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NADH-ubiquinone oxidoreductase chain 2

Core subunit of the mitochondrial membrane respiratory chain NADH dehydrogenase (Complex I) which catalyzes electron transfer from NADH through the respiratory chain, using ubiquinone as an electron acceptor. Essential for the catalytic activity and assembly of complex I.

AlphaFold DB , UniProt , Accession A0A068BS51, Species HUMAN (Homo sapiens, Human), Gene ND2, Length 347 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
1M80Confident94.1Very high100 Ų10081.2 Ų81.249%0.49346%0.458SS..  01460-68.9-176.595.100109.1P42 K46M1-P42 HydrophobicContact CE-CB 3.53Å; M1-P42 WeakPolarHBondContact CE-O 3.39Å; M1-K46 HydrophobicContact SD-CB 4.16Å; M1-K46 HydrophobicContact SD-CG 3.53Å; M1-K46 VanDerWaalsContact SD-CG 3.53Å
2N91.6Very high94.4Very high93 Ų9379.1 Ų79.150%0.49745%0.448SS..  trans-67.3121.9179.9-174.7-6.8000110.7L4 A5N2-L4 PolarHBondContact O-N 3.35Å; N2-L4 WeakPolarHBondContact OD1-CB 3.46Å; N2-L4 PolarHBondContact OD1-N 3.31Å; N2-A5 HydrophobicContact CB-CB 4.14Å; N2-A5 PolarHBondContact O-N 2.91Å
3P91.8Very high94.6Very high90 Ų9073.6 Ų73.658%0.58442%0.417SS*.G310 helixtrans-61.6-33177.226-34.4000112.3A5 Q6 P7P3-A5 PolarHBondContact O-N 3.25Å; P3-Q6 WeakPolarHBondContact O-CB 3.42Å; P3-Q6 PolarHBondContact O-N 2.89Å; P3-P7 WeakPolarHBondContact O-CD 3.4Å
4L95.4Very high94.9Very high141 Ų14176.4 Ų76.474%0.73842%0.423SS*.G310 helixtrans-67.2-24.4179.6-61.4173.1000113N2 P7N2-L4 PolarHBondContact O-N 3.35Å; N2-L4 WeakPolarHBondContact OD1-CB 3.46Å; N2-L4 PolarHBondContact OD1-N 3.31Å; L4-P7 WeakPolarHBondContact O-CD 3.43Å
5A95.4Very high95.1Very high38 Ų3873.7 Ų73.731%0.31441%0.414SS..G310 helixtrans-83-16.317800000112.9N2 P3 V8 I9N2-A5 HydrophobicContact CB-CB 4.14Å; N2-A5 PolarHBondContact O-N 2.91Å; P3-A5 PolarHBondContact O-N 3.25Å; A5-V8 PolarHBondContact O-N 3.45Å; A5-I9 WeakPolarHBondContact O-CG1 3.45Å; A5-I9 PolarHBondContact O-N 3.05Å
6Q94.5Very high95.2Very high73 Ų7369.1 Ų69.134%0.34139%0.388SS..Hα-helixtrans-63.1-44-176.7-65-177.95.500113.4P3 V8 I9 Y10P3-Q6 WeakPolarHBondContact O-CB 3.42Å; P3-Q6 PolarHBondContact O-N 2.89Å; Q6-V8 VanDerWaalsContact C-N 3.3Å; Q6-V8 PolarHBondContact O-N 3.47Å; Q6-I9 PolarHBondContact O-N 3.26Å; Q6-Y10 HydrophobicContact CB-CD2 4.17Å; Q6-Y10 HydrophobicContact CB-CE2 4.03Å; Q6-Y10 WeakPolarHBondContact O-CD2 3.48Å; Q6-Y10 PolarHBondContact O-N 3.36Å
7P97.2Very high95.3Very high85 Ų8565.9 Ų65.955%0.55237%0.371SS*.Hα-helixtrans-57.5-43.3177.1-25.535.5000112.5P3 L4 I9 Y10 S11P3-P7 WeakPolarHBondContact O-CD 3.4Å; L4-P7 WeakPolarHBondContact O-CD 3.43Å; P7-I9 VanDerWaalsContact C-N 3.34Å; P7-I9 PolarHBondContact O-N 3.28Å; P7-Y10 PolarHBondContact O-N 3.05Å; P7-S11 WeakPolarHBondContact O-CB 3.21Å; P7-S11 PolarHBondContact O-N 3.41Å; P7-S11 PolarHBondContact O-OG 3.24Å; P7-S11 VanDerWaalsContact O-OG 3.07Å
8V97.3Very high95.4Very high94 Ų9466.5 Ų66.557%0.5737%0.372SS*.Hα-helixtrans-62.2-41.8179.5-176.90000111.4A5 Q6 S11 T12A5-V8 PolarHBondContact O-N 3.45Å; Q6-V8 VanDerWaalsContact C-N 3.3Å; Q6-V8 PolarHBondContact O-N 3.47Å; V8-S11 WeakPolarHBondContact CA-OG 3.3Å; V8-S11 PolarHBondContact O-OG 2.83Å; V8-T12 WeakPolarHBondContact O-CG2 3.37Å; V8-T12 PolarHBondContact O-N 3.47Å; V8-T12 PolarHBondContact O-OG1 3.49Å; V8-T12 VanDerWaalsContact O-OG1 3.14Å
9I97.3Very high95.6Very high35 Ų3566.1 Ų66.118%0.17937%0.368CS..Hα-helixtrans-68.2-41.9177.6-65.1165.1000111.1A5 Q6 P7 T12 I13 A39 P42 V43A5-I9 WeakPolarHBondContact O-CG1 3.45Å; A5-I9 PolarHBondContact O-N 3.05Å; Q6-I9 PolarHBondContact O-N 3.26Å; P7-I9 VanDerWaalsContact C-N 3.34Å; P7-I9 PolarHBondContact O-N 3.28Å; I9-T12 PolarHBondContact O-N 3.42Å; I9-T12 PolarHBondContact O-OG1 3.08Å; I9-I13 HydrophobicContact CG2-CD1 4.11Å; I9-I13 WeakPolarHBondContact O-CG1 3.32Å; I9-I13 PolarHBondContact O-N 3.48Å; I9-I13 VanDerWaalsContact O-N 3.12Å; I9-A39 WeakPolarHBondContact CG2-O 3.25Å; I9-P42 HydrophobicContact CD1-CB 4.17Å; I9-V43 HydrophobicContact CG2-CG2 3.97Å
10Y97.1Very high95.6Very high78 Ų7862.8 Ų62.831%0.30635%0.35SS..Hα-helixtrans-72.1-34.9-179.6-71.6-53.7000112.8Q6 P7 T12 I13 F14 V43 K46 L129Q6-Y10 HydrophobicContact CB-CD2 4.17Å; Q6-Y10 HydrophobicContact CB-CE2 4.03Å; Q6-Y10 WeakPolarHBondContact O-CD2 3.48Å; Q6-Y10 PolarHBondContact O-N 3.36Å; P7-Y10 PolarHBondContact O-N 3.05Å; Y10-T12 VanDerWaalsContact C-N 3.32Å; Y10-T12 PolarHBondContact O-N 2.67Å; Y10-I13 HydrophobicContact CD1-CD1 4.07Å; Y10-I13 HydrophobicContact CE1-CD1 4.45Å; Y10-I13 PolarHBondContact O-N 3.34Å; Y10-F14 PolarHBondContact O-N 3.47Å; Y10-V43 HydrophobicContact CE1-CG2 4.22Å; Y10-K46 PolarHBondContact OH-NZ 3.47Å; Y10-L129 HydrophobicContact CE1-CD1 3.87Å
11S97.6Very high95.5Very high66 Ų6662.3 Ų62.346%0.46236%0.355SS..Hα-helixtrans-65.4-35.917457.40000112.1P7 V8 F14 A15P7-S11 WeakPolarHBondContact O-CB 3.21Å; P7-S11 PolarHBondContact O-N 3.41Å; P7-S11 PolarHBondContact O-OG 3.24Å; P7-S11 VanDerWaalsContact O-OG 3.07Å; V8-S11 WeakPolarHBondContact CA-OG 3.3Å; V8-S11 PolarHBondContact O-OG 2.83Å; S11-F14 PolarHBondContact O-N 2.96Å; S11-A15 WeakPolarHBondContact O-CB 3.48Å; S11-A15 PolarHBondContact O-N 3.2Å
12T97.6Very high96.3Very high56 Ų5663.8 Ų63.834%0.34436%0.364SS..Hα-helixtrans-72.4-36.3176.451.50000112.4V8 I9 Y10 F14 A15 G16 A39V8-T12 WeakPolarHBondContact O-CG2 3.37Å; V8-T12 PolarHBondContact O-N 3.47Å; V8-T12 PolarHBondContact O-OG1 3.49Å; V8-T12 VanDerWaalsContact O-OG1 3.14Å; I9-T12 PolarHBondContact O-N 3.42Å; I9-T12 PolarHBondContact O-OG1 3.08Å; Y10-T12 VanDerWaalsContact C-N 3.32Å; Y10-T12 PolarHBondContact O-N 2.67Å; T12-F14 VanDerWaalsContact C-N 3.32Å; T12-F14 PolarHBondContact O-N 3.12Å; T12-A15 PolarHBondContact O-N 3.28Å; T12-G16 PolarHBondContact O-N 3.02Å; T12-A39 VanDerWaalsContact OG1-CB 3.29Å; T12-A39 WeakPolarHBondContact OG1-CB 3.33Å
13I97.8Very high96.5Very high8 Ų859.9 Ų59.94%0.04134%0.344CS..Hα-helixtrans-61.2-42170-68.2164.4000111I9 Y10 T17 N36 A39 F40 V43 W133I9-I13 HydrophobicContact CG2-CD1 4.11Å; I9-I13 WeakPolarHBondContact O-CG1 3.32Å; I9-I13 PolarHBondContact O-N 3.48Å; I9-I13 VanDerWaalsContact O-N 3.12Å; Y10-I13 HydrophobicContact CD1-CD1 4.07Å; Y10-I13 HydrophobicContact CE1-CD1 4.45Å; Y10-I13 PolarHBondContact O-N 3.34Å; I13-T17 PolarHBondContact O-N 3.46Å; I13-T17 PolarHBondContact O-OG1 3.42Å; I13-N36 PolarHBondContact O-OD1 3.38Å; I13-A39 HydrophobicContact CG1-CB 3.63Å; I13-F40 HydrophobicContact CD1-CD2 4.11Å; I13-V43 HydrophobicContact CD1-CG2 3.87Å; I13-W133 VanDerWaalsContact CG2-CD1 3.44Å; I13-W133 HydrophobicContact CG2-CG 4.45Å; I13-W133 VanDerWaalsContact CG2-NE1 3.35Å
14F97.9Very high96.6Very high113 Ų11359.7 Ų59.750%0.49635%0.345SS..Hα-helixtrans-65.3-50.3177.3178.5-98.7000111.6Y10 S11 T12 G16 T17 L18 W133Y10-F14 PolarHBondContact O-N 3.47Å; S11-F14 PolarHBondContact O-N 2.96Å; T12-F14 VanDerWaalsContact C-N 3.32Å; T12-F14 PolarHBondContact O-N 3.12Å; F14-G16 VanDerWaalsContact C-N 3.32Å; F14-G16 PolarHBondContact O-N 3.37Å; F14-T17 PolarHBondContact O-N 3.43Å; F14-T17 PolarHBondContact O-OG1 3.12Å; F14-L18 HydrophobicContact CE1-CD2 4.08Å; F14-L18 WeakPolarHBondContact O-CB 3.45Å; F14-L18 PolarHBondContact O-N 3.03Å; F14-W133 AromaticContact CD2-CH2 3.82Å; F14-W133 HydrophobicContact CD2-CH2 3.82Å; F14-W133 AromaticContact CD2-CZ2 3.75Å; F14-W133 HydrophobicContact CD2-CZ2 3.75Å; F14-W133 HydrophobicContact CE2-CH2 4.23Å; F14-W133 HydrophobicContact CE2-CZ2 4.48Å
15A97.6Very high96.6Very high36 Ų3656 Ų5630%0.29832%0.323SS..Hα-helixtrans-61.2-39.417900000112.1S11 T12 T17 L18 I19S11-A15 WeakPolarHBondContact O-CB 3.48Å; S11-A15 PolarHBondContact O-N 3.2Å; T12-A15 PolarHBondContact O-N 3.28Å; A15-T17 PolarHBondContact O-N 2.81Å; A15-L18 PolarHBondContact O-N 3.22Å; A15-I19 WeakPolarHBondContact O-CB 3.11Å; A15-I19 WeakPolarHBondContact O-CD1 3.26Å; A15-I19 WeakPolarHBondContact O-CG1 3.32Å; A15-I19 PolarHBondContact O-N 2.92Å
16G97.4Very high96.5Very high0 Ų054.2 Ų54.20%031%0.309CS..Hα-helixtrans-57.8-49.5176.900000112.2T12 F14 L18 T20 G32 N36T12-G16 PolarHBondContact O-N 3.02Å; F14-G16 VanDerWaalsContact C-N 3.32Å; F14-G16 PolarHBondContact O-N 3.37Å; G16-L18 PolarHBondContact O-N 3.24Å; G16-T20 PolarHBondContact O-N 3.37Å; G16-G32 CarbonylContact O-C 3.57Å; G16-G32 WeakPolarHBondContact O-CA 3.46Å; G16-N36 VanDerWaalsContact C-ND2 3.31Å; G16-N36 WeakPolarHBondContact CA-OD1 3.12Å
17T96.9Very high96.6Very high15 Ų1555.3 Ų55.39%0.09231%0.312CS..Hα-helixtrans-65.6-35.5174.946.50000113.4I13 F14 A15 T20 A21 N36 W133 A137I13-T17 PolarHBondContact O-N 3.46Å; I13-T17 PolarHBondContact O-OG1 3.42Å; F14-T17 PolarHBondContact O-N 3.43Å; F14-T17 PolarHBondContact O-OG1 3.12Å; A15-T17 PolarHBondContact O-N 2.81Å; T17-T20 PolarHBondContact O-OG1 3.33Å; T17-A21 PolarHBondContact O-N 3.39Å; T17-N36 WeakPolarHBondContact CA-ND2 3.48Å; T17-N36 WeakPolarHBondContact CG2-ND2 3.36Å; T17-N36 PolarHBondContact N-ND2 3.35Å; T17-N36 VanDerWaalsContact N-ND2 3.14Å; T17-N36 PolarHBondContact N-OD1 2.7Å; T17-W133 VanDerWaalsContact CG2-NE1 3.28Å; T17-W133 WeakPolarHBondContact OG1-CZ2 3.47Å; T17-W133 PolarHBondContact OG1-NE1 3.1Å; T17-A137 HydrophobicContact CG2-CB 4.12Å
18L97.6Very high96.6Very high76 Ų7656.8 Ų56.840%0.39831%0.31SS..Hα-helixtrans-69.7-41.9179.4-175.265.2000111.2F14 A15 G16 T20 A21 L22F14-L18 HydrophobicContact CE1-CD2 4.08Å; F14-L18 WeakPolarHBondContact O-CB 3.45Å; F14-L18 PolarHBondContact O-N 3.03Å; A15-L18 PolarHBondContact O-N 3.22Å; G16-L18 PolarHBondContact O-N 3.24Å; L18-T20 VanDerWaalsContact C-N 3.29Å; L18-T20 PolarHBondContact O-N 3.38Å; L18-A21 PolarHBondContact O-N 3.17Å; L18-L22 HydrophobicContact CD1-CD1 4.23Å; L18-L22 HydrophobicContact CD1-CG 4.26Å; L18-L22 HydrophobicContact CD2-CD1 4.22Å; L18-L22 HydrophobicContact CG-CD1 3.77Å; L18-L22 HydrophobicContact CG-CG 4.2Å; L18-L22 WeakPolarHBondContact O-CG 3.19Å; L18-L22 PolarHBondContact O-N 3.15Å
19I97.7Very high96.5Very high58 Ų5852.3 Ų52.330%0.29728%0.283SS..Hα-helixtrans-62-37.4178.7-72.3165.7000110.9A15 A21 L22 S23 M35A15-I19 WeakPolarHBondContact O-CB 3.11Å; A15-I19 WeakPolarHBondContact O-CD1 3.26Å; A15-I19 WeakPolarHBondContact O-CG1 3.32Å; A15-I19 PolarHBondContact O-N 2.92Å; I19-A21 VanDerWaalsContact C-N 3.3Å; I19-A21 PolarHBondContact O-N 2.96Å; I19-L22 PolarHBondContact O-N 3.5Å; I19-S23 VanDerWaalsContact O-CB 3.25Å; I19-S23 WeakPolarHBondContact O-CB 3.32Å; I19-S23 PolarHBondContact O-N 3.16Å; I19-S23 VanDerWaalsContact O-N 3.08Å; I19-S23 PolarHBondContact O-OG 3.02Å; I19-M35 HydrophobicContact CB-CE 4.28Å; I19-M35 HydrophobicContact CD1-CE 3.33Å; I19-M35 HydrophobicContact CD1-SD 4.39Å; I19-M35 HydrophobicContact CG1-CE 4.37Å; I19-M35 HydrophobicContact CG2-CE 4.26Å
20T96.4Very high96.5Very high0 Ų052.9 Ų52.90%028%0.283CS..Hα-helixtrans-63.8-34.1173.1540000113.3G16 T17 L18 S23 T29 L33 A137G16-T20 PolarHBondContact O-N 3.37Å; T17-T20 PolarHBondContact O-OG1 3.33Å; L18-T20 VanDerWaalsContact C-N 3.29Å; L18-T20 PolarHBondContact O-N 3.38Å; T20-S23 PolarHBondContact O-OG 3.33Å; T20-T29 WeakPolarHBondContact CG2-O 3.3Å; T20-L33 HydrophobicContact CG2-CD2 4.39Å; T20-L33 HydrophobicContact CG2-CG 4.1Å; T20-A137 HydrophobicContact CG2-CB 4.11Å; T20-A137 VanDerWaalsContact OG1-CB 3.27Å; T20-A137 WeakPolarHBondContact OG1-CB 3.25Å
21A94.4Very high96.6Very high54 Ų5451 Ų5145%0.44628%0.279SS..Hα-helixtrans-78.2-36179.500000112.4T17 L18 I19T17-A21 PolarHBondContact O-N 3.39Å; L18-A21 PolarHBondContact O-N 3.17Å; I19-A21 VanDerWaalsContact C-N 3.3Å; I19-A21 PolarHBondContact O-N 2.96Å
22L96.3Very high96.6Very high130 Ų13047.8 Ų47.868%0.68126%0.257SS*.Hα-helixtrans-78.9-20.8-179-69.1176000113.9L18 I19L18-L22 HydrophobicContact CD1-CD1 4.23Å; L18-L22 HydrophobicContact CD1-CG 4.26Å; L18-L22 HydrophobicContact CD2-CD1 4.22Å; L18-L22 HydrophobicContact CG-CD1 3.77Å; L18-L22 HydrophobicContact CG-CG 4.2Å; L18-L22 WeakPolarHBondContact O-CG 3.19Å; L18-L22 PolarHBondContact O-N 3.15Å; I19-L22 PolarHBondContact O-N 3.5Å
23S95.1Very high96.5Very high12 Ų1245.4 Ų45.48%0.08424%0.242CC..  trans-78.2132.6-171.340.20000112.8I19 T20 F28 T29I19-S23 VanDerWaalsContact O-CB 3.25Å; I19-S23 WeakPolarHBondContact O-CB 3.32Å; I19-S23 PolarHBondContact O-N 3.16Å; I19-S23 VanDerWaalsContact O-N 3.08Å; I19-S23 PolarHBondContact O-OG 3.02Å; T20-S23 PolarHBondContact O-OG 3.33Å; S23-F28 VanDerWaalsContact CB-CB 3.46Å; S23-T29 WeakPolarHBondContact OG-CG2 3.14Å; S23-T29 PolarHBondContact OG-N 3.16Å
24S93.6Very high96.5Very high86 Ų8646.5 Ų46.560%0.60125%0.247SC*.  trans-96.7-21.5168.657.50000112.7T85 M86S24-T85 WeakPolarHBondContact O-CA 3.3Å; S24-M86 WeakPolarHBondContact O-CG 3.38Å; S24-M86 PolarHBondContact O-N 3.17Å
