 WeakPolarHBondContact O-CG2 3.41Å; Y196-T200 PolarHBondContact O-N 2.89Å; Y196-T200 PolarHBondContact O-OG1 3.45Å; L197-T200 PolarHBondContact O-OG1 3.12Å; T200-K204 VanDerWaalsContact O-CD 3.29Å; T200-K204 WeakPolarHBondContact O-CD 3.49Å
201R87.7Confident85.9Confident74 Ų7462.2 Ų62.228%0.27934%0.338SS..Iπ-helixtrans-109.1-59.9-177.4-59.1-169.9174.8-157.8-3.5112.7L197 K204 G205 K206 A209L197-R201 VanDerWaalsContact O-CB 3.3Å; L197-R201 WeakPolarHBondContact O-CB 3.48Å; L197-R201 PolarHBondContact O-N 3.13Å; R201-K204 CarbonylContact O-C 3.51Å; R201-K204 PolarHBondContact O-N 3.01Å; R201-K204 VanDerWaalsContact O-N 3.15Å; R201-G205 PolarHBondContact O-N 2.88Å; R201-K206 CarbonylContact C-O 3.54Å; R201-K206 HydrophobicContact CB-CB 4.2Å; R201-K206 WeakPolarHBondContact O-CB 3.35Å; R201-K206 PolarHBondContact O-N 3.2Å; R201-A209 PolarHBondContact NH1-O 2.91Å
202V87.6Confident84.4Confident12 Ų1270.7 Ų70.77%0.07341%0.407CS..Iπ-helixtrans-68.1-44.5-169.7-178.10000112.3T146 Y198 K204 G205 K206 F208T146-V202 HydrophobicContact CG2-CG1 3.95Å; Y198-V202 HydrophobicContact CD2-CB 3.8Å; Y198-V202 HydrophobicContact CD2-CG1 3.98Å; Y198-V202 HydrophobicContact CD2-CG2 4.03Å; Y198-V202 HydrophobicContact CE2-CB 4.07Å; Y198-V202 HydrophobicContact CE2-CG1 3.74Å; Y198-V202 HydrophobicContact CG-CB 4.33Å; Y198-V202 WeakPolarHBondContact O-CA 3.42Å; Y198-V202 WeakPolarHBondContact O-CB 3.37Å; Y198-V202 PolarHBondContact O-N 3.42Å; V202-K204 PolarHBondContact O-N 3.06Å; V202-G205 PolarHBondContact O-N 3.5Å; V202-K206 WeakPolarHBondContact CA-O 3.29Å; V202-F208 HydrophobicContact CG2-CB 3.74Å; V202-F208 HydrophobicContact CG2-CD2 3.8Å; V202-F208 HydrophobicContact CG2-CG 4.28Å
203I86.9Confident83.9Confident107 Ų10771.2 Ų71.255%0.54941%0.407SS..THydrogen-bonded Turntrans-61.9-29.1176.5-63.1-175.6000111.4Y198 I199 G205Y198-I203 HydrophobicContact CD1-CD1 4.16Å; Y198-I203 HydrophobicContact CD1-CG1 4.09Å; Y198-I203 HydrophobicContact CE1-CD1 3.92Å; Y198-I203 HydrophobicContact CE1-CG1 3.78Å; Y198-I203 PolarHBondContact O-N 3.38Å; I199-I203 HydrophobicContact CB-CD1 4.3Å; I199-I203 HydrophobicContact CG1-CD1 4.03Å; I199-I203 HydrophobicContact CG2-CD1 4.45Å; I203-G205 PolarHBondContact O-N 3.02Å
204K88.1Confident83.7Confident151 Ų15169.5 Ų69.566%0.65740%0.4SS*.THydrogen-bonded Turntrans-84.610.3175.6-57.8-168.6-1741760113.4T200 R201 V202 K206T200-K204 VanDerWaalsContact O-CD 3.29Å; T200-K204 WeakPolarHBondContact O-CD 3.49Å; R201-K204 CarbonylContact O-C 3.51Å; R201-K204 PolarHBondContact O-N 3.01Å; R201-K204 VanDerWaalsContact O-N 3.15Å; V202-K204 PolarHBondContact O-N 3.06Å; K204-K206 VanDerWaalsContact C-N 3.26Å; K204-K206 PolarHBondContact O-N 3.49Å
205G84.5Confident83.3Confident73 Ų7372.9 Ų72.975%0.75342%0.42SS*.THydrogen-bonded Turntrans73.511.6179.700000114.8R201 V202 I203R201-G205 PolarHBondContact O-N 2.88Å; V202-G205 PolarHBondContact O-N 3.5Å; I203-G205 PolarHBondContact O-N 3.02Å