25H95.1Very high96.4Very high62 Ų6244.1 Ų44.129%0.28724%0.238SC..BIsolated β-bridgetrans-95.8129.7-179.7-168.9-76000110.7F27 F28 T29 W84H25-F27 VanDerWaalsContact ND1-CB 3.3Å; H25-F27 WeakPolarHBondContact ND1-CB 3.49Å; H25-F27 PolarHBondContact ND1-N 3.15Å; H25-F27 VanDerWaalsContact ND1-N 3.12Å; H25-F27 PolarHBondContact O-N 3.24Å; H25-F27 VanDerWaalsContact O-N 3.12Å; H25-F28 HydrophobicContact CB-CD2 4.07Å; H25-F28 PolarHBondContact O-N 3.28Å; H25-T29 PolarHBondContact O-N 3.19Å; H25-W84 WeakPolarHBondContact CA-O 3.36Å; H25-W84 AromaticContact CE1-CD2 3.69Å; H25-W84 AromaticContact CE1-CE3 3.21Å; H25-W84 AromaticContact CE1-CZ3 3.89Å; H25-W84 VanDerWaalsContact NE2-CB 3.33Å; H25-W84 WeakPolarHBondContact NE2-CB 3.43Å; H25-W84 AromaticContact NE2-CD2 3.6Å; H25-W84 AromaticContact NE2-CE3 3.63Å; H25-W84 AromaticContact NE2-CG 3.52Å
26W94.4Very high96.4Very high2 Ų242.6 Ų42.61%0.00823%0.225CC..Hα-helixtrans-53.4-34.6-177.9-85.4105.9000114.3F28 T29 W30 I74 W84 T85 M86 T90 I98 I141 I145W26-F28 PolarHBondContact O-N 3Å; W26-T29 PolarHBondContact O-N 3.38Å; W26-T29 PolarHBondContact O-OG1 3.31Å; W26-W30 PolarHBondContact O-N 2.61Å; W26-I74 HydrophobicContact CB-CB 4.36Å; W26-I74 HydrophobicContact CB-CD1 3.91Å; W26-I74 HydrophobicContact CB-CG1 3.86Å; W26-I74 HydrophobicContact CB-CG2 3.58Å; W26-I74 HydrophobicContact CD2-CD1 4.44Å; W26-I74 HydrophobicContact CD2-CG1 3.95Å; W26-I74 HydrophobicContact CE3-CD1 3.89Å; W26-I74 HydrophobicContact CE3-CG1 3.66Å; W26-I74 HydrophobicContact CG-CG1 4.08Å; W26-I74 HydrophobicContact CG-CG2 4.23Å; W26-I74 WeakPolarHBondContact O-CD1 3.05Å; W26-W84 VanDerWaalsContact CD1-O 3.29Å; W26-W84 PolarHBondContact N-O 3.31Å; W26-T85 PolarHBondContact NE1-O 3.44Å; W26-M86 HydrophobicContact CD2-CE 4.3Å; W26-M86 HydrophobicContact CD2-SD 3.14Å; W26-M86 HydrophobicContact CE3-CE 4.11Å; W26-M86 HydrophobicContact CE3-SD 3.32Å; W26-M86 HydrophobicContact CG-SD 3.73Å; W26-M86 HydrophobicContact CH2-CE 3.46Å; W26-M86 VanDerWaalsContact CH2-CE 3.46Å; W26-M86 HydrophobicContact CH2-SD 3.65Å; W26-M86 HydrophobicContact CZ2-CE 3.66Å; W26-M86 HydrophobicContact CZ2-SD 3.48Å; W26-M86 WeakPolarHBondContact CZ2-SD 3.3Å; W26-M86 HydrophobicContact CZ3-CE 3.7Å; W26-M86 HydrophobicContact CZ3-SD 3.58Å; W26-M86 VanDerWaalsContact CZ3-SD 3.58Å; W26-T90 HydrophobicContact CH2-CG2 4.5Å; W26-T90 HydrophobicContact CZ2-CG2 3.73Å; W26-I98 HydrophobicContact CH2-CD1 3.55Å; W26-I98 HydrophobicContact CH2-CG1 4.42Å; W26-I98 HydrophobicContact CZ2-CD1 4.07Å; W26-I98 HydrophobicContact CZ3-CD1 4.05Å; W26-I141 HydrophobicContact CH2-CG2 4.45Å; W26-I141 HydrophobicContact CZ3-CG2 4.22Å; W26-I145 HydrophobicContact CH2-CD1 4.5Å; W26-I145 HydrophobicContact CH2-CG2 3.66Å; W26-I145 HydrophobicContact CZ2-CG2 3.76Å
27F96.3Very high96.3Very high95 Ų9542.7 Ų42.742%0.41723%0.226SC..Hα-helixtrans-62.1-41175.9-174.9-105000112.9H25 W30 V31H25-F27 VanDerWaalsContact ND1-CB 3.3Å; H25-F27 WeakPolarHBondContact ND1-CB 3.49Å; H25-F27 PolarHBondContact ND1-N 3.15Å; H25-F27 VanDerWaalsContact ND1-N 3.12Å; H25-F27 PolarHBondContact O-N 3.24Å; H25-F27 VanDerWaalsContact O-N 3.12Å; F27-W30 HydrophobicContact CD2-CE3 4.35Å; F27-W30 AromaticContact CE2-CE3 3.94Å; F27-W30 HydrophobicContact CE2-CE3 3.94Å; F27-W30 HydrophobicContact CE2-CZ3 4.03Å; F27-W30 HydrophobicContact CZ-CE3 4.4Å; F27-W30 HydrophobicContact CZ-CZ3 4.28Å; F27-W30 WeakPolarHBondContact O-CB 3.49Å; F27-W30 PolarHBondContact O-N 3.04Å; F27-V31 HydrophobicContact CD1-CG2 3.95Å; F27-V31 HydrophobicContact CE1-CG2 3.56Å; F27-V31 HydrophobicContact CE2-CG2 4.49Å; F27-V31 HydrophobicContact CZ-CG2 3.87Å; F27-V31 WeakPolarHBondContact O-CG2 3.44Å; F27-V31 PolarHBondContact O-N 3.08Å
28F97Very high96.4Very high116 Ų11646.9 Ų46.951%0.50925%0.247SC..Hα-helixtrans-73.1-29.4-179.6-71.6-51.4000112.5S23 H25 W26 W30 V31 G32S23-F28 VanDerWaalsContact CB-CB 3.46Å; H25-F28 HydrophobicContact CB-CD2 4.07Å; H25-F28 PolarHBondContact O-N 3.28Å; W26-F28 PolarHBondContact O-N 3Å; F28-W30 VanDerWaalsContact C-N 3.31Å; F28-V31 PolarHBondContact O-N 3.23Å; F28-G32 PolarHBondContact O-N 3.48Å
29T96.1Very high96.3Very high0 Ų043.8 Ų43.80%023%0.233CC..Hα-helixtrans-63.5-40.8170.563.10000110.6T20 S23 H25 W26 G32 L33 M86T20-T29 WeakPolarHBondContact CG2-O 3.3Å; S23-T29 WeakPolarHBondContact OG-CG2 3.14Å; S23-T29 PolarHBondContact OG-N 3.16Å; H25-T29 PolarHBondContact O-N 3.19Å; W26-T29 PolarHBondContact O-N 3.38Å; W26-T29 PolarHBondContact O-OG1 3.31Å; T29-G32 PolarHBondContact O-N 3.21Å; T29-L33 WeakPolarHBondContact O-CG 3.43Å; T29-L33 PolarHBondContact O-N 3.38Å; T29-M86 HydrophobicContact CG2-CE 4.42Å; T29-M86 HydrophobicContact CG2-CG 4.16Å; T29-M86 HydrophobicContact CG2-SD 3.84Å
30W97.6Very high96.3Very high48 Ų4841.1 Ų41.118%0.18222%0.219CC..Hα-helixtrans-62.7-46.8172.5178.784000112.5W26 F27 F28 G32 L33 E34 S67 L70 L71 I74W26-W30 PolarHBondContact O-N 2.61Å; F27-W30 HydrophobicContact CD2-CE3 4.35Å; F27-W30 AromaticContact CE2-CE3 3.94Å; F27-W30 HydrophobicContact CE2-CE3 3.94Å; F27-W30 HydrophobicContact CE2-CZ3 4.03Å; F27-W30 HydrophobicContact CZ-CE3 4.4Å; F27-W30 HydrophobicContact CZ-CZ3 4.28Å; F27-W30 WeakPolarHBondContact O-CB 3.49Å; F27-W30 PolarHBondContact O-N 3.04Å; F28-W30 VanDerWaalsContact C-N 3.31Å; W30-G32 VanDerWaalsContact C-N 3.32Å; W30-G32 PolarHBondContact O-N 3.11Å; W30-L33 WeakPolarHBondContact O-CB 3.36Å; W30-L33 PolarHBondContact O-N 3.26Å; W30-L33 VanDerWaalsContact O-N 3.12Å; W30-E34 HydrophobicContact CD2-CG 4.01Å; W30-E34 HydrophobicContact CE3-CG 4.33Å; W30-E34 HydrophobicContact CH2-CG 3.92Å; W30-E34 HydrophobicContact CZ2-CG 3.55Å; W30-E34 HydrophobicContact CZ3-CG 4.29Å; W30-E34 PolarHBondContact O-N 3.15Å; W30-S67 PolarHBondContact NE1-O 3.36Å; W30-S67 VanDerWaalsContact NE1-O 3.16Å; W30-L70 HydrophobicContact CB-CD2 3.62Å; W30-L70 VanDerWaalsContact CD1-CD2 3.49Å; W30-L70 HydrophobicContact CG-CD2 3.95Å; W30-L71 HydrophobicContact CD2-CD1 4.07Å; W30-L71 HydrophobicContact CE3-CD1 4.49Å; W30-L71 HydrophobicContact CH2-CD1 4.36Å; W30-L71 HydrophobicContact CZ2-CD1 3.91Å; W30-I74 HydrophobicContact CB-CD1 4.27Å
31V97.8Very high96.4Very high37 Ų3742.9 Ų42.922%0.22423%0.228CC..Hα-helixtrans-58.1-42.9178.11710000111.6F27 F28 L33 E34 M35F27-V31 HydrophobicContact CD1-CG2 3.95Å; F27-V31 HydrophobicContact CE1-CG2 3.56Å; F27-V31 HydrophobicContact CE2-CG2 4.49Å; F27-V31 HydrophobicContact CZ-CG2 3.87Å; F27-V31 WeakPolarHBondContact O-CG2 3.44Å; F27-V31 PolarHBondContact O-N 3.08Å; F28-V31 PolarHBondContact O-N 3.23Å; V31-L33 PolarHBondContact O-N 3.43Å; V31-E34 PolarHBondContact O-N 3.27Å; V31-M35 HydrophobicContact CG1-CE 3.71Å; V31-M35 HydrophobicContact CG1-SD 4.45Å; V31-M35 PolarHBondContact O-N 2.87Å
32G97.4Very high96.4Very high0 Ų042.1 Ų42.10%022%0.219CC..Hα-helixtrans-62.5-39.6176.700000113.2G16 F28 T29 W30 N36G16-G32 CarbonylContact O-C 3.57Å; G16-G32 WeakPolarHBondContact O-CA 3.46Å; F28-G32 PolarHBondContact O-N 3.48Å; T29-G32 PolarHBondContact O-N 3.21Å; W30-G32 VanDerWaalsContact C-N 3.32Å; W30-G32 PolarHBondContact O-N 3.11Å; G32-N36 PolarHBondContact O-N 2.74Å; G32-N36 VanDerWaalsContact O-N 3.12Å; G32-N36 PolarHBondContact O-ND2 3.38Å
33L96.4Very high96.4Very high6 Ų636.1 Ų36.13%0.03119%0.187CC..Hα-helixtrans-65.3-38.8174.3-71.4173.3000112.6T20 T29 W30 V31 M37 L70 M102 K105 A137 P138 I141T20-L33 HydrophobicContact CG2-CD2 4.39Å; T20-L33 HydrophobicContact CG2-CG 4.1Å; T29-L33 WeakPolarHBondContact O-CG 3.43Å; T29-L33 PolarHBondContact O-N 3.38Å; W30-L33 WeakPolarHBondContact O-CB 3.36Å; W30-L33 PolarHBondContact O-N 3.26Å; W30-L33 VanDerWaalsContact O-N 3.12Å; V31-L33 PolarHBondContact O-N 3.43Å; L33-M37 WeakPolarHBondContact O-CB 3.37Å; L33-M37 PolarHBondContact O-N 2.9Å; L33-L70 HydrophobicContact CD1-CD1 4.17Å; L33-L70 HydrophobicContact CD1-CD2 4.37Å; L33-M102 HydrophobicContact CD1-CE 4.22Å; L33-K105 HydrophobicContact CD1-CD 4.18Å; L33-K105 HydrophobicContact CD2-CD 4.13Å; L33-A137 HydrophobicContact CD2-CB 3.97Å; L33-P138 HydrophobicContact CD2-CG 4.36Å; L33-I141 HydrophobicContact CD1-CD1 3.58Å; L33-I141 HydrophobicContact CD2-CD1 4.19Å; L33-I141 HydrophobicContact CG-CD1 3.97Å
34E97.6Very high96.5Very high31 Ų3135.6 Ų35.615%0.14518%0.183CC..Hα-helixtrans-68.3-44.1177.5-75.6-63.216800112.4W30 V31 N36 M37 L38 S67W30-E34 HydrophobicContact CD2-CG 4.01Å; W30-E34 HydrophobicContact CE3-CG 4.33Å; W30-E34 HydrophobicContact CH2-CG 3.92Å; W30-E34 HydrophobicContact CZ2-CG 3.55Å; W30-E34 HydrophobicContact CZ3-CG 4.29Å; W30-E34 PolarHBondContact O-N 3.15Å; V31-E34 PolarHBondContact O-N 3.27Å; E34-N36 VanDerWaalsContact C-N 3.31Å; E34-N36 PolarHBondContact O-N 3.45Å; E34-M37 PolarHBondContact O-N 3.14Å; E34-L38 PolarHBondContact O-N 3.07Å; E34-S67 WeakPolarHBondContact OE1-CB 3.32Å; E34-S67 PolarHBondContact OE1-OG 2.86Å
35M96.8Very high96.6Very high62 Ų6232.8 Ų32.831%0.30516%0.163SC..Hα-helixtrans-59.6-43.3175.2-76.2-173.5-66.400111.7I19 V31 M37 A39I19-M35 HydrophobicContact CB-CE 4.28Å; I19-M35 HydrophobicContact CD1-CE 3.33Å; I19-M35 HydrophobicContact CD1-SD 4.39Å; I19-M35 HydrophobicContact CG1-CE 4.37Å; I19-M35 HydrophobicContact CG2-CE 4.26Å; V31-M35 HydrophobicContact CG1-CE 3.71Å; V31-M35 HydrophobicContact CG1-SD 4.45Å; V31-M35 PolarHBondContact O-N 2.87Å; M35-M37 VanDerWaalsContact C-N 3.33Å; M35-M37 PolarHBondContact O-N 3.21Å; M35-A39 WeakPolarHBondContact O-CB 3.34Å; M35-A39 PolarHBondContact O-N 3.5Å
36N96.3Very high96.3Very high4 Ų432.4 Ų32.42%0.02116%0.16CC..Hα-helixtrans-59.1-45.3175.2-80.5-27.4000112.1I13 G16 T17 G32 E34 F40I13-N36 PolarHBondContact O-OD1 3.38Å; G16-N36 VanDerWaalsContact C-ND2 3.31Å; G16-N36 WeakPolarHBondContact CA-OD1 3.12Å; T17-N36 WeakPolarHBondContact CA-ND2 3.48Å; T17-N36 WeakPolarHBondContact CG2-ND2 3.36Å; T17-N36 PolarHBondContact N-ND2 3.35Å; T17-N36 VanDerWaalsContact N-ND2 3.14Å; T17-N36 PolarHBondContact N-OD1 2.7Å; G32-N36 PolarHBondContact O-N 2.74Å; G32-N36 VanDerWaalsContact O-N 3.12Å; G32-N36 PolarHBondContact O-ND2 3.38Å; E34-N36 VanDerWaalsContact C-N 3.31Å; E34-N36 PolarHBondContact O-N 3.45Å; N36-F40 WeakPolarHBondContact O-CB 3.38Å; N36-F40 PolarHBondContact O-N 3.49Å
37M96.5Very high96Very high2 Ų238.9 Ų38.91%0.0119%0.188CC..Hα-helixtrans-63.2-52.6-178.3-179-80.5-14100110.9L33 E34 M35 A39 F40 I41 Y59 F60 Q63 T64L33-M37 WeakPolarHBondContact O-CB 3.37Å; L33-M37 PolarHBondContact O-N 2.9Å; E34-M37 PolarHBondContact O-N 3.14Å; M35-M37 VanDerWaalsContact C-N 3.33Å; M35-M37 PolarHBondContact O-N 3.21Å; M37-A39 PolarHBondContact O-N 3.4Å; M37-F40 PolarHBondContact O-N 2.88Å; M37-I41 WeakPolarHBondContact O-CG1 3.36Å; M37-I41 PolarHBondContact O-N 3.32Å; M37-I41 HydrophobicContact SD-CD1 3.75Å; M37-I41 HydrophobicContact SD-CG1 4.5Å; M37-Y59 HydrophobicContact CG-CE1 4.33Å; M37-F60 HydrophobicContact CE-CD2 3.24Å; M37-F60 HydrophobicContact CE-CE2 3.46Å; M37-F60 VanDerWaalsContact CE-CE2 3.46Å; M37-F60 HydrophobicContact CE-CG 4.15Å; M37-F60 HydrophobicContact CE-CZ 4.48Å; M37-F60 HydrophobicContact SD-CD2 4.04Å; M37-F60 HydrophobicContact SD-CE2 4.34Å; M37-Q63 HydrophobicContact CE-CB 4.41Å; M37-Q63 HydrophobicContact CG-CB 3.71Å; M37-T64 HydrophobicContact CE-CG2 3.12Å
38L97.2Very high95.8Very high103 Ų10340.7 Ų40.754%0.53920%0.2SC..Hα-helixtrans-64.9-43.6-177.5-69.8173.4000112.1E34 F40 I41 P42E34-L38 PolarHBondContact O-N 3.07Å; L38-F40 VanDerWaalsContact C-N 3.26Å; L38-F40 PolarHBondContact O-N 3.39Å; L38-I41 HydrophobicContact CD2-CD1 4.45Å; L38-I41 PolarHBondContact O-N 2.98Å; L38-P42 VanDerWaalsContact O-CD 3.31Å; L38-P42 WeakPolarHBondContact O-CD 3.47Å
39A97Very high95.6Very high12 Ų1238.9 Ų38.910%0.09920%0.196CC..Hα-helixtrans-68.8-25.4179.300000112.7I9 T12 I13 M35 M37 P42I9-A39 WeakPolarHBondContact CG2-O 3.25Å; T12-A39 VanDerWaalsContact OG1-CB 3.29Å; T12-A39 WeakPolarHBondContact OG1-CB 3.33Å; I13-A39 HydrophobicContact CG1-CB 3.63Å; M35-A39 WeakPolarHBondContact O-CB 3.34Å; M35-A39 PolarHBondContact O-N 3.5Å; M37-A39 PolarHBondContact O-N 3.4Å; A39-P42 WeakPolarHBondContact O-CD 3.46Å
40F97.5Very high95.6Very high1 Ų144.1 Ų44.10%0.00423%0.229CC..Hα-helixtrans-81.1-25.1-179.5-166-110.9000114.2I13 N36 M37 L38 V43 L44 Y59 L129 L130 Q134I13-F40 HydrophobicContact CD1-CD2 4.11Å; N36-F40 WeakPolarHBondContact O-CB 3.38Å; N36-F40 PolarHBondContact O-N 3.49Å; M37-F40 PolarHBondContact O-N 2.88Å; L38-F40 VanDerWaalsContact C-N 3.26Å; L38-F40 PolarHBondContact O-N 3.39Å; F40-V43 HydrophobicContact CD2-CB 4.19Å; F40-V43 HydrophobicContact CD2-CG2 4.38Å; F40-V43 HydrophobicContact CE2-CB 4.24Å; F40-V43 HydrophobicContact CE2-CG1 4.12Å; F40-V43 VanDerWaalsContact O-CB 3.29Å; F40-V43 WeakPolarHBondContact O-CB 3.36Å; F40-V43 PolarHBondContact O-N 3.4Å; F40-L44 HydrophobicContact CD1-CD1 4.22Å; F40-L44 HydrophobicContact CD1-CD2 4.36Å; F40-L44 HydrophobicContact CD1-CG 4.14Å; F40-L44 HydrophobicContact CE1-CD1 4.24Å; F40-L44 HydrophobicContact CE1-CD2 3.66Å; F40-L44 HydrophobicContact CE1-CG 3.94Å; F40-L44 HydrophobicContact CZ-CD2 4.17Å; F40-L44 PolarHBondContact O-N 3.33Å; F40-Y59 AromaticContact CD1-CE1 3.91Å; F40-Y59 HydrophobicContact CD1-CE1 3.91Å; F40-Y59 HydrophobicContact CD1-CE2 4.25Å; F40-Y59 AromaticContact CD1-CZ 3.7Å; F40-L129 HydrophobicContact CE2-CB 3.66Å; F40-L129 HydrophobicContact CE2-CD1 4.49Å; F40-L129 HydrophobicContact CZ-CB 4.12Å; F40-L130 HydrophobicContact CD1-CD1 4.5Å; F40-L130 HydrophobicContact CE1-CB 3.98Å; F40-L130 HydrophobicContact CE1-CD1 3.62Å; F40-L130 HydrophobicContact CE1-CG 4.39Å; F40-L130 HydrophobicContact CZ-CB 3.78Å; F40-L130 HydrophobicContact CZ-CD1 4.28Å; F40-Q134 HydrophobicContact CD1-CG 4.22Å; F40-Q134 HydrophobicContact CD2-CG 4.39Å; F40-Q134 VanDerWaalsContact CD2-NE2 3.27Å; F40-Q134 HydrophobicContact CE1-CG 4.1Å; F40-Q134 HydrophobicContact CE2-CG 4.31Å; F40-Q134 HydrophobicContact CG-CG 4.36Å; F40-Q134 VanDerWaalsContact CG-NE2 3.32Å; F40-Q134 HydrophobicContact CZ-CG 4.17Å
41I97.1Very high95.4Very high37 Ų3747.8 Ų47.819%0.1924%0.243CC..Hα-helixtrans-55.9-48.4-179.2-66.7160.4000112.8M37 L38 V43 L44 A56 Y59 F60M37-I41 WeakPolarHBondContact O-CG1 3.36Å; M37-I41 PolarHBondContact O-N 3.32Å; M37-I41 HydrophobicContact SD-CD1 3.75Å; M37-I41 HydrophobicContact SD-CG1 4.5Å; L38-I41 HydrophobicContact CD2-CD1 4.45Å; L38-I41 PolarHBondContact O-N 2.98Å; I41-V43 PolarHBondContact O-N 2.84Å; I41-L44 WeakPolarHBondContact O-CB 3.5Å; I41-L44 PolarHBondContact O-N 3.47Å; I41-A56 HydrophobicContact CG2-CB 4.44Å; I41-Y59 HydrophobicContact CG1-CD1 4.37Å; I41-F60 HydrophobicContact CD1-CD2 3.59Å; I41-F60 HydrophobicContact CD1-CE2 4.29Å; I41-F60 HydrophobicContact CD1-CG 4.5Å
42P95.8Very high95.3Very high39 Ų3946.1 Ų46.125%0.25323%0.233SC..Hα-helixtrans-59.5-29177.1-24.534.4000113.5M1 I9 L38 A39 L44 T45M1-P42 HydrophobicContact CE-CB 3.53Å; M1-P42 WeakPolarHBondContact CE-O 3.39Å; I9-P42 HydrophobicContact CD1-CB 4.17Å; L38-P42 VanDerWaalsContact O-CD 3.31Å; L38-P42 WeakPolarHBondContact O-CD 3.47Å; A39-P42 WeakPolarHBondContact O-CD 3.46Å; P42-L44 VanDerWaalsContact C-N 3.26Å; P42-L44 PolarHBondContact O-N 3.04Å; P42-T45 PolarHBondContact O-N 3.14Å; P42-T45 PolarHBondContact O-OG1 3.16Å
43V96.6Very high95.3Very high4 Ų448.9 Ų48.92%0.02425%0.25CC..Hα-helixtrans-67.5-30.5178.5-175.80000111I9 Y10 I13 F40 I41 K46 S126 L129I9-V43 HydrophobicContact CG2-CG2 3.97Å; Y10-V43 HydrophobicContact CE1-CG2 4.22Å; I13-V43 HydrophobicContact CD1-CG2 3.87Å; F40-V43 HydrophobicContact CD2-CB 4.19Å; F40-V43 HydrophobicContact CD2-CG2 4.38Å; F40-V43 HydrophobicContact CE2-CB 4.24Å; F40-V43 HydrophobicContact CE2-CG1 4.12Å; F40-V43 VanDerWaalsContact O-CB 3.29Å; F40-V43 WeakPolarHBondContact O-CB 3.36Å; F40-V43 PolarHBondContact O-N 3.4Å; I41-V43 PolarHBondContact O-N 2.84Å; V43-K46 WeakPolarHBondContact O-CG 3.48Å; V43-S126 WeakPolarHBondContact O-CB 3.43Å; V43-L129 HydrophobicContact CG1-CD1 3.98Å
44L96.1Very high95.3Very high0 Ų053.2 Ų53.20%027%0.27CS..Hα-helixtrans-73.4-29.6177.3-63175.1000112.8F40 I41 P42 S52 A56 Y59 V118 T122F40-L44 HydrophobicContact CD1-CD1 4.22Å; F40-L44 HydrophobicContact CD1-CD2 4.36Å; F40-L44 HydrophobicContact CD1-CG 4.14Å; F40-L44 HydrophobicContact CE1-CD1 4.24Å; F40-L44 HydrophobicContact CE1-CD2 3.66Å; F40-L44 HydrophobicContact CE1-CG 3.94Å; F40-L44 HydrophobicContact CZ-CD2 4.17Å; F40-L44 PolarHBondContact O-N 3.33Å; I41-L44 WeakPolarHBondContact O-CB 3.5Å; I41-L44 PolarHBondContact O-N 3.47Å; P42-L44 VanDerWaalsContact C-N 3.26Å; P42-L44 PolarHBondContact O-N 3.04Å; L44-S52 PolarHBondContact O-OG 2.8Å; L44-A56 HydrophobicContact CB-CB 4.11Å; L44-A56 HydrophobicContact CD1-CB 4.43Å; L44-Y59 HydrophobicContact CD1-CD1 3.7Å; L44-Y59 HydrophobicContact CD1-CD2 4.42Å; L44-Y59 HydrophobicContact CD1-CE1 4.4Å; L44-Y59 HydrophobicContact CD1-CG 3.71Å; L44-V118 HydrophobicContact CD1-CG1 4.28Å; L44-V118 HydrophobicContact CD2-CG1 3.96Å; L44-T122 HydrophobicContact CB-CG2 4.09Å; L44-T122 HydrophobicContact CD2-CG2 3.61Å; L44-T122 HydrophobicContact CG-CG2 4.46Å
45T95.3Very high95.3Very high27 Ų2751.9 Ų51.917%0.16627%0.265CS..THydrogen-bonded Turntrans-94.310.5-173.1570000114.8P42 K47 M48 S52 T53 A56P42-T45 PolarHBondContact O-N 3.14Å; P42-T45 PolarHBondContact O-OG1 3.16Å; T45-K47 VanDerWaalsContact C-N 3.29Å; T45-K47 PolarHBondContact O-N 2.97Å; T45-M48 PolarHBondContact O-N 2.85Å; T45-S52 WeakPolarHBondContact CA-OG 3.42Å; T45-T53 HydrophobicContact CG2-CG2 4.37Å; T45-A56 HydrophobicContact CG2-CB 3.59Å
46K90.3Very high95.3Very high54 Ų5449.3 Ų49.324%0.23525%0.253CS..THydrogen-bonded Turntrans-45.4-41.4-173.6-81.9178.7176.8-169.20117M1 Y10 V43 P123M1-K46 HydrophobicContact SD-CB 4.16Å; M1-K46 HydrophobicContact SD-CG 3.53Å; M1-K46 VanDerWaalsContact SD-CG 3.53Å; Y10-K46 PolarHBondContact OH-NZ 3.47Å; V43-K46 WeakPolarHBondContact O-CG 3.48Å; K46-P123 HydrophobicContact CB-CG 4.28Å; K46-P123 HydrophobicContact CD-CG 4.42Å
47K87.4Confident95.4Very high138 Ų13854 Ų5460%0.628%0.277SS*.THydrogen-bonded Turntrans-92.2-3.2-174.2-71.4-167.8173.2-1700114.2T45 N49T45-K47 VanDerWaalsContact C-N 3.29Å; T45-K47 PolarHBondContact O-N 2.97Å; K47-N49 PolarHBondContact O-N 3.19Å; K47-N49 VanDerWaalsContact O-N 3.13Å; K47-N49 PolarHBondContact O-OD1 3.12Å
48M91.2Very high95.4Very high133 Ų13356.7 Ų56.766%0.65529%0.289SS*.  trans5425.5-176.5-55.1-55.6-157.100114.9T45T45-M48 PolarHBondContact O-N 2.85Å
49N93.4Very high95.5Very high79 Ų7951.9 Ų51.942%0.42226%0.263SS..  trans-77.6147.1175.4-67.5-13.7000110K47 R51 S52 T53K47-N49 PolarHBondContact O-N 3.19Å; K47-N49 VanDerWaalsContact O-N 3.13Å; K47-N49 PolarHBondContact O-OD1 3.12Å; N49-R51 PolarHBondContact O-N 3.12Å; N49-R51 VanDerWaalsContact O-N 3.16Å; N49-S52 WeakPolarHBondContact O-CA 3.44Å; N49-S52 WeakPolarHBondContact O-CB 3.27Å; N49-S52 PolarHBondContact O-N 3.35Å; N49-T53 PolarHBondContact O-N 2.96Å; N49-T53 PolarHBondContact O-OG1 3.29Å
50P95.5Very high95.5Very high109 Ų10955.4 Ų55.471%0.70828%0.276SS*.Hα-helixtrans-57.9-35.5176.823.1-33.7000112S52 T53 E54P50-S52 VanDerWaalsContact C-N 3.34Å; P50-S52 PolarHBondContact O-N 3.48Å; P50-T53 WeakPolarHBondContact CA-OG1 3.46Å; P50-T53 PolarHBondContact O-N 3.27Å; P50-T53 PolarHBondContact O-OG1 3.5Å; P50-E54 WeakPolarHBondContact O-CB 3.32Å; P50-E54 PolarHBondContact O-N 3.34Å
51R95.2Very high95.6Very high126 Ų12660 Ų6048%0.47530%0.301SS..Hα-helixtrans-68.3-32.2174.9-167.4-178.8-175.4152.714.7113.6N49 A55N49-R51 PolarHBondContact O-N 3.12Å; N49-R51 VanDerWaalsContact O-N 3.16Å; R51-A55 VanDerWaalsContact O-CB 3.32Å; R51-A55 WeakPolarHBondContact O-CB 3.24Å; R51-A55 PolarHBondContact O-N 3.28Å; R51-A55 VanDerWaalsContact O-N 3.08Å
52S95.5Very high95.6Very high1 Ų160 Ų601%0.00730%0.302CS..Hα-helixtrans-76.2-35179.9168.60000110.5L44 T45 N49 P50 A56L44-S52 PolarHBondContact O-OG 2.8Å; T45-S52 WeakPolarHBondContact CA-OG 3.42Å; N49-S52 WeakPolarHBondContact O-CA 3.44Å; N49-S52 WeakPolarHBondContact O-CB 3.27Å; N49-S52 PolarHBondContact O-N 3.35Å; P50-S52 VanDerWaalsContact C-N 3.34Å; P50-S52 PolarHBondContact O-N 3.48Å; S52-A56 PolarHBondContact O-N 2.95Å
53T96.1Very high95.7Very high58 Ų5858.6 Ų58.636%0.35629%0.292SS..Hα-helixtrans-72.1-41.9172.152.90000112.1T45 N49 P50 A55 A56 I57T45-T53 HydrophobicContact CG2-CG2 4.37Å; N49-T53 PolarHBondContact O-N 2.96Å; N49-T53 PolarHBondContact O-OG1 3.29Å; P50-T53 WeakPolarHBondContact CA-OG1 3.46Å; P50-T53 PolarHBondContact O-N 3.27Å; P50-T53 PolarHBondContact O-OG1 3.5Å; T53-A55 VanDerWaalsContact C-N 3.33Å; T53-A55 PolarHBondContact O-N 3.25Å; T53-A56 WeakPolarHBondContact O-CB 2.96Å; T53-A56 PolarHBondContact O-N 3Å; T53-A56 VanDerWaalsContact O-N 3.13Å; T53-I57 WeakPolarHBondContact O-CG1 3.4Å; T53-I57 PolarHBondContact O-N 3.23Å; T53-I57 VanDerWaalsContact O-N 3.09Å
54E97.4Very high95.7Very high97 Ų9759.9 Ų59.945%0.45330%0.301SS..Hα-helixtrans-59.5-43.9173.9-170.6-158.414700111.6P50 A56 I57 K58P50-E54 WeakPolarHBondContact O-CB 3.32Å; P50-E54 PolarHBondContact O-N 3.34Å; E54-A56 VanDerWaalsContact C-N 3.29Å; E54-A56 PolarHBondContact O-N 3.47Å; E54-I57 PolarHBondContact O-N 3.44Å; E54-K58 PolarHBondContact O-N 2.93Å; E54-K58 WeakPolarHBondContact OE1-CE 3.3Å; E54-K58 IonicContact OE1-NZ 3.71Å; E54-K58 PolarHBondContact OE1-NZ 2.98Å
55A96.9Very high95.8Very high4 Ų463.3 Ų63.33%0.03332%0.321CS..Hα-helixtrans-58.2-40174.500000112.6R51 T53 K58 Y59 V118 T122R51-A55 VanDerWaalsContact O-CB 3.32Å; R51-A55 WeakPolarHBondContact O-CB 3.24Å; R51-A55 PolarHBondContact O-N 3.28Å; R51-A55 VanDerWaalsContact O-N 3.08Å; T53-A55 VanDerWaalsContact C-N 3.33Å; T53-A55 PolarHBondContact O-N 3.25Å; A55-K58 PolarHBondContact O-N 3.17Å; A55-Y59 PolarHBondContact O-N 2.75Å; A55-V118 HydrophobicContact CB-CG1 4.46Å; A55-V118 HydrophobicContact CB-CG2 4.49Å; A55-V118 WeakPolarHBondContact O-CG2 3.36Å; A55-T122 HydrophobicContact CB-CG2 4.07Å
56A97.1Very high95.9Very high7 Ų762 Ų626%0.05831%0.313CS..Hα-helixtrans-65-39177.100000112.1I41 L44 T45 S52 T53 E54 Y59 F60I41-A56 HydrophobicContact CG2-CB 4.44Å; L44-A56 HydrophobicContact CB-CB 4.11Å; L44-A56 HydrophobicContact CD1-CB 4.43Å; T45-A56 HydrophobicContact CG2-CB 3.59Å; S52-A56 PolarHBondContact O-N 2.95Å; T53-A56 WeakPolarHBondContact O-CB 2.96Å; T53-A56 PolarHBondContact O-N 3Å; T53-A56 VanDerWaalsContact O-N 3.13Å; E54-A56 VanDerWaalsContact C-N 3.29Å; E54-A56 PolarHBondContact O-N 3.47Å; A56-Y59 PolarHBondContact O-N 2.96Å; A56-F60 WeakPolarHBondContact O-CB 3.41Å; A56-F60 PolarHBondContact O-N 3.47Å
57I97.8Very high96.3Very high102 Ų10259.5 Ų59.552%0.52330%0.303SS..Hα-helixtrans-65-45.3176.3-63.9165.8000110.8T53 E54 Y59 F60 L61T53-I57 WeakPolarHBondContact O-CG1 3.4Å; T53-I57 PolarHBondContact O-N 3.23Å; T53-I57 VanDerWaalsContact O-N 3.09Å; E54-I57 PolarHBondContact O-N 3.44Å; I57-Y59 VanDerWaalsContact C-N 3.32Å; I57-Y59 PolarHBondContact O-N 2.87Å; I57-F60 PolarHBondContact O-N 2.97Å; I57-L61 HydrophobicContact CG2-CD1 4.04Å; I57-L61 HydrophobicContact CG2-CG 4.39Å; I57-L61 WeakPolarHBondContact O-CG 3.44Å; I57-L61 PolarHBondContact O-N 3.22Å
58K97.9Very high96.7Very high60 Ų6058.7 Ų58.726%0.26130%0.302SS..Hα-helixtrans-60.1-41.9177-70.8-178.7172.2178.50112.2E54 A55 T62 E117 V118E54-K58 PolarHBondContact O-N 2.93Å; E54-K58 WeakPolarHBondContact OE1-CE 3.3Å; E54-K58 IonicContact OE1-NZ 3.71Å; E54-K58 PolarHBondContact OE1-NZ 2.98Å; A55-K58 PolarHBondContact O-N 3.17Å; K58-T62 WeakPolarHBondContact O-CG2 3.35Å; K58-T62 PolarHBondContact O-N 3.37Å; K58-T62 PolarHBondContact O-OG1 3.39Å; K58-E117 HydrophobicContact CD-CB 4.4Å; K58-E117 WeakPolarHBondContact CD-OE2 3.43Å; K58-E117 WeakPolarHBondContact CE-OE2 3.23Å; K58-E117 IonicContact NZ-OE1 2.77Å; K58-E117 IonicContact NZ-OE2 2.93Å; K58-E117 PolarHBondContact NZ-OE2 3.32Å; K58-V118 HydrophobicContact CB-CG2 4.33Å
59Y97.9Very high97.1Very high2 Ų254.8 Ų54.81%0.00828%0.284CS..Hα-helixtrans-64.3-45.4174177.1-96.8000111.8M37 F40 I41 L44 A55 A56 I57 L61 T62 Q63 W114 L130 Q134M37-Y59 HydrophobicContact CG-CE1 4.33Å; F40-Y59 AromaticContact CD1-CE1 3.91Å; F40-Y59 HydrophobicContact CD1-CE1 3.91Å; F40-Y59 HydrophobicContact CD1-CE2 4.25Å; F40-Y59 AromaticContact CD1-CZ 3.7Å; I41-Y59 HydrophobicContact CG1-CD1 4.37Å; L44-Y59 HydrophobicContact CD1-CD1 3.7Å; L44-Y59 HydrophobicContact CD1-CD2 4.42Å; L44-Y59 HydrophobicContact CD1-CE1 4.4Å; L44-Y59 HydrophobicContact CD1-CG 3.71Å; A55-Y59 PolarHBondContact O-N 2.75Å; A56-Y59 PolarHBondContact O-N 2.96Å; I57-Y59 VanDerWaalsContact C-N 3.32Å; I57-Y59 PolarHBondContact O-N 2.87Å; Y59-L61 PolarHBondContact O-N 2.93Å; Y59-T62 PolarHBondContact O-N 3.31Å; Y59-T62 PolarHBondContact O-OG1 3.36Å; Y59-Q63 HydrophobicContact CD1-CG 4.27Å; Y59-Q63 HydrophobicContact CD2-CG 3.87Å; Y59-Q63 HydrophobicContact CE1-CG 4.02Å; Y59-Q63 HydrophobicContact CE2-CG 3.6Å; Y59-Q63 HydrophobicContact CG-CG 4.2Å; Y59-Q63 VanDerWaalsContact O-CB 3.29Å; Y59-Q63 WeakPolarHBondContact O-CB 3.45Å; Y59-Q63 WeakPolarHBondContact O-CG 3.43Å; Y59-Q63 PolarHBondContact O-N 2.7Å; Y59-W114 HydrophobicContact CD2-CE3 4.36Å; Y59-W114 HydrophobicContact CD2-CH2 4.22Å; Y59-W114 AromaticContact CD2-CZ3 3.78Å; Y59-W114 HydrophobicContact CD2-CZ3 3.78Å; Y59-W114 HydrophobicContact CE2-CH2 4.31Å; Y59-W114 HydrophobicContact CE2-CZ3 4.28Å; Y59-L130 HydrophobicContact CD2-CD1 3.98Å; Y59-L130 HydrophobicContact CE2-CD1 3.71Å; Y59-Q134 PolarHBondContact OH-OE1 3.21Å
60F98.3Very high97.2Very high85 Ų8551 Ų5137%0.37326%0.264SS..Hα-helixtrans-58.7-49.2179.6177-101.2000111.9M37 I41 A56 I57 T62 Q63 T64M37-F60 HydrophobicContact CE-CD2 3.24Å; M37-F60 HydrophobicContact CE-CE2 3.46Å; M37-F60 VanDerWaalsContact CE-CE2 3.46Å; M37-F60 HydrophobicContact CE-CG 4.15Å; M37-F60 HydrophobicContact CE-CZ 4.48Å; M37-F60 HydrophobicContact SD-CD2 4.04Å; M37-F60 HydrophobicContact SD-CE2 4.34Å; I41-F60 HydrophobicContact CD1-CD2 3.59Å; I41-F60 HydrophobicContact CD1-CE2 4.29Å; I41-F60 HydrophobicContact CD1-CG 4.5Å; A56-F60 WeakPolarHBondContact O-CB 3.41Å; A56-F60 PolarHBondContact O-N 3.47Å; I57-F60 PolarHBondContact O-N 2.97Å; F60-T62 PolarHBondContact O-N 2.93Å; F60-Q63 PolarHBondContact O-N 3.48Å; F60-T64 HydrophobicContact CD1-CG2 4.22Å; F60-T64 HydrophobicContact CD2-CG2 3.95Å; F60-T64 HydrophobicContact CE1-CG2 3.86Å; F60-T64 HydrophobicContact CE2-CG2 3.58Å; F60-T64 HydrophobicContact CG-CG2 4.27Å; F60-T64 HydrophobicContact CZ-CG2 3.53Å; F60-T64 WeakPolarHBondContact O-CB 3.28Å; F60-T64 WeakPolarHBondContact O-CG2 3.4Å; F60-T64 PolarHBondContact O-N 3.3Å; F60-T64 PolarHBondContact O-OG1 3.25Å