206K83.3Confident82.8Confident138 Ų13875.1 Ų75.160%0.644%0.435SS*.  trans-88148.6174.5-59.3-175.4177.5-173.60109.9R201 V202 K204R201-K206 CarbonylContact C-O 3.54Å; R201-K206 HydrophobicContact CB-CB 4.2Å; R201-K206 WeakPolarHBondContact O-CB 3.35Å; R201-K206 PolarHBondContact O-N 3.2Å; V202-K206 WeakPolarHBondContact CA-O 3.29Å; K204-K206 VanDerWaalsContact C-N 3.26Å; K204-K206 PolarHBondContact O-N 3.49Å
207A79.3Confident82.3Confident66 Ų6670.3 Ų70.355%0.54543%0.425SS..  trans-57.5143.917400000111A209A207-A209 PolarHBondContact O-N 3.46Å
208F78.3Confident81.9Confident4 Ų474.3 Ų74.32%0.01845%0.45CS..EExtended strand (participates in β ladder)trans-73.497.6168.5-169.7-78000107.9I138 E143 A144 F194 L197 V202 L210I138-F208 HydrophobicContact CG2-CD1 4.26Å; I138-F208 HydrophobicContact CG2-CE1 3.68Å; E143-F208 WeakPolarHBondContact CA-O 3.27Å; A144-F208 HydrophobicContact CB-CB 4.26Å; A144-F208 HydrophobicContact CB-CD1 3.68Å; A144-F208 HydrophobicContact CB-CE1 4.37Å; A144-F208 HydrophobicContact CB-CG 4.13Å; A144-F208 PolarHBondContact N-O 3.13Å; A144-F208 VanDerWaalsContact N-O 3.09Å; F194-F208 AromaticContact CD2-CE2 3.66Å; F194-F208 HydrophobicContact CD2-CE2 3.66Å; F194-F208 AromaticContact CD2-CZ 3.63Å; F194-F208 HydrophobicContact CD2-CZ 3.63Å; F194-F208 HydrophobicContact CE2-CD2 4.14Å; F194-F208 AromaticContact CE2-CE2 3.51Å; F194-F208 HydrophobicContact CE2-CE2 3.51Å; F194-F208 AromaticContact CE2-CZ 3.81Å; F194-F208 HydrophobicContact CE2-CZ 3.81Å; F194-F208 HydrophobicContact CZ-CE2 4.33Å; L197-F208 HydrophobicContact CB-CD2 4.27Å; L197-F208 HydrophobicContact CB-CE2 3.47Å; L197-F208 VanDerWaalsContact CB-CE2 3.47Å; L197-F208 HydrophobicContact CB-CZ 3.8Å; L197-F208 HydrophobicContact CD1-CE1 4.4Å; L197-F208 HydrophobicContact CD1-CE2 4.29Å; L197-F208 HydrophobicContact CD1-CZ 3.73Å; L197-F208 HydrophobicContact CG-CZ 4.45Å; V202-F208 HydrophobicContact CG2-CB 3.74Å; V202-F208 HydrophobicContact CG2-CD2 3.8Å; V202-F208 HydrophobicContact CG2-CG 4.28Å; F208-L210 HydrophobicContact CE1-CD2 4.43Å
209A77.2Confident81.4Confident22 Ų2278.2 Ų78.218%0.18248%0.477CS..EExtended strand (participates in β ladder)trans-122146.8169.900000108.4G142 E143 R201 A207G142-A209 WeakPolarHBondContact O-CA 3.18Å; E143-A209 HydrophobicContact CG-CB 4.36Å; R201-A209 PolarHBondContact NH1-O 2.91Å; A207-A209 PolarHBondContact O-N 3.46Å
210L74.7Confident80.7Confident48 Ų4877.2 Ų77.225%0.25148%0.478SS..  trans-76.5150.2169.2-66.7168.9000109.9I138 G142 L197 F208I138-L210 HydrophobicContact CG2-CD1 4.5Å; G142-L210 PolarHBondContact O-N 3.46Å; L197-L210 HydrophobicContact CD1-CD2 3.4Å; F208-L210 HydrophobicContact CE1-CD2 4.43Å
211P70.3Confident79.8Confident89 Ų8980.1 Ų80.158%0.57850%0.496SS*.  trans-60.2137.8166.527.4-31.5000109.2
212A60.1Low79.1Confident177 Ų17780.6 Ų80.6100%1.46352%0.515SS*.  trans-64.50175.900000112

Retrieved 212 of 212 residues in 211.6 ms (Link to these results)

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