61L98.4Very high97.3Very high98 Ų9848.2 Ų48.251%0.51324%0.242SC..Hα-helixtrans-62.7-43.7-177.8-70173.9000112.6I57 Y59 T64 T65I57-L61 HydrophobicContact CG2-CD1 4.04Å; I57-L61 HydrophobicContact CG2-CG 4.39Å; I57-L61 WeakPolarHBondContact O-CG 3.44Å; I57-L61 PolarHBondContact O-N 3.22Å; Y59-L61 PolarHBondContact O-N 2.93Å; L61-T64 WeakPolarHBondContact CA-OG1 3.4Å; L61-T64 PolarHBondContact O-OG1 3.04Å; L61-T65 VanDerWaalsContact O-CG2 3.27Å; L61-T65 WeakPolarHBondContact O-CG2 3.46Å; L61-T65 PolarHBondContact O-N 3.26Å; L61-T65 PolarHBondContact O-OG1 3.3Å; L61-T65 VanDerWaalsContact O-OG1 3.1Å
62T97.6Very high97.4Very high37 Ų3747.2 Ų47.223%0.22724%0.244CC..Hα-helixtrans-71.7-33.7-179.957.60000112.5K58 Y59 F60 T65 A66 W114K58-T62 WeakPolarHBondContact O-CG2 3.35Å; K58-T62 PolarHBondContact O-N 3.37Å; K58-T62 PolarHBondContact O-OG1 3.39Å; Y59-T62 PolarHBondContact O-N 3.31Å; Y59-T62 PolarHBondContact O-OG1 3.36Å; F60-T62 PolarHBondContact O-N 2.93Å; T62-T65 PolarHBondContact O-OG1 2.83Å; T62-T65 VanDerWaalsContact O-OG1 3.05Å; T62-A66 WeakPolarHBondContact O-CB 3.41Å; T62-A66 PolarHBondContact O-N 3.32Å; T62-W114 HydrophobicContact CG2-CB 4.16Å; T62-W114 HydrophobicContact CG2-CG 4.09Å
63Q97.6Very high97.4Very high9 Ų947.1 Ų47.14%0.04224%0.244CC..Hα-helixtrans-81-32-177.3-64.8-68-17.500113.2M37 Y59 F60 S67 K105M37-Q63 HydrophobicContact CE-CB 4.41Å; M37-Q63 HydrophobicContact CG-CB 3.71Å; Y59-Q63 HydrophobicContact CD1-CG 4.27Å; Y59-Q63 HydrophobicContact CD2-CG 3.87Å; Y59-Q63 HydrophobicContact CE1-CG 4.02Å; Y59-Q63 HydrophobicContact CE2-CG 3.6Å; Y59-Q63 HydrophobicContact CG-CG 4.2Å; Y59-Q63 VanDerWaalsContact O-CB 3.29Å; Y59-Q63 WeakPolarHBondContact O-CB 3.45Å; Y59-Q63 WeakPolarHBondContact O-CG 3.43Å; Y59-Q63 PolarHBondContact O-N 2.7Å; F60-Q63 PolarHBondContact O-N 3.48Å; Q63-S67 PolarHBondContact O-N 3.17Å; Q63-S67 VanDerWaalsContact O-N 3.11Å; Q63-S67 PolarHBondContact O-OG 3.25Å; Q63-K105 PolarHBondContact NE2-O 3.46Å; Q63-K105 PolarHBondContact O-NZ 2.92Å; Q63-K105 VanDerWaalsContact OE1-CG 3.24Å
64T97.3Very high97.3Very high32 Ų3244.8 Ų44.820%0.19623%0.229CC..Hα-helixtrans-67.5-46.517244.30000111.6M37 F60 L61 A66 S67 M68M37-T64 HydrophobicContact CE-CG2 3.12Å; F60-T64 HydrophobicContact CD1-CG2 4.22Å; F60-T64 HydrophobicContact CD2-CG2 3.95Å; F60-T64 HydrophobicContact CE1-CG2 3.86Å; F60-T64 HydrophobicContact CE2-CG2 3.58Å; F60-T64 HydrophobicContact CG-CG2 4.27Å; F60-T64 HydrophobicContact CZ-CG2 3.53Å; F60-T64 WeakPolarHBondContact O-CB 3.28Å; F60-T64 WeakPolarHBondContact O-CG2 3.4Å; F60-T64 PolarHBondContact O-N 3.3Å; F60-T64 PolarHBondContact O-OG1 3.25Å; L61-T64 WeakPolarHBondContact CA-OG1 3.4Å; L61-T64 PolarHBondContact O-OG1 3.04Å; T64-A66 VanDerWaalsContact C-N 3.29Å; T64-A66 PolarHBondContact O-N 3.22Å; T64-S67 PolarHBondContact O-N 3.21Å; T64-S67 PolarHBondContact O-OG 2.65Å; T64-M68 WeakPolarHBondContact O-CG 3.49Å; T64-M68 PolarHBondContact O-N 3.06Å
65T98Very high97.2Very high71 Ų7144.2 Ų44.244%0.43623%0.229SC..Hα-helixtrans-62-42.6178.5550000110.7L61 T62 S67 M68 I69L61-T65 VanDerWaalsContact O-CG2 3.27Å; L61-T65 WeakPolarHBondContact O-CG2 3.46Å; L61-T65 PolarHBondContact O-N 3.26Å; L61-T65 PolarHBondContact O-OG1 3.3Å; L61-T65 VanDerWaalsContact O-OG1 3.1Å; T62-T65 PolarHBondContact O-OG1 2.83Å; T62-T65 VanDerWaalsContact O-OG1 3.05Å; T65-S67 VanDerWaalsContact C-N 3.34Å; T65-S67 PolarHBondContact O-N 3.44Å; T65-M68 PolarHBondContact O-N 2.93Å; T65-I69 VanDerWaalsContact O-CG1 3.26Å; T65-I69 WeakPolarHBondContact O-CG1 3.49Å; T65-I69 PolarHBondContact O-N 2.82Å
66A97.8Very high97.1Very high0 Ų046.4 Ų46.40%024%0.237CC..Hα-helixtrans-61-39.517600000113.1T62 T64 L70 A101 M104 K105T62-A66 WeakPolarHBondContact O-CB 3.41Å; T62-A66 PolarHBondContact O-N 3.32Å; T64-A66 VanDerWaalsContact C-N 3.29Å; T64-A66 PolarHBondContact O-N 3.22Å; A66-L70 PolarHBondContact O-N 3.43Å; A66-A101 WeakPolarHBondContact O-CB 3.43Å; A66-M104 HydrophobicContact CB-CB 3.78Å; A66-M104 HydrophobicContact CB-SD 4.28Å; A66-K105 HydrophobicContact CB-CD 4.47Å; A66-K105 HydrophobicContact CB-CG 3.62Å
67S97Very high96.9Very high1 Ų146.3 Ų46.31%0.00724%0.236CC..Hα-helixtrans-73.7-33.9179.362.50000113.1W30 E34 Q63 T64 T65 L70 L71W30-S67 PolarHBondContact NE1-O 3.36Å; W30-S67 VanDerWaalsContact NE1-O 3.16Å; E34-S67 WeakPolarHBondContact OE1-CB 3.32Å; E34-S67 PolarHBondContact OE1-OG 2.86Å; Q63-S67 PolarHBondContact O-N 3.17Å; Q63-S67 VanDerWaalsContact O-N 3.11Å; Q63-S67 PolarHBondContact O-OG 3.25Å; T64-S67 PolarHBondContact O-N 3.21Å; T64-S67 PolarHBondContact O-OG 2.65Å; T65-S67 VanDerWaalsContact C-N 3.34Å; T65-S67 PolarHBondContact O-N 3.44Å; S67-L70 WeakPolarHBondContact O-CB 3.22Å; S67-L70 PolarHBondContact O-N 2.89Å; S67-L71 PolarHBondContact O-N 3.02Å
68M97.8Very high96.7Very high121 Ų12143.4 Ų43.460%0.59622%0.221SC*.Hα-helixtrans-67.6-38.6172.9-64.9-59.4-80.500111.9T64 T65 L70 L71 M72T64-M68 WeakPolarHBondContact O-CG 3.49Å; T64-M68 PolarHBondContact O-N 3.06Å; T65-M68 PolarHBondContact O-N 2.93Å; M68-L70 VanDerWaalsContact C-N 3.32Å; M68-L70 PolarHBondContact O-N 3.18Å; M68-L71 PolarHBondContact O-N 3.36Å; M68-M72 PolarHBondContact O-N 3.11Å
69I97.8Very high96.4Very high52 Ų5246.8 Ų46.827%0.26724%0.24SC..Hα-helixtrans-62.9-40.6172.9-66.5164.3000110.7T65 M72 A73 M97 A101 M104T65-I69 VanDerWaalsContact O-CG1 3.26Å; T65-I69 WeakPolarHBondContact O-CG1 3.49Å; T65-I69 PolarHBondContact O-N 2.82Å; I69-M72 PolarHBondContact O-N 3.4Å; I69-A73 PolarHBondContact O-N 2.82Å; I69-M97 HydrophobicContact CG2-CB 4.29Å; I69-A101 HydrophobicContact CB-CB 4.29Å; I69-A101 HydrophobicContact CG2-CB 4.06Å; I69-M104 HydrophobicContact CD1-CE 3.79Å; I69-M104 HydrophobicContact CD1-SD 4Å
70L96.9Very high96.2Very high0 Ų051.2 Ų51.20%026%0.263CS..Hα-helixtrans-60.9-45.8175.6-174.7121.5000111.5W30 L33 A66 S67 M68 M72 A73 I74 A101 M102W30-L70 HydrophobicContact CB-CD2 3.62Å; W30-L70 VanDerWaalsContact CD1-CD2 3.49Å; W30-L70 HydrophobicContact CG-CD2 3.95Å; L33-L70 HydrophobicContact CD1-CD1 4.17Å; L33-L70 HydrophobicContact CD1-CD2 4.37Å; A66-L70 PolarHBondContact O-N 3.43Å; S67-L70 WeakPolarHBondContact O-CB 3.22Å; S67-L70 PolarHBondContact O-N 2.89Å; M68-L70 VanDerWaalsContact C-N 3.32Å; M68-L70 PolarHBondContact O-N 3.18Å; L70-M72 VanDerWaalsContact C-N 3.33Å; L70-M72 PolarHBondContact O-N 2.89Å; L70-A73 WeakPolarHBondContact O-CB 3.38Å; L70-A73 PolarHBondContact O-N 3.41Å; L70-A73 VanDerWaalsContact O-N 3.13Å; L70-I74 HydrophobicContact CD2-CD1 3.48Å; L70-I74 VanDerWaalsContact CD2-CD1 3.48Å; L70-I74 HydrophobicContact CD2-CG1 4.49Å; L70-I74 HydrophobicContact CG-CD1 4.05Å; L70-I74 VanDerWaalsContact O-CG1 3.3Å; L70-I74 WeakPolarHBondContact O-CG1 3.43Å; L70-I74 PolarHBondContact O-N 2.96Å; L70-A101 HydrophobicContact CB-CB 4.18Å; L70-M102 HydrophobicContact CD1-CE 3.17Å
71L96.7Very high95.7Very high49 Ų4949.6 Ų49.626%0.25726%0.262SS..Hα-helixtrans-62.4-41177.9-171.1139.6000111.7W30 S67 M68 A73 I74 L75W30-L71 HydrophobicContact CD2-CD1 4.07Å; W30-L71 HydrophobicContact CE3-CD1 4.49Å; W30-L71 HydrophobicContact CH2-CD1 4.36Å; W30-L71 HydrophobicContact CZ2-CD1 3.91Å; S67-L71 PolarHBondContact O-N 3.02Å; M68-L71 PolarHBondContact O-N 3.36Å; L71-A73 VanDerWaalsContact C-N 3.32Å; L71-A73 PolarHBondContact O-N 3.27Å; L71-I74 PolarHBondContact O-N 3.47Å; L71-L75 HydrophobicContact CD2-CD1 3.6Å; L71-L75 HydrophobicContact CD2-CG 4.24Å; L71-L75 WeakPolarHBondContact O-CG 3.32Å; L71-L75 PolarHBondContact O-N 3.15Å
72M97.1Very high95.3Very high105 Ų10547.4 Ų47.452%0.51726%0.263SS..Hα-helixtrans-59-43.5172.5-177.660.4-174.700111.7M68 I69 L70 I74 L75 F76 M97M68-M72 PolarHBondContact O-N 3.11Å; I69-M72 PolarHBondContact O-N 3.4Å; L70-M72 VanDerWaalsContact C-N 3.33Å; L70-M72 PolarHBondContact O-N 2.89Å; M72-I74 PolarHBondContact O-N 3.31Å; M72-L75 PolarHBondContact O-N 3.29Å; M72-F76 VanDerWaalsContact O-CB 3.23Å; M72-F76 WeakPolarHBondContact O-CB 3.46Å; M72-F76 PolarHBondContact O-N 3.45Å; M72-M97 HydrophobicContact CG-SD 4.29Å
73A95.4Very high94.8Very high0 Ų048.9 Ų48.90%027%0.268CS..Hα-helixtrans-63.5-40.4178.600000112.7I69 L70 L71 N77 M97 I98I69-A73 PolarHBondContact O-N 2.82Å; L70-A73 WeakPolarHBondContact O-CB 3.38Å; L70-A73 PolarHBondContact O-N 3.41Å; L70-A73 VanDerWaalsContact O-N 3.13Å; L71-A73 VanDerWaalsContact C-N 3.32Å; L71-A73 PolarHBondContact O-N 3.27Å; A73-N77 WeakPolarHBondContact O-CB 3.34Å; A73-N77 PolarHBondContact O-N 3.36Å; A73-M97 HydrophobicContact CB-CB 3.63Å; A73-M97 HydrophobicContact CB-CE 4.32Å; A73-I98 HydrophobicContact CB-CD1 4.4Å; A73-I98 HydrophobicContact CB-CG1 3.68Å
74I94.4Very high94.4Very high9 Ų952.6 Ų52.65%0.04628%0.282CS..Hα-helixtrans-64.5-50.4177.5-66.3164.4000110.7W26 W30 L70 L71 M72 F76 N77 N78 W84W26-I74 HydrophobicContact CB-CB 4.36Å; W26-I74 HydrophobicContact CB-CD1 3.91Å; W26-I74 HydrophobicContact CB-CG1 3.86Å; W26-I74 HydrophobicContact CB-CG2 3.58Å; W26-I74 HydrophobicContact CD2-CD1 4.44Å; W26-I74 HydrophobicContact CD2-CG1 3.95Å; W26-I74 HydrophobicContact CE3-CD1 3.89Å; W26-I74 HydrophobicContact CE3-CG1 3.66Å; W26-I74 HydrophobicContact CG-CG1 4.08Å; W26-I74 HydrophobicContact CG-CG2 4.23Å; W26-I74 WeakPolarHBondContact O-CD1 3.05Å; W30-I74 HydrophobicContact CB-CD1 4.27Å; L70-I74 HydrophobicContact CD2-CD1 3.48Å; L70-I74 VanDerWaalsContact CD2-CD1 3.48Å; L70-I74 HydrophobicContact CD2-CG1 4.49Å; L70-I74 HydrophobicContact CG-CD1 4.05Å; L70-I74 VanDerWaalsContact O-CG1 3.3Å; L70-I74 WeakPolarHBondContact O-CG1 3.43Å; L70-I74 PolarHBondContact O-N 2.96Å; L71-I74 PolarHBondContact O-N 3.47Å; M72-I74 PolarHBondContact O-N 3.31Å; I74-F76 VanDerWaalsContact C-N 3.32Å; I74-F76 PolarHBondContact O-N 3.07Å; I74-N77 PolarHBondContact O-N 3.12Å; I74-N78 PolarHBondContact O-N 3.31Å; I74-W84 HydrophobicContact CG2-CE3 4.28Å; I74-W84 HydrophobicContact CG2-CZ3 3.96Å
75L95.5Very high94.2Very high84 Ų8454 Ų5444%0.4429%0.29SS..Hα-helixtrans-63.7-39.9-179.6-68.4179.8000111.6L71 M72 N78 M79 W84L71-L75 HydrophobicContact CD2-CD1 3.6Å; L71-L75 HydrophobicContact CD2-CG 4.24Å; L71-L75 WeakPolarHBondContact O-CG 3.32Å; L71-L75 PolarHBondContact O-N 3.15Å; M72-L75 PolarHBondContact O-N 3.29Å; L75-N78 PolarHBondContact O-N 3.43Å; L75-M79 WeakPolarHBondContact O-CB 3.46Å; L75-M79 PolarHBondContact O-N 3.42Å; L75-W84 HydrophobicContact CD2-CH2 4.14Å
76F94.4Very high93.6Very high50 Ų5051 Ų5122%0.21927%0.271CS..Hα-helixtrans-65.4-39.2175.7-172.3-101.8000112.1M72 I74 N78 M79 L80 M97M72-F76 VanDerWaalsContact O-CB 3.23Å; M72-F76 WeakPolarHBondContact O-CB 3.46Å; M72-F76 PolarHBondContact O-N 3.45Å; I74-F76 VanDerWaalsContact C-N 3.32Å; I74-F76 PolarHBondContact O-N 3.07Å; F76-N78 VanDerWaalsContact C-N 3.35Å; F76-M79 HydrophobicContact CD2-CE 3.6Å; F76-M79 HydrophobicContact CE2-CE 3.48Å; F76-M79 VanDerWaalsContact CE2-CE 3.48Å; F76-M79 HydrophobicContact CZ-CE 4.4Å; F76-M79 PolarHBondContact O-N 3.04Å; F76-L80 HydrophobicContact CD1-CD1 3.96Å; F76-L80 HydrophobicContact CE1-CD1 3.35Å; F76-L80 HydrophobicContact CE1-CG 4.4Å; F76-L80 HydrophobicContact CE2-CD1 4.3Å; F76-L80 HydrophobicContact CZ-CD1 3.57Å; F76-L80 HydrophobicContact CZ-CG 4.4Å; F76-L80 PolarHBondContact O-N 3.17Å; F76-M97 HydrophobicContact CB-CE 4.04Å; F76-M97 HydrophobicContact CD1-CE 3.78Å; F76-M97 HydrophobicContact CG-CE 4.03Å
77N93.6Very high92.3Very high5 Ų556.9 Ų56.93%0.02731%0.307CS..Hα-helixtrans-62.5-43.4174.1-169.448.4000111.3A73 I74 L80 S81 N91 S94A73-N77 WeakPolarHBondContact O-CB 3.34Å; A73-N77 PolarHBondContact O-N 3.36Å; I74-N77 PolarHBondContact O-N 3.12Å; N77-L80 PolarHBondContact O-N 2.88Å; N77-S81 PolarHBondContact O-N 3.27Å; N77-S81 PolarHBondContact O-OG 3.28Å; N77-N91 PolarHBondContact OD1-N 3.46Å; N77-S94 PolarHBondContact OD1-OG 3.18Å
78N92.8Very high90.7Very high41 Ų4159.8 Ų59.822%0.21932%0.323CS..Hα-helixtrans-65.3-39.9176.7-178.541.8000112.2I74 L75 F76 L80 G82 W84I74-N78 PolarHBondContact O-N 3.31Å; L75-N78 PolarHBondContact O-N 3.43Å; F76-N78 VanDerWaalsContact C-N 3.35Å; N78-L80 PolarHBondContact O-N 2.92Å; N78-G82 VanDerWaalsContact O-CA 3.26Å; N78-G82 WeakPolarHBondContact O-CA 3.47Å; N78-G82 PolarHBondContact O-N 3.43Å; N78-G82 VanDerWaalsContact OD1-C 3.24Å; N78-G82 VanDerWaalsContact OD1-CA 3.32Å; N78-G82 WeakPolarHBondContact OD1-CA 3.28Å; N78-W84 HydrophobicContact CB-CZ2 4.31Å; N78-W84 WeakPolarHBondContact ND2-CZ2 3.39Å; N78-W84 PolarHBondContact OD1-NE1 3.07Å
79M93.1Very high89.3Confident132 Ų13259.5 Ų59.565%0.6533%0.328SS*.Hα-helixtrans-57.6-35.4176.9-174.2-17372.900112.4L75 F76L75-M79 WeakPolarHBondContact O-CB 3.46Å; L75-M79 PolarHBondContact O-N 3.42Å; F76-M79 HydrophobicContact CD2-CE 3.6Å; F76-M79 HydrophobicContact CE2-CE 3.48Å; F76-M79 VanDerWaalsContact CE2-CE 3.48Å; F76-M79 HydrophobicContact CZ-CE 4.4Å; F76-M79 PolarHBondContact O-N 3.04Å
80L91.9Very high88.2Confident94 Ų9457.4 Ų57.449%0.49232%0.318SS..Hα-helixtrans-92.9-32.4-176-64.8177.5000114.2F76 N77 N78 N91F76-L80 HydrophobicContact CD1-CD1 3.96Å; F76-L80 HydrophobicContact CE1-CD1 3.35Å; F76-L80 HydrophobicContact CE1-CG 4.4Å; F76-L80 HydrophobicContact CE2-CD1 4.3Å; F76-L80 HydrophobicContact CZ-CD1 3.57Å; F76-L80 HydrophobicContact CZ-CG 4.4Å; F76-L80 PolarHBondContact O-N 3.17Å; N77-L80 PolarHBondContact O-N 2.88Å; N78-L80 PolarHBondContact O-N 2.92Å; L80-N91 HydrophobicContact CD1-CB 4.41Å; L80-N91 WeakPolarHBondContact CD1-ND2 3.44Å
81S89Confident87.7Confident51 Ų5160.2 Ų60.236%0.35733%0.332SS..Hα-helixtrans-116.2-17.7-172.866.70000114.4N77 Q83N77-S81 PolarHBondContact O-N 3.27Å; N77-S81 PolarHBondContact O-OG 3.28Å; S81-Q83 PolarHBondContact O-N 3.39Å; S81-Q83 PolarHBondContact OG-N 3Å
82G89.4Confident87.3Confident52 Ų5263.8 Ų63.854%0.53635%0.348SS..  trans69.87.9-172.400000114.7N78N78-G82 VanDerWaalsContact O-CA 3.26Å; N78-G82 WeakPolarHBondContact O-CA 3.47Å; N78-G82 PolarHBondContact O-N 3.43Å; N78-G82 VanDerWaalsContact OD1-C 3.24Å; N78-G82 VanDerWaalsContact OD1-CA 3.32Å; N78-G82 WeakPolarHBondContact OD1-CA 3.28Å
83Q87.8Confident87.1Confident68 Ų6866.1 Ų66.132%0.31835%0.352SS..  trans-101.3135.4-171.7-63.2179.1-2.900112.5S81 N88S81-Q83 PolarHBondContact O-N 3.39Å; S81-Q83 PolarHBondContact OG-N 3Å; Q83-N88 PolarHBondContact NE2-ND2 3.01Å; Q83-N88 PolarHBondContact OE1-ND2 2.99Å
84W89.4Confident87Confident88 Ų8866.1 Ų66.133%0.33335%0.352SS..  trans-110.6-8.7177.7-70.895000114.3H25 W26 I74 L75 N78H25-W84 WeakPolarHBondContact CA-O 3.36Å; H25-W84 AromaticContact CE1-CD2 3.69Å; H25-W84 AromaticContact CE1-CE3 3.21Å; H25-W84 AromaticContact CE1-CZ3 3.89Å; H25-W84 VanDerWaalsContact NE2-CB 3.33Å; H25-W84 WeakPolarHBondContact NE2-CB 3.43Å; H25-W84 AromaticContact NE2-CD2 3.6Å; H25-W84 AromaticContact NE2-CE3 3.63Å; H25-W84 AromaticContact NE2-CG 3.52Å; W26-W84 VanDerWaalsContact CD1-O 3.29Å; W26-W84 PolarHBondContact N-O 3.31Å; I74-W84 HydrophobicContact CG2-CE3 4.28Å; I74-W84 HydrophobicContact CG2-CZ3 3.96Å; L75-W84 HydrophobicContact CD2-CH2 4.14Å; N78-W84 HydrophobicContact CB-CZ2 4.31Å; N78-W84 WeakPolarHBondContact ND2-CZ2 3.39Å; N78-W84 PolarHBondContact OD1-NE1 3.07Å
85T92.3Very high86.9Confident61 Ų6165.9 Ų65.937%0.37435%0.351SS..BIsolated β-bridgetrans-82.2140.6-178.449.70000111.8S24 W26 T87S24-T85 WeakPolarHBondContact O-CA 3.3Å; W26-T85 PolarHBondContact NE1-O 3.44Å; T85-T87 VanDerWaalsContact C-N 3.33Å; T85-T87 PolarHBondContact O-N 2.95Å
86M84.6Confident86.9Confident9 Ų964 Ų644%0.04434%0.341CS..THydrogen-bonded Turntrans-64.2-32.1179.3-73.3-63.8-63.500114S24 W26 T29 N88 I141 Q144 I145S24-M86 WeakPolarHBondContact O-CG 3.38Å; S24-M86 PolarHBondContact O-N 3.17Å; W26-M86 HydrophobicContact CD2-CE 4.3Å; W26-M86 HydrophobicContact CD2-SD 3.14Å; W26-M86 HydrophobicContact CE3-CE 4.11Å; W26-M86 HydrophobicContact CE3-SD 3.32Å; W26-M86 HydrophobicContact CG-SD 3.73Å; W26-M86 HydrophobicContact CH2-CE 3.46Å; W26-M86 VanDerWaalsContact CH2-CE 3.46Å; W26-M86 HydrophobicContact CH2-SD 3.65Å; W26-M86 HydrophobicContact CZ2-CE 3.66Å; W26-M86 HydrophobicContact CZ2-SD 3.48Å; W26-M86 WeakPolarHBondContact CZ2-SD 3.3Å; W26-M86 HydrophobicContact CZ3-CE 3.7Å; W26-M86 HydrophobicContact CZ3-SD 3.58Å; W26-M86 VanDerWaalsContact CZ3-SD 3.58Å; T29-M86 HydrophobicContact CG2-CE 4.42Å; T29-M86 HydrophobicContact CG2-CG 4.16Å; T29-M86 HydrophobicContact CG2-SD 3.84Å; M86-N88 PolarHBondContact O-N 3.42Å; M86-I141 HydrophobicContact CE-CG2 3.96Å; M86-Q144 HydrophobicContact CE-CB 4.2Å; M86-Q144 VanDerWaalsContact CE-OE1 3.29Å; M86-I145 HydrophobicContact CE-CG2 3.83Å
87T70.8Confident87Confident122 Ų12263.9 Ų63.975%0.74834%0.342SS*.THydrogen-bonded Turntrans-71.7-15.9-167.252.40000114.5T85T85-T87 VanDerWaalsContact C-N 3.33Å; T85-T87 PolarHBondContact O-N 2.95Å
88N63Low87.1Confident62 Ų6263.7 Ų63.733%0.33234%0.341SS..SBendtrans-95.6150.5-173.3-64.7-3.6000111.1Q83 M86 T90Q83-N88 PolarHBondContact NE2-ND2 3.01Å; Q83-N88 PolarHBondContact OE1-ND2 2.99Å; M86-N88 PolarHBondContact O-N 3.42Å; N88-T90 PolarHBondContact O-N 3.08Å
89T69.1Low87.3Confident115 Ų11561.9 Ų61.971%0.70633%0.331SS*.  trans-53.9112.5-17952.30000110.6
90T73.9Confident87.5Confident9 Ų958.5 Ų58.56%0.05532%0.315CS..  trans-64140.1169.853.90000109.3W26 N88 S94 S95 I98 S148W26-T90 HydrophobicContact CH2-CG2 4.5Å; W26-T90 HydrophobicContact CZ2-CG2 3.73Å; N88-T90 PolarHBondContact O-N 3.08Å; T90-S94 WeakPolarHBondContact CB-OG 3.28Å; T90-S95 WeakPolarHBondContact OG1-CB 3.04Å; T90-I98 HydrophobicContact CG2-CD1 4.03Å; T90-S148 PolarHBondContact OG1-OG 3.07Å
91N86.8Confident87.8Confident58 Ų5854 Ų5431%0.3129%0.291SS..  trans-56.1148.9170.9-175.319.9000111N77 L80 Y93 S94 S95N77-N91 PolarHBondContact OD1-N 3.46Å; L80-N91 HydrophobicContact CD1-CB 4.41Å; L80-N91 WeakPolarHBondContact CD1-ND2 3.44Å; N91-Y93 VanDerWaalsContact C-N 3.29Å; N91-Y93 PolarHBondContact O-N 3.16Å; N91-S94 PolarHBondContact N-OG 3.28Å; N91-S94 WeakPolarHBondContact O-CA 3.25Å; N91-S94 PolarHBondContact O-N 3.45Å; N91-S94 PolarHBondContact O-OG 3.49Å; N91-S95 PolarHBondContact O-N 3.28Å
92Q88.3Confident88.2Confident125 Ų12551.7 Ų51.758%0.58427%0.274SS*.Hα-helixtrans-53.4-40.3-175.7-172.3172.6-0.300113.6S95 L96Q92-S95 PolarHBondContact O-OG 3.02Å; Q92-L96 VanDerWaalsContact O-CG 3.3Å; Q92-L96 WeakPolarHBondContact O-CG 3.42Å; Q92-L96 PolarHBondContact O-N 3.42Å
93Y92.8Very high88.6Confident154 Ų15449.3 Ų49.360%0.60425%0.25SC*.Hα-helixtrans-71.5-36.1176.1-63.2-66.2000112.7N91 L96 M97N91-Y93 VanDerWaalsContact C-N 3.29Å; N91-Y93 PolarHBondContact O-N 3.16Å; Y93-L96 HydrophobicContact CD1-CD1 4.46Å; Y93-L96 PolarHBondContact O-N 3.19Å; Y93-M97 PolarHBondContact O-N 3.43Å; Y93-M97 VanDerWaalsContact O-N 3.1Å
94S93.1Very high89Confident0 Ų047.4 Ų47.40%024%0.241CC..Hα-helixtrans-68.3-38.2175.763.90000111.9N77 T90 N91 L96 M97 I98N77-S94 PolarHBondContact OD1-OG 3.18Å; T90-S94 WeakPolarHBondContact CB-OG 3.28Å; N91-S94 PolarHBondContact N-OG 3.28Å; N91-S94 WeakPolarHBondContact O-CA 3.25Å; N91-S94 PolarHBondContact O-N 3.45Å; N91-S94 PolarHBondContact O-OG 3.49Å; S94-L96 VanDerWaalsContact C-N 3.33Å; S94-L96 PolarHBondContact O-N 2.98Å; S94-M97 PolarHBondContact O-N 3.1Å; S94-I98 WeakPolarHBondContact O-CD1 3.19Å; S94-I98 VanDerWaalsContact O-CG1 3.25Å; S94-I98 WeakPolarHBondContact O-CG1 3.24Å; S94-I98 PolarHBondContact O-N 3.3Å
95S93Very high89.4Confident3 Ų343.6 Ų43.62%0.02123%0.227CC..Hα-helixtrans-63.8-39.1175.474.80000111.7T90 N91 Q92 I98 M99T90-S95 WeakPolarHBondContact OG1-CB 3.04Å; N91-S95 PolarHBondContact O-N 3.28Å; Q92-S95 PolarHBondContact O-OG 3.02Å; S95-I98 PolarHBondContact O-N 3.04Å; S95-M99 WeakPolarHBondContact O-CB 2.97Å; S95-M99 WeakPolarHBondContact O-CG 3.32Å; S95-M99 PolarHBondContact O-N 3.47Å
96L95.9Very high89.6Confident44 Ų4440.8 Ų40.823%0.2321%0.21CC..Hα-helixtrans-59.8-48.4172.4-70.4165.5000112.3Q92 Y93 S94 I98 M99 M100 N150 L153Q92-L96 VanDerWaalsContact O-CG 3.3Å; Q92-L96 WeakPolarHBondContact O-CG 3.42Å; Q92-L96 PolarHBondContact O-N 3.42Å; Y93-L96 HydrophobicContact CD1-CD1 4.46Å; Y93-L96 PolarHBondContact O-N 3.19Å; S94-L96 VanDerWaalsContact C-N 3.33Å; S94-L96 PolarHBondContact O-N 2.98Å; L96-I98 PolarHBondContact O-N 3.47Å; L96-M99 HydrophobicContact CD2-CE 3.77Å; L96-M99 HydrophobicContact CG-CE 4.27Å; L96-M99 PolarHBondContact O-N 3.35Å; L96-M100 WeakPolarHBondContact O-CG 3.48Å; L96-M100 PolarHBondContact O-N 3.26Å; L96-N150 HydrophobicContact CD2-CB 4.41Å; L96-L153 HydrophobicContact CD2-CB 4.33Å; L96-L153 HydrophobicContact CD2-CD1 3.76Å; L96-L153 HydrophobicContact CD2-CG 4.43Å
97M96.5Very high90.2Very high48 Ų4840.4 Ų40.424%0.23621%0.208CC..Hα-helixtrans-63.5-40.7177.9-70.4-174.7-77.200112.1I69 M72 A73 F76 Y93 S94 M100 A101I69-M97 HydrophobicContact CG2-CB 4.29Å; M72-M97 HydrophobicContact CG-SD 4.29Å; A73-M97 HydrophobicContact CB-CB 3.63Å; A73-M97 HydrophobicContact CB-CE 4.32Å; F76-M97 HydrophobicContact CB-CE 4.04Å; F76-M97 HydrophobicContact CD1-CE 3.78Å; F76-M97 HydrophobicContact CG-CE 4.03Å; Y93-M97 PolarHBondContact O-N 3.43Å; Y93-M97 VanDerWaalsContact O-N 3.1Å; S94-M97 PolarHBondContact O-N 3.1Å; M97-M100 PolarHBondContact O-N 3.12Å; M97-A101 WeakPolarHBondContact O-CB 3.46Å; M97-A101 PolarHBondContact O-N 2.86Å
98I95.8Very high91.5Very high1 Ų134.8 Ų34.81%0.00517%0.173CC..Hα-helixtrans-63.9-43.6175.8-65.1158.8000110.6W26 A73 T90 S94 S95 L96 M100 A101 M102 I145W26-I98 HydrophobicContact CH2-CD1 3.55Å; W26-I98 HydrophobicContact CH2-CG1 4.42Å; W26-I98 HydrophobicContact CZ2-CD1 4.07Å; W26-I98 HydrophobicContact CZ3-CD1 4.05Å; A73-I98 HydrophobicContact CB-CD1 4.4Å; A73-I98 HydrophobicContact CB-CG1 3.68Å; T90-I98 HydrophobicContact CG2-CD1 4.03Å; S94-I98 WeakPolarHBondContact O-CD1 3.19Å; S94-I98 VanDerWaalsContact O-CG1 3.25Å; S94-I98 WeakPolarHBondContact O-CG1 3.24Å; S94-I98 PolarHBondContact O-N 3.3Å; S95-I98 PolarHBondContact O-N 3.04Å; L96-I98 PolarHBondContact O-N 3.47Å; I98-M100 VanDerWaalsContact C-N 3.32Å; I98-M100 PolarHBondContact O-N 3.1Å; I98-A101 PolarHBondContact O-N 3.35Å; I98-M102 HydrophobicContact CG2-CE 4.28Å; I98-M102 HydrophobicContact CG2-CG 4.17Å; I98-M102 WeakPolarHBondContact O-CB 3.09Å; I98-M102 WeakPolarHBondContact O-CG 3.38Å; I98-M102 PolarHBondContact O-N 3Å; I98-I145 HydrophobicContact CB-CD1 4.35Å; I98-I145 HydrophobicContact CG2-CD1 3.39Å
99M96.1Very high93.1Very high3 Ų332 Ų322%0.01516%0.159CC..Hα-helixtrans-58.4-43.6175.3-78.8-173.8-71.800111.8S95 L96 M102 A103 M142 L149 N150 L153 L154S95-M99 WeakPolarHBondContact O-CB 2.97Å; S95-M99 WeakPolarHBondContact O-CG 3.32Å; S95-M99 PolarHBondContact O-N 3.47Å; L96-M99 HydrophobicContact CD2-CE 3.77Å; L96-M99 HydrophobicContact CG-CE 4.27Å; L96-M99 PolarHBondContact O-N 3.35Å; M99-M102 PolarHBondContact O-N 2.91Å; M99-A103 WeakPolarHBondContact O-CB 3.38Å; M99-A103 PolarHBondContact O-N 3.07Å; M99-M142 HydrophobicContact CG-CE 4.37Å; M99-L149 HydrophobicContact CG-CD2 3.46Å; M99-L149 VanDerWaalsContact CG-CD2 3.46Å; M99-L149 HydrophobicContact SD-CB 4.27Å; M99-L149 HydrophobicContact SD-CD2 3.74Å; M99-N150 HydrophobicContact CE-CB 3.67Å; M99-L153 HydrophobicContact CB-CD2 3.92Å; M99-L153 HydrophobicContact CE-CB 4.47Å; M99-L153 HydrophobicContact CE-CD2 3.92Å; M99-L153 HydrophobicContact CG-CD2 4.49Å; M99-L153 HydrophobicContact SD-CD2 3.81Å; M99-L154 HydrophobicContact SD-CB 4.32Å
100M97.6Very high94.4Very high62 Ų6229.7 Ų29.731%0.30515%0.146SC..Hα-helixtrans-65.8-42.7177.5-66.2-59.1-77.900112L96 M97 I98 A103 M104 F111L96-M100 WeakPolarHBondContact O-CG 3.48Å; L96-M100 PolarHBondContact O-N 3.26Å; M97-M100 PolarHBondContact O-N 3.12Å; I98-M100 VanDerWaalsContact C-N 3.32Å; I98-M100 PolarHBondContact O-N 3.1Å; M100-A103 PolarHBondContact O-N 3.29Å; M100-M104 WeakPolarHBondContact O-CG 3.42Å; M100-M104 PolarHBondContact O-N 3.46Å; M100-F111 HydrophobicContact CE-CE2 3.49Å; M100-F111 VanDerWaalsContact CE-CE2 3.49Å; M100-F111 HydrophobicContact CE-CZ 3.4Å; M100-F111 VanDerWaalsContact CE-CZ 3.4Å; M100-F111 HydrophobicContact SD-CE2 4.23Å
101A97.8Very high95.5Very high0 Ų031.8 Ų31.80%015%0.154CC..Hα-helixtrans-60.1-48.917500000111.7A66 I69 L70 M97 I98 M104 K105A66-A101 WeakPolarHBondContact O-CB 3.43Å; I69-A101 HydrophobicContact CB-CB 4.29Å; I69-A101 HydrophobicContact CG2-CB 4.06Å; L70-A101 HydrophobicContact CB-CB 4.18Å; M97-A101 WeakPolarHBondContact O-CB 3.46Å; M97-A101 PolarHBondContact O-N 2.86Å; I98-A101 PolarHBondContact O-N 3.35Å; A101-M104 PolarHBondContact O-N 3Å; A101-K105 WeakPolarHBondContact O-CG 3.29Å; A101-K105 PolarHBondContact O-N 3.3Å
102M97.6Very high96.1Very high1 Ų130 Ų301%0.00514%0.144CC..Hα-helixtrans-66.6-38.6178.9-66.2-56.2164.600112.3L33 L70 I98 M99 M104 K105 L106 P138 I141 M142L33-M102 HydrophobicContact CD1-CE 4.22Å; L70-M102 HydrophobicContact CD1-CE 3.17Å; I98-M102 HydrophobicContact CG2-CE 4.28Å; I98-M102 HydrophobicContact CG2-CG 4.17Å; I98-M102 WeakPolarHBondContact O-CB 3.09Å; I98-M102 WeakPolarHBondContact O-CG 3.38Å; I98-M102 PolarHBondContact O-N 3Å; M99-M102 PolarHBondContact O-N 2.91Å; M102-M104 VanDerWaalsContact C-N 3.3Å; M102-M104 PolarHBondContact O-N 3.37Å; M102-K105 PolarHBondContact O-N 3.18Å; M102-L106 VanDerWaalsContact O-CB 3.28Å; M102-L106 WeakPolarHBondContact O-CB 3.19Å; M102-L106 WeakPolarHBondContact O-CG 3.37Å; M102-L106 PolarHBondContact O-N 2.93Å; M102-P138 HydrophobicContact SD-CB 3.81Å; M102-I141 HydrophobicContact CE-CB 3.81Å; M102-I141 HydrophobicContact CE-CD1 3.59Å; M102-I141 HydrophobicContact CE-CG1 4.3Å; M102-I141 HydrophobicContact CE-CG2 3.48Å; M102-I141 VanDerWaalsContact CE-CG2 3.48Å; M102-I141 HydrophobicContact SD-CB 4.47Å; M102-I141 HydrophobicContact SD-CD1 4.46Å; M102-M142 HydrophobicContact CB-CG 3.9Å; M102-M142 HydrophobicContact CB-SD 3.65Å; M102-M142 HydrophobicContact CG-CG 3.92Å; M102-M142 HydrophobicContact CG-SD 3.68Å
103A97.6Very high96.5Very high2 Ų230.8 Ų30.82%0.01715%0.146CC..Hα-helixtrans-59.7-40.7175.100000111.8M99 M100 G107 M108 F111 L157M99-A103 WeakPolarHBondContact O-CB 3.38Å; M99-A103 PolarHBondContact O-N 3.07Å; M100-A103 PolarHBondContact O-N 3.29Å; A103-G107 PolarHBondContact O-N 3.19Å; A103-M108 HydrophobicContact CB-CB 4.21Å; A103-M108 HydrophobicContact CB-SD 4.26Å; A103-M108 PolarHBondContact O-N 3.08Å; A103-F111 HydrophobicContact CB-CD2 4.13Å; A103-F111 HydrophobicContact CB-CE2 4.49Å; A103-L157 HydrophobicContact CB-CD1 4.04Å
104M97.8Very high96.7Very high28 Ų2824.2 Ų24.214%0.13812%0.12CC..Hα-helixtrans-64.1-49.3172.9-70.8-179.6-165.500111.8A66 I69 M100 A101 M102 L106 G107 F111 W114A66-M104 HydrophobicContact CB-CB 3.78Å; A66-M104 HydrophobicContact CB-SD 4.28Å; I69-M104 HydrophobicContact CD1-CE 3.79Å; I69-M104 HydrophobicContact CD1-SD 4Å; M100-M104 WeakPolarHBondContact O-CG 3.42Å; M100-M104 PolarHBondContact O-N 3.46Å; A101-M104 PolarHBondContact O-N 3Å; M102-M104 VanDerWaalsContact C-N 3.3Å; M102-M104 PolarHBondContact O-N 3.37Å; M104-L106 VanDerWaalsContact C-N 3.31Å; M104-L106 PolarHBondContact O-N 3.24Å; M104-G107 PolarHBondContact O-N 2.85Å; M104-G107 VanDerWaalsContact O-N 3.14Å; M104-F111 HydrophobicContact CB-CB 4.45Å; M104-F111 HydrophobicContact CB-CD2 4.43Å; M104-F111 HydrophobicContact CB-CG 4.38Å; M104-F111 HydrophobicContact CE-CD1 4.11Å; M104-F111 HydrophobicContact CE-CE1 3.55Å; M104-F111 HydrophobicContact CE-CE2 4.03Å; M104-F111 HydrophobicContact CE-CZ 3.5Å; M104-F111 VanDerWaalsContact CE-CZ 3.5Å; M104-F111 HydrophobicContact CG-CB 4.02Å; M104-F111 HydrophobicContact CG-CD1 3.79Å; M104-F111 HydrophobicContact CG-CD2 3.52Å; M104-F111 HydrophobicContact CG-CE1 4.14Å; M104-F111 HydrophobicContact CG-CE2 3.87Å; M104-F111 HydrophobicContact CG-CG 3.48Å; M104-F111 VanDerWaalsContact CG-CG 3.48Å; M104-F111 HydrophobicContact CG-CZ 4.17Å; M104-W114 PolarHBondContact O-NE1 3.25Å
105K97.4Very high97Very high9 Ų924.2 Ų24.24%0.03912%0.12CC..Hα-helixtrans-61.2-40.7-178.8-67.4-158164.7-77.80112.2L33 Q63 A66 A101 M102 G107 P138L33-K105 HydrophobicContact CD1-CD 4.18Å; L33-K105 HydrophobicContact CD2-CD 4.13Å; Q63-K105 PolarHBondContact NE2-O 3.46Å; Q63-K105 PolarHBondContact O-NZ 2.92Å; Q63-K105 VanDerWaalsContact OE1-CG 3.24Å; A66-K105 HydrophobicContact CB-CD 4.47Å; A66-K105 HydrophobicContact CB-CG 3.62Å; A101-K105 WeakPolarHBondContact O-CG 3.29Å; A101-K105 PolarHBondContact O-N 3.3Å; M102-K105 PolarHBondContact O-N 3.18Å; K105-G107 VanDerWaalsContact C-N 3.35Å; K105-P138 HydrophobicContact CB-CB 4.45Å; K105-P138 HydrophobicContact CB-CG 4.1Å
106L97.1Very high97.2Very high1 Ų124.4 Ų24.41%0.00512%0.121CC..Hα-helixtrans-82-10.1179-69.8172.7000113.7M102 M104 M108 K135 P138 I139 M187 M191M102-L106 VanDerWaalsContact O-CB 3.28Å; M102-L106 WeakPolarHBondContact O-CB 3.19Å; M102-L106 WeakPolarHBondContact O-CG 3.37Å; M102-L106 PolarHBondContact O-N 2.93Å; M104-L106 VanDerWaalsContact C-N 3.31Å; M104-L106 PolarHBondContact O-N 3.24Å; L106-M108 HydrophobicContact CB-CE 3.58Å; L106-M108 HydrophobicContact CD1-CE 3.37Å; L106-M108 HydrophobicContact CG-CE 4.1Å; L106-K135 HydrophobicContact CD2-CB 4.3Å; L106-K135 HydrophobicContact CD2-CD 3.74Å; L106-K135 PolarHBondContact O-NZ 3.17Å; L106-P138 HydrophobicContact CD1-CB 3.99Å; L106-P138 HydrophobicContact CD2-CB 3.59Å; L106-P138 HydrophobicContact CD2-CG 3.94Å; L106-P138 HydrophobicContact CG-CB 3.58Å; L106-P138 HydrophobicContact CG-CG 4.26Å; L106-I139 HydrophobicContact CD1-CG1 4.21Å; L106-I139 HydrophobicContact CD2-CG1 4.23Å; L106-M187 HydrophobicContact CB-CE 3.94Å; L106-M187 HydrophobicContact CD1-CE 3.79Å; L106-M187 HydrophobicContact CD2-CE 3.65Å; L106-M187 HydrophobicContact CD2-SD 4.46Å; L106-M187 HydrophobicContact CG-CE 4.01Å; L106-M191 HydrophobicContact CD1-CE 3.55Å; L106-M191 HydrophobicContact CD1-SD 4.26Å
107G96.2Very high97.2Very high1 Ų126.3 Ų26.31%0.0113%0.129CC..THydrogen-bonded Turntrans69.936.4178.400000114A103 M104 K105 H112A103-G107 PolarHBondContact O-N 3.19Å; M104-G107 PolarHBondContact O-N 2.85Å; M104-G107 VanDerWaalsContact O-N 3.14Å; K105-G107 VanDerWaalsContact C-N 3.35Å; G107-H112 WeakPolarHBondContact O-CA 3.41Å; G107-H112 WeakPolarHBondContact O-CB 2.91Å
108M97.6Very high97.3Very high4 Ų424 Ų242%0.0212%0.117CC..  trans-74.1159.4170.8-71.9162.4-156.200111.2A103 L106 F111 H112 M187 M191A103-M108 HydrophobicContact CB-CB 4.21Å; A103-M108 HydrophobicContact CB-SD 4.26Å; A103-M108 PolarHBondContact O-N 3.08Å; L106-M108 HydrophobicContact CB-CE 3.58Å; L106-M108 HydrophobicContact CD1-CE 3.37Å; L106-M108 HydrophobicContact CG-CE 4.1Å; M108-F111 CarbonylContact O-C 3.22Å; M108-F111 WeakPolarHBondContact O-CA 3.17Å; M108-F111 WeakPolarHBondContact O-CB 3.12Å; M108-F111 PolarHBondContact O-N 3.12Å; M108-H112 PolarHBondContact O-N 2.98Å; M108-H112 VanDerWaalsContact O-N 3.09Å; M108-M187 HydrophobicContact CE-CB 4.41Å; M108-M187 HydrophobicContact CE-CE 3.62Å; M108-M191 HydrophobicContact CE-CB 4.31Å; M108-M191 HydrophobicContact CE-CE 3.65Å; M108-M191 HydrophobicContact CE-CG 2.98Å; M108-M191 HydrophobicContact CE-SD 3.46Å; M108-M191 WeakPolarHBondContact CE-SD 3.24Å; M108-M191 HydrophobicContact SD-CB 4.49Å; M108-M191 HydrophobicContact SD-CG 3.57Å; M108-M191 VanDerWaalsContact SD-CG 3.57Å; M108-M191 HydrophobicContact SD-SD 4.3Å
109A96.7Very high97.4Very high4 Ų424 Ų243%0.03312%0.118CC..THydrogen-bonded Turntrans-68.3142174.500000111.5L157 L160 A164A109-L157 VanDerWaalsContact O-CD2 3.24Å; A109-L157 WeakPolarHBondContact O-CD2 3.24Å; A109-L160 HydrophobicContact CB-CB 3.94Å; A109-A164 HydrophobicContact CB-CB 4.06Å
110P97Very high97.4Very high66 Ų6624.4 Ų24.443%0.42912%0.119SC..THydrogen-bonded Turncis-83.90.12.733.8-36.1000115H112 F113P110-H112 PolarHBondContact O-N 3.05Å; P110-H112 VanDerWaalsContact O-N 3.14Å; P110-F113 WeakPolarHBondContact O-CD2 3.39Å; P110-F113 VanDerWaalsContact O-CE2 3.27Å; P110-F113 WeakPolarHBondContact O-CE2 3.34Å
111F98Very high97Very high54 Ų5421.9 Ų21.924%0.23711%0.11CC..G310 helixtrans-78.312.6-179.1-52.3-59000114.8M100 A103 M104 M108 F113 W114M100-F111 HydrophobicContact CE-CE2 3.49Å; M100-F111 VanDerWaalsContact CE-CE2 3.49Å; M100-F111 HydrophobicContact CE-CZ 3.4Å; M100-F111 VanDerWaalsContact CE-CZ 3.4Å; M100-F111 HydrophobicContact SD-CE2 4.23Å; A103-F111 HydrophobicContact CB-CD2 4.13Å; A103-F111 HydrophobicContact CB-CE2 4.49Å; M104-F111 HydrophobicContact CB-CB 4.45Å; M104-F111 HydrophobicContact CB-CD2 4.43Å; M104-F111 HydrophobicContact CB-CG 4.38Å; M104-F111 HydrophobicContact CE-CD1 4.11Å; M104-F111 HydrophobicContact CE-CE1 3.55Å; M104-F111 HydrophobicContact CE-CE2 4.03Å; M104-F111 HydrophobicContact CE-CZ 3.5Å; M104-F111 VanDerWaalsContact CE-CZ 3.5Å; M104-F111 HydrophobicContact CG-CB 4.02Å; M104-F111 HydrophobicContact CG-CD1 3.79Å; M104-F111 HydrophobicContact CG-CD2 3.52Å; M104-F111 HydrophobicContact CG-CE1 4.14Å; M104-F111 HydrophobicContact CG-CE2 3.87Å; M104-F111 HydrophobicContact CG-CG 3.48Å; M104-F111 VanDerWaalsContact CG-CG 3.48Å; M104-F111 HydrophobicContact CG-CZ 4.17Å; M108-F111 CarbonylContact O-C 3.22Å; M108-F111 WeakPolarHBondContact O-CA 3.17Å; M108-F111 WeakPolarHBondContact O-CB 3.12Å; M108-F111 PolarHBondContact O-N 3.12Å; F111-F113 VanDerWaalsContact C-N 3.28Å; F111-F113 PolarHBondContact O-N 3.5Å; F111-W114 PolarHBondContact O-NE1 3.18Å
112H97.5Very high96.9Very high20 Ų2022 Ų229%0.09311%0.111CC..G310 helixtrans-76.3-12.1-174.871.169.4000113.8G107 M108 P110 W114 V115 P116 A164 I184G107-H112 WeakPolarHBondContact O-CA 3.41Å; G107-H112 WeakPolarHBondContact O-CB 2.91Å; M108-H112 PolarHBondContact O-N 2.98Å; M108-H112 VanDerWaalsContact O-N 3.09Å; P110-H112 PolarHBondContact O-N 3.05Å; P110-H112 VanDerWaalsContact O-N 3.14Å; H112-W114 PolarHBondContact O-N 3.46Å; H112-W114 VanDerWaalsContact O-N 3.16Å; H112-V115 PolarHBondContact O-N 3.07Å; H112-P116 VanDerWaalsContact O-CD 3.26Å; H112-P116 WeakPolarHBondContact O-CD 3.47Å; H112-A164 WeakPolarHBondContact NE2-CB 3.45Å; H112-I184 HydrophobicContact CB-CD1 3.8Å; H112-I184 HydrophobicContact CB-CG1 4.17Å; H112-I184 HydrophobicContact CB-CG2 4.12Å
113F97.8Very high96.7Very high142 Ų14222.8 Ų22.862%0.62312%0.116SC*.G310 helixtrans-59.3-30.9-168.9-70.5-67000114.4P110 F111 V115P110-F113 WeakPolarHBondContact O-CD2 3.39Å; P110-F113 VanDerWaalsContact O-CE2 3.27Å; P110-F113 WeakPolarHBondContact O-CE2 3.34Å; F111-F113 VanDerWaalsContact C-N 3.28Å; F111-F113 PolarHBondContact O-N 3.5Å; F113-V115 VanDerWaalsContact C-N 3.35Å
114W97.8Very high96.6Very high15 Ų1523.5 Ų23.56%0.05712%0.119CC..Hα-helixtrans-73.7-25.8179.367.3-94.1000112.8Y59 T62 M104 F111 H112 E117 V118 L130Y59-W114 HydrophobicContact CD2-CE3 4.36Å; Y59-W114 HydrophobicContact CD2-CH2 4.22Å; Y59-W114 AromaticContact CD2-CZ3 3.78Å; Y59-W114 HydrophobicContact CD2-CZ3 3.78Å; Y59-W114 HydrophobicContact CE2-CH2 4.31Å; Y59-W114 HydrophobicContact CE2-CZ3 4.28Å; T62-W114 HydrophobicContact CG2-CB 4.16Å; T62-W114 HydrophobicContact CG2-CG 4.09Å; M104-W114 PolarHBondContact O-NE1 3.25Å; F111-W114 PolarHBondContact O-NE1 3.18Å; H112-W114 PolarHBondContact O-N 3.46Å; H112-W114 VanDerWaalsContact O-N 3.16Å; W114-E117 PolarHBondContact O-N 2.55Å; W114-V118 HydrophobicContact CE3-CB 4.18Å; W114-V118 HydrophobicContact CE3-CG2 3.82Å; W114-V118 VanDerWaalsContact O-CG2 3.3Å; W114-V118 WeakPolarHBondContact O-CG2 3.14Å; W114-V118 PolarHBondContact O-N 3.16Å; W114-L130 HydrophobicContact CH2-CD1 4.19Å; W114-L130 HydrophobicContact CZ3-CD1 3.9Å; W114-L130 HydrophobicContact CZ3-CD2 4.29Å; W114-L130 HydrophobicContact CZ3-CG 4.49Å
115V97.8Very high96.5Very high1 Ų125.2 Ų25.21%0.00613%0.131CC..Hα-helixtrans-64.2-48.8-170.5-1730000112.4H112 F113 E117 T119 L131 A180 I184H112-V115 PolarHBondContact O-N 3.07Å; F113-V115 VanDerWaalsContact C-N 3.35Å; V115-E117 PolarHBondContact O-N 3.4Å; V115-T119 HydrophobicContact CG1-CG2 4.32Å; V115-T119 WeakPolarHBondContact O-CB 3.15Å; V115-T119 VanDerWaalsContact O-CG2 3.23Å; V115-T119 WeakPolarHBondContact O-CG2 3.48Å; V115-T119 PolarHBondContact O-N 2.97Å; V115-T119 VanDerWaalsContact O-N 3.12Å; V115-T119 PolarHBondContact O-OG1 2.95Å; V115-L131 HydrophobicContact CG1-CD2 3.96Å; V115-A180 HydrophobicContact CG1-CB 4.12Å; V115-I184 HydrophobicContact CB-CD1 4.27Å; V115-I184 HydrophobicContact CB-CG1 4.48Å
116P97.5Very high96.4Very high6 Ų624.8 Ų24.84%0.03913%0.129CC..Hα-helixtrans-64.4-26.7178.1-22.835.1000114H112 T119 Q120 K177 Y181H112-P116 VanDerWaalsContact O-CD 3.26Å; H112-P116 WeakPolarHBondContact O-CD 3.47Å; P116-T119 WeakPolarHBondContact CA-OG1 3.3Å; P116-T119 PolarHBondContact O-OG1 3.33Å; P116-Q120 WeakPolarHBondContact O-CB 3.32Å; P116-Q120 PolarHBondContact O-N 3.45Å; P116-K177 HydrophobicContact CB-CG 4.33Å; P116-Y181 HydrophobicContact CB-CE2 4.23Å; P116-Y181 HydrophobicContact CG-CD1 4.45Å; P116-Y181 HydrophobicContact CG-CE1 3.85Å; P116-Y181 HydrophobicContact CG-CE2 4.01Å
117E96.9Very high96.4Very high84 Ų8424.9 Ų24.939%0.39313%0.13SC..Hα-helixtrans-81.9-47.4-175.7-60.7177.5159.800111K58 W114 V115 Q120 G121K58-E117 HydrophobicContact CD-CB 4.4Å; K58-E117 WeakPolarHBondContact CD-OE2 3.43Å; K58-E117 WeakPolarHBondContact CE-OE2 3.23Å; K58-E117 IonicContact NZ-OE1 2.77Å; K58-E117 IonicContact NZ-OE2 2.93Å; K58-E117 PolarHBondContact NZ-OE2 3.32Å; W114-E117 PolarHBondContact O-N 2.55Å; V115-E117 PolarHBondContact O-N 3.4Å; E117-Q120 PolarHBondContact O-N 3.01Å; E117-G121 PolarHBondContact O-N 3.3Å
118V97.9Very high96.4Very high0 Ų026.1 Ų26.10%014%0.136CC..Hα-helixtrans-65.8-44178.5-179.20000110.7L44 A55 K58 W114 Q120 G121 T122 L130L44-V118 HydrophobicContact CD1-CG1 4.28Å; L44-V118 HydrophobicContact CD2-CG1 3.96Å; A55-V118 HydrophobicContact CB-CG1 4.46Å; A55-V118 HydrophobicContact CB-CG2 4.49Å; A55-V118 WeakPolarHBondContact O-CG2 3.36Å; K58-V118 HydrophobicContact CB-CG2 4.33Å; W114-V118 HydrophobicContact CE3-CB 4.18Å; W114-V118 HydrophobicContact CE3-CG2 3.82Å; W114-V118 VanDerWaalsContact O-CG2 3.3Å; W114-V118 WeakPolarHBondContact O-CG2 3.14Å; W114-V118 PolarHBondContact O-N 3.16Å; V118-Q120 VanDerWaalsContact C-N 3.32Å; V118-Q120 PolarHBondContact O-N 3.32Å; V118-G121 PolarHBondContact O-N 3.36Å; V118-T122 HydrophobicContact CG1-CG2 4.41Å; V118-T122 WeakPolarHBondContact O-CB 3.42Å; V118-T122 WeakPolarHBondContact O-CG2 3.39Å; V118-T122 PolarHBondContact O-N 3.22Å; V118-T122 PolarHBondContact O-OG1 3.13Å; V118-L130 HydrophobicContact CB-CD2 4.15Å; V118-L130 HydrophobicContact CG1-CD2 3.64Å
119T96.9Very high96.4Very high2 Ų228 Ų281%0.01215%0.146CC..Hα-helixtrans-62.5-38175.852.70000112.4V115 P116 L130 L131 R176 A180V115-T119 HydrophobicContact CG1-CG2 4.32Å; V115-T119 WeakPolarHBondContact O-CB 3.15Å; V115-T119 VanDerWaalsContact O-CG2 3.23Å; V115-T119 WeakPolarHBondContact O-CG2 3.48Å; V115-T119 PolarHBondContact O-N 2.97Å; V115-T119 VanDerWaalsContact O-N 3.12Å; V115-T119 PolarHBondContact O-OG1 2.95Å; P116-T119 WeakPolarHBondContact CA-OG1 3.3Å; P116-T119 PolarHBondContact O-OG1 3.33Å; T119-L130 HydrophobicContact CG2-CD2 3.8Å; T119-L131 HydrophobicContact CG2-CD1 4Å; T119-L131 HydrophobicContact CG2-CD2 3.79Å; T119-L131 HydrophobicContact CG2-CG 3.94Å; T119-R176 WeakPolarHBondContact O-CD 3.36Å; T119-A180 HydrophobicContact CG2-CB 4.01Å; T119-A180 WeakPolarHBondContact OG1-CB 3.42Å
120Q96.4Very high96.5Very high10 Ų1027.9 Ų27.95%0.04715%0.145CC..Hα-helixtrans-75.3-34.7-178.1-179.263.25.100113.2P116 E117 V118 T122 R176 K177P116-Q120 WeakPolarHBondContact O-CB 3.32Å; P116-Q120 PolarHBondContact O-N 3.45Å; E117-Q120 PolarHBondContact O-N 3.01Å; V118-Q120 VanDerWaalsContact C-N 3.32Å; V118-Q120 PolarHBondContact O-N 3.32Å; Q120-T122 VanDerWaalsContact C-N 3.33Å; Q120-R176 PolarHBondContact O-NE 3.44Å; Q120-R176 PolarHBondContact O-NH2 3.3Å; Q120-R176 VanDerWaalsContact OE1-NE 3.08Å; Q120-K177 HydrophobicContact CB-CG 4.06Å; Q120-K177 HydrophobicContact CG-CG 4.37Å
121G90.1Very high96.5Very high10 Ų1024.8 Ų24.810%0.10313%0.125CC..Hα-helixtrans-76.7-17.1-177.600000114.6E117 V118E117-G121 PolarHBondContact O-N 3.3Å; V118-G121 PolarHBondContact O-N 3.36Å
122T94.8Very high96.5Very high3 Ų322.8 Ų22.82%0.01812%0.117CC..SBendtrans-107.5159-169.562.50000112.1L44 A55 V118 Q120 S126L44-T122 HydrophobicContact CB-CG2 4.09Å; L44-T122 HydrophobicContact CD2-CG2 3.61Å; L44-T122 HydrophobicContact CG-CG2 4.46Å; A55-T122 HydrophobicContact CB-CG2 4.07Å; V118-T122 HydrophobicContact CG1-CG2 4.41Å; V118-T122 WeakPolarHBondContact O-CB 3.42Å; V118-T122 WeakPolarHBondContact O-CG2 3.39Å; V118-T122 PolarHBondContact O-N 3.22Å; V118-T122 PolarHBondContact O-OG1 3.13Å; Q120-T122 VanDerWaalsContact C-N 3.33Å; T122-S126 VanDerWaalsContact CB-OG 3.26Å; T122-S126 WeakPolarHBondContact CB-OG 3.5Å; T122-S126 PolarHBondContact OG1-OG 3.11Å
123P94.8Very high96.6Very high17 Ų1725.4 Ų25.411%0.1113%0.126CC..  trans-62.5158.617523.5-31.4000112.2K46 T125 S126 G127K46-P123 HydrophobicContact CB-CG 4.28Å; K46-P123 HydrophobicContact CD-CG 4.42Å; P123-T125 PolarHBondContact O-N 3.04Å; P123-S126 WeakPolarHBondContact CD-OG 3.34Å; P123-S126 VanDerWaalsContact CG-OG 3.25Å; P123-S126 WeakPolarHBondContact CG-OG 3.39Å; P123-S126 PolarHBondContact O-N 3.11Å; P123-S126 PolarHBondContact O-OG 3.06Å; P123-G127 PolarHBondContact O-N 2.93Å
124L94.8Very high96.6Very high17 Ų1719.9 Ų19.99%0.08910%0.102CC..Hα-helixtrans-58.3-34.5-176.8-71.5170.1000112.9G127 L128 R176 F216 L219 N220 T225L124-G127 PolarHBondContact O-N 2.86Å; L124-L128 WeakPolarHBondContact O-CB 3.25Å; L124-L128 PolarHBondContact O-N 3.46Å; L124-R176 HydrophobicContact CD2-CG 3.74Å; L124-F216 HydrophobicContact CB-CD1 4.38Å; L124-F216 HydrophobicContact CD2-CD1 3.95Å; L124-F216 HydrophobicContact CD2-CE1 4.07Å; L124-L219 HydrophobicContact CD1-CB 4.16Å; L124-L219 HydrophobicContact CD2-CB 4.43Å; L124-L219 HydrophobicContact CD2-CD1 4.3Å; L124-N220 WeakPolarHBondContact CB-OD1 3.43Å; L124-N220 WeakPolarHBondContact CD1-OD1 3.38Å; L124-T225 HydrophobicContact CD1-CG2 4.48Å
125T94.9Very high96.5Very high64 Ų6419.5 Ų19.539%0.39310%0.101SC..Hα-helixtrans-71.1-38.8179.349.60000113.5P123 L128 L129P123-T125 PolarHBondContact O-N 3.04Å; T125-L128 PolarHBondContact O-N 3.22Å; T125-L129 PolarHBondContact O-N 2.65Å
126S95.9Very high96.5Very high0 Ų022 Ų220%011%0.114CC..Hα-helixtrans-72.1-36.217356.80000111.3V43 T122 P123 L128 L129 L130V43-S126 WeakPolarHBondContact O-CB 3.43Å; T122-S126 VanDerWaalsContact CB-OG 3.26Å; T122-S126 WeakPolarHBondContact CB-OG 3.5Å; T122-S126 PolarHBondContact OG1-OG 3.11Å; P123-S126 WeakPolarHBondContact CD-OG 3.34Å; P123-S126 VanDerWaalsContact CG-OG 3.25Å; P123-S126 WeakPolarHBondContact CG-OG 3.39Å; P123-S126 PolarHBondContact O-N 3.11Å; P123-S126 PolarHBondContact O-OG 3.06Å; S126-L128 VanDerWaalsContact C-N 3.3Å; S126-L128 PolarHBondContact O-N 3.07Å; S126-L129 PolarHBondContact O-N 3.3Å; S126-L130 WeakPolarHBondContact O-CB 3.34Å; S126-L130 PolarHBondContact O-N 3.26Å
127G96.6Very high96.5Very high2 Ų221.9 Ų21.92%0.02111%0.114CC..Hα-helixtrans-60.9-39.1172.700000112.4P123 L124 L130 L131P123-G127 PolarHBondContact O-N 2.93Å; L124-G127 PolarHBondContact O-N 2.86Å; G127-L130 PolarHBondContact O-N 3.4Å; G127-L131 WeakPolarHBondContact O-CG 3.45Å; G127-L131 PolarHBondContact O-N 3.32Å
128L97.1Very high96.5Very high27 Ų2718.1 Ų18.114%0.14110%0.097CC..Hα-helixtrans-59.9-52.9172.9173.460.4000111.4L124 T125 S126 L130 L131 T132 T213 F216L124-L128 WeakPolarHBondContact O-CB 3.25Å; L124-L128 PolarHBondContact O-N 3.46Å; T125-L128 PolarHBondContact O-N 3.22Å; S126-L128 VanDerWaalsContact C-N 3.3Å; S126-L128 PolarHBondContact O-N 3.07Å; L128-L130 VanDerWaalsContact C-N 3.27Å; L128-L130 PolarHBondContact O-N 2.93Å; L128-L131 PolarHBondContact O-N 3.48Å; L128-T132 HydrophobicContact CD1-CG2 3.84Å; L128-T132 WeakPolarHBondContact O-CB 3.33Å; L128-T132 PolarHBondContact O-N 2.9Å; L128-T132 PolarHBondContact O-OG1 3.26Å; L128-T213 HydrophobicContact CD1-CG2 3.8Å; L128-F216 HydrophobicContact CB-CB 4.11Å; L128-F216 HydrophobicContact CB-CD1 4.42Å; L128-F216 HydrophobicContact CB-CD2 4.05Å; L128-F216 HydrophobicContact CB-CG 3.95Å; L128-F216 HydrophobicContact CD1-CB 4.01Å; L128-F216 HydrophobicContact CD1-CD2 3.68Å; L128-F216 HydrophobicContact CD1-CG 4.12Å; L128-F216 HydrophobicContact CD2-CB 4.41Å; L128-F216 HydrophobicContact CG-CB 4.4Å; L128-F216 HydrophobicContact CG-CD2 4.48Å
129L98Very high96.5Very high44 Ų4418.5 Ų18.523%0.2310%0.098CC..Hα-helixtrans-60.9-37179-70166.6000112.1Y10 F40 V43 T125 S126 W133 Q134Y10-L129 HydrophobicContact CE1-CD1 3.87Å; F40-L129 HydrophobicContact CE2-CB 3.66Å; F40-L129 HydrophobicContact CE2-CD1 4.49Å; F40-L129 HydrophobicContact CZ-CB 4.12Å; V43-L129 HydrophobicContact CG1-CD1 3.98Å; T125-L129 PolarHBondContact O-N 2.65Å; S126-L129 PolarHBondContact O-N 3.3Å; L129-W133 HydrophobicContact CD2-CB 4.33Å; L129-W133 WeakPolarHBondContact O-CB 3.32Å; L129-W133 PolarHBondContact O-N 2.87Å; L129-Q134 PolarHBondContact O-N 3.01Å
130L98.1Very high96.4Very high2 Ų219.7 Ų19.71%0.0111%0.107CC..Hα-helixtrans-64.4-44177.1179.572.4000112.1F40 Y59 W114 V118 T119 S126 G127 L128 Q134F40-L130 HydrophobicContact CD1-CD1 4.5Å; F40-L130 HydrophobicContact CE1-CB 3.98Å; F40-L130 HydrophobicContact CE1-CD1 3.62Å; F40-L130 HydrophobicContact CE1-CG 4.39Å; F40-L130 HydrophobicContact CZ-CB 3.78Å; F40-L130 HydrophobicContact CZ-CD1 4.28Å; Y59-L130 HydrophobicContact CD2-CD1 3.98Å; Y59-L130 HydrophobicContact CE2-CD1 3.71Å; W114-L130 HydrophobicContact CH2-CD1 4.19Å; W114-L130 HydrophobicContact CZ3-CD1 3.9Å; W114-L130 HydrophobicContact CZ3-CD2 4.29Å; W114-L130 HydrophobicContact CZ3-CG 4.49Å; V118-L130 HydrophobicContact CB-CD2 4.15Å; V118-L130 HydrophobicContact CG1-CD2 3.64Å; T119-L130 HydrophobicContact CG2-CD2 3.8Å; S126-L130 WeakPolarHBondContact O-CB 3.34Å; S126-L130 PolarHBondContact O-N 3.26Å; G127-L130 PolarHBondContact O-N 3.4Å; L128-L130 VanDerWaalsContact C-N 3.27Å; L128-L130 PolarHBondContact O-N 2.93Å; L130-Q134 HydrophobicContact CD1-CG 4.41Å; L130-Q134 WeakPolarHBondContact O-CB 3.49Å
131L97.7Very high96.4Very high1 Ų119.2 Ų19.21%0.00511%0.105CC..Hα-helixtrans-81.9-18.6-176.2-66.4-172.1000113.2V115 T119 G127 L128 K135 S183 Y208 F216V115-L131 HydrophobicContact CG1-CD2 3.96Å; T119-L131 HydrophobicContact CG2-CD1 4Å; T119-L131 HydrophobicContact CG2-CD2 3.79Å; T119-L131 HydrophobicContact CG2-CG 3.94Å; G127-L131 WeakPolarHBondContact O-CG 3.45Å; G127-L131 PolarHBondContact O-N 3.32Å; L128-L131 PolarHBondContact O-N 3.48Å; L131-K135 VanDerWaalsContact O-CG 3.3Å; L131-K135 WeakPolarHBondContact O-CG 3.26Å; L131-S183 WeakPolarHBondContact CD2-OG 3.3Å; L131-Y208 WeakPolarHBondContact O-CE1 3.35Å; L131-Y208 PolarHBondContact O-OH 3.39Å; L131-F216 HydrophobicContact CB-CE2 4.47Å; L131-F216 HydrophobicContact CD1-CE2 3.86Å; L131-F216 HydrophobicContact CD1-CZ 3.82Å
132T98Very high96.7Very high11 Ų1118.9 Ų18.97%0.06710%0.1CC..THydrogen-bonded Turntrans-109.1-72-178.255.60000112.2L128 Q134 K135 I209 T212 T213L128-T132 HydrophobicContact CD1-CG2 3.84Å; L128-T132 WeakPolarHBondContact O-CB 3.33Å; L128-T132 PolarHBondContact O-N 2.9Å; L128-T132 PolarHBondContact O-OG1 3.26Å; T132-Q134 PolarHBondContact O-N 3.44Å; T132-K135 WeakPolarHBondContact O-CB 3.46Å; T132-K135 PolarHBondContact O-N 3.43Å; T132-K135 VanDerWaalsContact O-N 3.11Å; T132-I209 HydrophobicContact CG2-CG1 4.38Å; T132-I209 HydrophobicContact CG2-CG2 4.3Å; T132-T212 WeakPolarHBondContact CG2-OG1 3.33Å; T132-T213 HydrophobicContact CG2-CG2 4.28Å
133W97.9Very high96.7Very high76 Ų7622.9 Ų22.929%0.28812%0.116SC..G310 helixtrans-60.9-42.8-171.6-165.3-92.9000113I13 F14 T17 L129 K135 L136I13-W133 VanDerWaalsContact CG2-CD1 3.44Å; I13-W133 HydrophobicContact CG2-CG 4.45Å; I13-W133 VanDerWaalsContact CG2-NE1 3.35Å; F14-W133 AromaticContact CD2-CH2 3.82Å; F14-W133 HydrophobicContact CD2-CH2 3.82Å; F14-W133 AromaticContact CD2-CZ2 3.75Å; F14-W133 HydrophobicContact CD2-CZ2 3.75Å; F14-W133 HydrophobicContact CE2-CH2 4.23Å; F14-W133 HydrophobicContact CE2-CZ2 4.48Å; T17-W133 VanDerWaalsContact CG2-NE1 3.28Å; T17-W133 WeakPolarHBondContact OG1-CZ2 3.47Å; T17-W133 PolarHBondContact OG1-NE1 3.1Å; L129-W133 HydrophobicContact CD2-CB 4.33Å; L129-W133 WeakPolarHBondContact O-CB 3.32Å; L129-W133 PolarHBondContact O-N 2.87Å; W133-K135 PolarHBondContact O-N 2.99Å; W133-K135 VanDerWaalsContact O-N 3.07Å; W133-L136 HydrophobicContact CD2-CD1 3.95Å; W133-L136 HydrophobicContact CE3-CD1 3.75Å; W133-L136 HydrophobicContact CH2-CD1 4.37Å; W133-L136 HydrophobicContact CZ3-CD1 3.98Å; W133-L136 WeakPolarHBondContact O-CB 3.06Å; W133-L136 PolarHBondContact O-N 3.47Å; W133-L136 VanDerWaalsContact O-N 3.11Å
134Q97.7Very high96.6Very high25 Ų2525.3 Ų25.312%0.11713%0.126CC..G310 helixtrans-67.3-9.4-178.9-62.9-64.2-35.900113.7F40 Y59 L129 L130 T132 P138F40-Q134 HydrophobicContact CD1-CG 4.22Å; F40-Q134 HydrophobicContact CD2-CG 4.39Å; F40-Q134 VanDerWaalsContact CD2-NE2 3.27Å; F40-Q134 HydrophobicContact CE1-CG 4.1Å; F40-Q134 HydrophobicContact CE2-CG 4.31Å; F40-Q134 HydrophobicContact CG-CG 4.36Å; F40-Q134 VanDerWaalsContact CG-NE2 3.32Å; F40-Q134 HydrophobicContact CZ-CG 4.17Å; Y59-Q134 PolarHBondContact OH-OE1 3.21Å; L129-Q134 PolarHBondContact O-N 3.01Å; L130-Q134 HydrophobicContact CD1-CG 4.41Å; L130-Q134 WeakPolarHBondContact O-CB 3.49Å; T132-Q134 PolarHBondContact O-N 3.44Å; Q134-P138 VanDerWaalsContact O-CD 3.32Å; Q134-P138 WeakPolarHBondContact O-CD 3.43Å
135K97.4Very high96.6Very high7 Ų724.7 Ų24.73%0.0312%0.122CC..G310 helixtrans-84.5-21.5175-54.9-58.2-172.8-174.40113.1L106 L131 T132 W133 I139 M187L106-K135 HydrophobicContact CD2-CB 4.3Å; L106-K135 HydrophobicContact CD2-CD 3.74Å; L106-K135 PolarHBondContact O-NZ 3.17Å; L131-K135 VanDerWaalsContact O-CG 3.3Å; L131-K135 WeakPolarHBondContact O-CG 3.26Å; T132-K135 WeakPolarHBondContact O-CB 3.46Å; T132-K135 PolarHBondContact O-N 3.43Å; T132-K135 VanDerWaalsContact O-N 3.11Å; W133-K135 PolarHBondContact O-N 2.99Å; W133-K135 VanDerWaalsContact O-N 3.07Å; K135-I139 HydrophobicContact CB-CD1 4.36Å; K135-I139 WeakPolarHBondContact O-CB 3.4Å; K135-I139 WeakPolarHBondContact O-CG1 3.3Å; K135-I139 PolarHBondContact O-N 2.78Å; K135-M187 HydrophobicContact CB-SD 4.48Å; K135-M187 HydrophobicContact CD-CG 4.48Å; K135-M187 HydrophobicContact CD-SD 3.72Å; K135-M187 HydrophobicContact CG-SD 4.11Å
136L97.9Very high96.5Very high54 Ų5422.1 Ų22.128%0.28311%0.107SC..Hα-helixtrans-63.6-55.6-172.9-66.8173000112.6W133 I139 S140 L205 I209W133-L136 HydrophobicContact CD2-CD1 3.95Å; W133-L136 HydrophobicContact CE3-CD1 3.75Å; W133-L136 HydrophobicContact CH2-CD1 4.37Å; W133-L136 HydrophobicContact CZ3-CD1 3.98Å; W133-L136 WeakPolarHBondContact O-CB 3.06Å; W133-L136 PolarHBondContact O-N 3.47Å; W133-L136 VanDerWaalsContact O-N 3.11Å; L136-I139 PolarHBondContact O-N 2.97Å; L136-S140 PolarHBondContact O-N 3.49Å; L136-L205 HydrophobicContact CD2-CD1 4.27Å; L136-L205 HydrophobicContact CD2-CD2 3.83Å; L136-I209 HydrophobicContact CD2-CD1 3.9Å
137A96.5Very high96.2Very high4 Ų427.8 Ų27.83%0.03314%0.144CC..Hα-helixtrans-64.2-44.1-175.500000113.9T17 T20 L33 I139 S140 I141T17-A137 HydrophobicContact CG2-CB 4.12Å; T20-A137 HydrophobicContact CG2-CB 4.11Å; T20-A137 VanDerWaalsContact OG1-CB 3.27Å; T20-A137 WeakPolarHBondContact OG1-CB 3.25Å; L33-A137 HydrophobicContact CD2-CB 3.97Å; A137-I139 VanDerWaalsContact C-N 3.34Å; A137-I139 PolarHBondContact O-N 3.24Å; A137-S140 PolarHBondContact O-N 3.3Å; A137-S140 PolarHBondContact O-OG 2.8Å; A137-I141 WeakPolarHBondContact O-CG1 3.43Å; A137-I141 PolarHBondContact O-N 2.9Å
138P97.1Very high95.8Very high5 Ų529.2 Ų29.23%0.03215%0.153CC..Hα-helixtrans-67.3-33.9176.2-2133000112.9L33 M102 K105 L106 Q134 I141 M142L33-P138 HydrophobicContact CD2-CG 4.36Å; M102-P138 HydrophobicContact SD-CB 3.81Å; K105-P138 HydrophobicContact CB-CB 4.45Å; K105-P138 HydrophobicContact CB-CG 4.1Å; L106-P138 HydrophobicContact CD1-CB 3.99Å; L106-P138 HydrophobicContact CD2-CB 3.59Å; L106-P138 HydrophobicContact CD2-CG 3.94Å; L106-P138 HydrophobicContact CG-CB 3.58Å; L106-P138 HydrophobicContact CG-CG 4.26Å; Q134-P138 VanDerWaalsContact O-CD 3.32Å; Q134-P138 WeakPolarHBondContact O-CD 3.43Å; P138-I141 PolarHBondContact O-N 2.92Å; P138-M142 WeakPolarHBondContact O-CG 3.14Å; P138-M142 PolarHBondContact O-N 2.98Å
139I97Very high95.4Very high7 Ų728.4 Ų28.44%0.03615%0.15CC..Hα-helixtrans-69.1-38.2175.6-75.8169.9000111.4L106 K135 L136 A137 I141 M142 Y143 M187 M190 M191 L205L106-I139 HydrophobicContact CD1-CG1 4.21Å; L106-I139 HydrophobicContact CD2-CG1 4.23Å; K135-I139 HydrophobicContact CB-CD1 4.36Å; K135-I139 WeakPolarHBondContact O-CB 3.4Å; K135-I139 WeakPolarHBondContact O-CG1 3.3Å; K135-I139 PolarHBondContact O-N 2.78Å; L136-I139 PolarHBondContact O-N 2.97Å; A137-I139 VanDerWaalsContact C-N 3.34Å; A137-I139 PolarHBondContact O-N 3.24Å; I139-I141 VanDerWaalsContact C-N 3.26Å; I139-I141 PolarHBondContact O-N 3.35Å; I139-M142 PolarHBondContact O-N 3.41Å; I139-Y143 VanDerWaalsContact O-CB 3.32Å; I139-Y143 WeakPolarHBondContact O-CB 3.33Å; I139-Y143 PolarHBondContact O-N 3.18Å; I139-M187 HydrophobicContact CD1-CE 3.8Å; I139-M187 HydrophobicContact CD1-SD 4.33Å; I139-M187 HydrophobicContact CG1-CE 4.32Å; I139-M190 HydrophobicContact CD1-SD 4.1Å; I139-M191 HydrophobicContact CD1-CE 4.17Å; I139-M191 HydrophobicContact CG1-CE 3.63Å; I139-L205 HydrophobicContact CB-CD1 4.16Å; I139-L205 HydrophobicContact CD1-CD1 3.27Å; I139-L205 HydrophobicContact CG1-CD1 4.27Å; I139-L205 HydrophobicContact CG2-CD1 4.08Å
140S96.2Very high95.2Very high27 Ų2728.7 Ų28.719%0.18915%0.151CC..Hα-helixtrans-61.7-37176.166.80000111.9L136 A137 Y143 Q144L136-S140 PolarHBondContact O-N 3.49Å; A137-S140 PolarHBondContact O-N 3.3Å; A137-S140 PolarHBondContact O-OG 2.8Å; S140-Y143 PolarHBondContact O-N 2.92Å; S140-Q144 WeakPolarHBondContact O-CG 3.28Å; S140-Q144 PolarHBondContact O-N 3.38Å; S140-Q144 VanDerWaalsContact O-N 3.16Å
141I95.9Very high95Very high0 Ų031.2 Ų31.20%017%0.167CC..Hα-helixtrans-68.8-46.7175.6-61.9165.9000110.7W26 L33 M86 M102 A137 P138 I139 Y143 Q144 I145W26-I141 HydrophobicContact CH2-CG2 4.45Å; W26-I141 HydrophobicContact CZ3-CG2 4.22Å; L33-I141 HydrophobicContact CD1-CD1 3.58Å; L33-I141 HydrophobicContact CD2-CD1 4.19Å; L33-I141 HydrophobicContact CG-CD1 3.97Å; M86-I141 HydrophobicContact CE-CG2 3.96Å; M102-I141 HydrophobicContact CE-CB 3.81Å; M102-I141 HydrophobicContact CE-CD1 3.59Å; M102-I141 HydrophobicContact CE-CG1 4.3Å; M102-I141 HydrophobicContact CE-CG2 3.48Å; M102-I141 VanDerWaalsContact CE-CG2 3.48Å; M102-I141 HydrophobicContact SD-CB 4.47Å; M102-I141 HydrophobicContact SD-CD1 4.46Å; A137-I141 WeakPolarHBondContact O-CG1 3.43Å; A137-I141 PolarHBondContact O-N 2.9Å; P138-I141 PolarHBondContact O-N 2.92Å; I139-I141 VanDerWaalsContact C-N 3.26Å; I139-I141 PolarHBondContact O-N 3.35Å; I141-Y143 PolarHBondContact O-N 3.32Å; I141-Q144 PolarHBondContact O-N 2.69Å; I141-I145 HydrophobicContact CG2-CD1 4.46Å; I141-I145 WeakPolarHBondContact O-CG1 3.31Å; I141-I145 PolarHBondContact O-N 3Å
142M95.7Very high94.9Very high3 Ų334.7 Ų34.72%0.01519%0.191CC..Hα-helixtrans-60.8-33.6176.9-72.4-63.7-67.700112.8M99 M102 P138 I139 I145 S146 L149 L154 M191 L194M99-M142 HydrophobicContact CG-CE 4.37Å; M102-M142 HydrophobicContact CB-CG 3.9Å; M102-M142 HydrophobicContact CB-SD 3.65Å; M102-M142 HydrophobicContact CG-CG 3.92Å; M102-M142 HydrophobicContact CG-SD 3.68Å; P138-M142 WeakPolarHBondContact O-CG 3.14Å; P138-M142 PolarHBondContact O-N 2.98Å; I139-M142 PolarHBondContact O-N 3.41Å; M142-I145 HydrophobicContact SD-CD1 4.24Å; M142-S146 WeakPolarHBondContact O-CA 3.26Å; M142-S146 PolarHBondContact O-N 3.09Å; M142-S146 VanDerWaalsContact O-N 3.17Å; M142-L149 HydrophobicContact CE-CD1 3.64Å; M142-L149 HydrophobicContact CE-CD2 3.84Å; M142-L149 HydrophobicContact CE-CG 4.44Å; M142-L149 HydrophobicContact SD-CD2 4.39Å; M142-L154 HydrophobicContact CE-CD1 3.88Å; M142-M191 HydrophobicContact CE-SD 4.14Å; M142-M191 HydrophobicContact CG-SD 4.44Å; M142-L194 HydrophobicContact CB-CD1 3.83Å; M142-L194 HydrophobicContact CE-CD1 3.94Å
143Y95.1Very high94.9Very high88 Ų8836.2 Ų36.235%0.34520%0.198SC..Hα-helixtrans-63.9-47.3174179.7-87.2000111.4I139 S140 I141 I145 S146 P198 N199 I202I139-Y143 VanDerWaalsContact O-CB 3.32Å; I139-Y143 WeakPolarHBondContact O-CB 3.33Å; I139-Y143 PolarHBondContact O-N 3.18Å; S140-Y143 PolarHBondContact O-N 2.92Å; I141-Y143 PolarHBondContact O-N 3.32Å; Y143-I145 VanDerWaalsContact C-N 3.32Å; Y143-I145 PolarHBondContact O-N 2.84Å; Y143-S146 WeakPolarHBondContact O-CB 3.41Å; Y143-S146 PolarHBondContact O-N 2.92Å; Y143-S146 PolarHBondContact O-OG 2.87Å; Y143-P198 HydrophobicContact CD2-CB 3.34Å; Y143-P198 HydrophobicContact CE2-CB 3.26Å; Y143-P198 HydrophobicContact CE2-CG 4.47Å; Y143-P198 HydrophobicContact CG-CB 4.31Å; Y143-N199 PolarHBondContact OH-OD1 3.35Å; Y143-N199 VanDerWaalsContact OH-OD1 3.05Å; Y143-I202 HydrophobicContact CD2-CD1 3.62Å; Y143-I202 HydrophobicContact CD2-CG1 4.08Å; Y143-I202 HydrophobicContact CE2-CD1 3.34Å; Y143-I202 HydrophobicContact CE2-CG1 4.18Å; Y143-I202 HydrophobicContact CG-CD1 4.48Å
144Q93.9Very high94.8Very high67 Ų6732.7 Ų32.731%0.31319%0.185SC..Hα-helixtrans-65.3-33.4-178-72.3173.3-3.900113.3M86 S140 I141M86-Q144 HydrophobicContact CE-CB 4.2Å; M86-Q144 VanDerWaalsContact CE-OE1 3.29Å; S140-Q144 WeakPolarHBondContact O-CG 3.28Å; S140-Q144 PolarHBondContact O-N 3.38Å; S140-Q144 VanDerWaalsContact O-N 3.16Å; I141-Q144 PolarHBondContact O-N 2.69Å
145I93.3Very high94.8Very high4 Ų432.3 Ų32.32%0.02118%0.184CC..THydrogen-bonded Turntrans-98.48.6-179.668.6-175.4000113.8W26 M86 I98 I141 M142 Y143 P147 S148 L149W26-I145 HydrophobicContact CH2-CD1 4.5Å; W26-I145 HydrophobicContact CH2-CG2 3.66Å; W26-I145 HydrophobicContact CZ2-CG2 3.76Å; M86-I145 HydrophobicContact CE-CG2 3.83Å; I98-I145 HydrophobicContact CB-CD1 4.35Å; I98-I145 HydrophobicContact CG2-CD1 3.39Å; I141-I145 HydrophobicContact CG2-CD1 4.46Å; I141-I145 WeakPolarHBondContact O-CG1 3.31Å; I141-I145 PolarHBondContact O-N 3Å; M142-I145 HydrophobicContact SD-CD1 4.24Å; Y143-I145 VanDerWaalsContact C-N 3.32Å; Y143-I145 PolarHBondContact O-N 2.84Å; I145-P147 VanDerWaalsContact C-N 3.32Å; I145-S148 PolarHBondContact O-N 3.4Å; I145-S148 PolarHBondContact O-OG 2.94Å; I145-L149 HydrophobicContact CD1-CD2 4.17Å; I145-L149 HydrophobicContact CG1-CD2 4.09Å; I145-L149 HydrophobicContact CG1-CG 4.47Å
146S92.9Very high94.8Very high11 Ų1135.5 Ų35.58%0.07720%0.204CC..G310 helixtrans-54.1-37.2-170.575.90000115.3M142 Y143 S148 L149 P198M142-S146 WeakPolarHBondContact O-CA 3.26Å; M142-S146 PolarHBondContact O-N 3.09Å; M142-S146 VanDerWaalsContact O-N 3.17Å; Y143-S146 WeakPolarHBondContact O-CB 3.41Å; Y143-S146 PolarHBondContact O-N 2.92Å; Y143-S146 PolarHBondContact O-OG 2.87Å; S146-S148 VanDerWaalsContact C-N 3.29Å; S146-S148 PolarHBondContact O-N 3.45Å; S146-L149 PolarHBondContact O-N 3.18Å; S146-P198 WeakPolarHBondContact OG-CG 3.33Å
147P89.9Confident94.8Very high118 Ų11833.6 Ų33.677%0.76619%0.194SC*.G310 helixtrans-69.3-24.9-176.4-20.535.2000113.7I145I145-P147 VanDerWaalsContact C-N 3.32Å
148S88.3Confident94.9Very high32 Ų3233.4 Ų33.422%0.22419%0.192CC..G310 helixtrans-989.4-177.856.90000113.6T90 I145 S146T90-S148 PolarHBondContact OG1-OG 3.07Å; I145-S148 PolarHBondContact O-N 3.4Å; I145-S148 PolarHBondContact O-OG 2.94Å; S146-S148 VanDerWaalsContact C-N 3.29Å; S146-S148 PolarHBondContact O-N 3.45Å
149L89.1Confident94.9Very high11 Ų1134.6 Ų34.66%0.05820%0.198CC..SBendtrans-75.1138.5178.3-66.8172.8000111.1M99 M142 I145 S146 V151 L154M99-L149 HydrophobicContact CG-CD2 3.46Å; M99-L149 VanDerWaalsContact CG-CD2 3.46Å; M99-L149 HydrophobicContact SD-CB 4.27Å; M99-L149 HydrophobicContact SD-CD2 3.74Å; M142-L149 HydrophobicContact CE-CD1 3.64Å; M142-L149 HydrophobicContact CE-CD2 3.84Å; M142-L149 HydrophobicContact CE-CG 4.44Å; M142-L149 HydrophobicContact SD-CD2 4.39Å; I145-L149 HydrophobicContact CD1-CD2 4.17Å; I145-L149 HydrophobicContact CG1-CD2 4.09Å; I145-L149 HydrophobicContact CG1-CG 4.47Å; S146-L149 PolarHBondContact O-N 3.18Å; L149-V151 PolarHBondContact O-N 3.07Å; L149-V151 VanDerWaalsContact O-N 3.07Å; L149-L154 HydrophobicContact CD1-CD2 3.94Å
150N93.8Very high95Very high49 Ų4938.3 Ų38.326%0.26222%0.218SC..  trans-72.6104.6169.9-176.8-6.5000109.4L96 M99 S152 L153 L154L96-N150 HydrophobicContact CD2-CB 4.41Å; M99-N150 HydrophobicContact CE-CB 3.67Å; N150-S152 PolarHBondContact ND2-OG 3.07Å; N150-S152 PolarHBondContact O-N 3.48Å; N150-S152 PolarHBondContact OD1-N 3.43Å; N150-S152 VanDerWaalsContact OD1-N 3.16Å; N150-S152 PolarHBondContact OD1-OG 2.65Å; N150-L153 PolarHBondContact O-N 2.95Å; N150-L154 PolarHBondContact O-N 3.36Å
151V94.3Very high95.1Very high56 Ų5637 Ų3734%0.33921%0.209SC..Hα-helixtrans-53.6-40.8-177.9-1780000112L149 L154 L155 P195L149-V151 PolarHBondContact O-N 3.07Å; L149-V151 VanDerWaalsContact O-N 3.07Å; V151-L154 PolarHBondContact O-N 3.16Å; V151-L155 HydrophobicContact CG1-CD1 3.54Å; V151-L155 HydrophobicContact CG1-CG 4.1Å; V151-L155 WeakPolarHBondContact O-CB 3.37Å; V151-L155 VanDerWaalsContact O-CG 3.26Å; V151-L155 WeakPolarHBondContact O-CG 3.4Å; V151-L155 PolarHBondContact O-N 3.23Å; V151-P195 HydrophobicContact CG1-CG 4.32Å; V151-P195 HydrophobicContact CG2-CB 3.86Å; V151-P195 HydrophobicContact CG2-CG 4.37Å
152S95.6Very high95.2Very high74 Ų7437.1 Ų37.152%0.51721%0.209SC..Hα-helixtrans-62.1-47.8-178.964.60000112.7N150 T156N150-S152 PolarHBondContact ND2-OG 3.07Å; N150-S152 PolarHBondContact O-N 3.48Å; N150-S152 PolarHBondContact OD1-N 3.43Å; N150-S152 VanDerWaalsContact OD1-N 3.16Å; N150-S152 PolarHBondContact OD1-OG 2.65Å; S152-T156 VanDerWaalsContact O-CG2 3.29Å; S152-T156 WeakPolarHBondContact O-CG2 3.4Å; S152-T156 PolarHBondContact O-N 2.86Å; S152-T156 VanDerWaalsContact O-N 3.11Å; S152-T156 PolarHBondContact O-OG1 3.23Å; S152-T156 VanDerWaalsContact O-OG1 3.08Å
153L96.6Very high95.3Very high42 Ų4239.6 Ų39.622%0.2222%0.221CC..Hα-helixtrans-69.4-40.9179.5-175.6133.1000111L96 M99 N150 L155 T156 L157L96-L153 HydrophobicContact CD2-CB 4.33Å; L96-L153 HydrophobicContact CD2-CD1 3.76Å; L96-L153 HydrophobicContact CD2-CG 4.43Å; M99-L153 HydrophobicContact CB-CD2 3.92Å; M99-L153 HydrophobicContact CE-CB 4.47Å; M99-L153 HydrophobicContact CE-CD2 3.92Å; M99-L153 HydrophobicContact CG-CD2 4.49Å; M99-L153 HydrophobicContact SD-CD2 3.81Å; N150-L153 PolarHBondContact O-N 2.95Å; L153-L155 PolarHBondContact O-N 3.23Å; L153-T156 WeakPolarHBondContact CA-OG1 3.28Å; L153-T156 PolarHBondContact O-N 3.14Å; L153-T156 PolarHBondContact O-OG1 3.4Å; L153-L157 HydrophobicContact CD2-CD1 3.61Å; L153-L157 HydrophobicContact CD2-CG 4.28Å; L153-L157 HydrophobicContact CG-CD1 4.41Å; L153-L157 WeakPolarHBondContact O-CG 3.48Å; L153-L157 PolarHBondContact O-N 3.12Å
154L96.9Very high95.5Very high3 Ų336.4 Ų36.42%0.01621%0.214CC..Hα-helixtrans-64.2-43.4179.9-171.267.3000112.1M99 M142 L149 N150 V151 L157 S158 M191 L194 P195M99-L154 HydrophobicContact SD-CB 4.32Å; M142-L154 HydrophobicContact CE-CD1 3.88Å; L149-L154 HydrophobicContact CD1-CD2 3.94Å; N150-L154 PolarHBondContact O-N 3.36Å; V151-L154 PolarHBondContact O-N 3.16Å; L154-L157 PolarHBondContact O-N 3.36Å; L154-S158 PolarHBondContact O-N 3.32Å; L154-S158 PolarHBondContact O-OG 3.37Å; L154-M191 HydrophobicContact CD1-CB 4.1Å; L154-M191 HydrophobicContact CD1-SD 4.48Å; L154-M191 WeakPolarHBondContact CD2-O 3.46Å; L154-L194 HydrophobicContact CD2-CB 4.12Å; L154-P195 HydrophobicContact CD2-CG 4.13Å
155L97.3Very high95.6Very high16 Ų1633.2 Ų33.28%0.08420%0.199CC..Hα-helixtrans-67.2-36.6178.6-72.2174.1000112.7V151 L153 S158 I159 A192 F270 I278V151-L155 HydrophobicContact CG1-CD1 3.54Å; V151-L155 HydrophobicContact CG1-CG 4.1Å; V151-L155 WeakPolarHBondContact O-CB 3.37Å; V151-L155 VanDerWaalsContact O-CG 3.26Å; V151-L155 WeakPolarHBondContact O-CG 3.4Å; V151-L155 PolarHBondContact O-N 3.23Å; L153-L155 PolarHBondContact O-N 3.23Å; L155-S158 VanDerWaalsContact CA-OG 3.27Å; L155-S158 WeakPolarHBondContact CA-OG 3.39Å; L155-S158 PolarHBondContact O-N 2.94Å; L155-S158 PolarHBondContact O-OG 2.79Å; L155-I159 VanDerWaalsContact O-CG1 3.31Å; L155-I159 WeakPolarHBondContact O-CG1 3.31Å; L155-I159 PolarHBondContact O-N 3.18Å; L155-A192 HydrophobicContact CD2-CB 4.4Å; L155-F270 HydrophobicContact CD2-CE1 4.19Å; L155-F270 HydrophobicContact CD2-CZ 4.3Å; L155-I278 HydrophobicContact CD1-CD1 3.69Å; L155-I278 HydrophobicContact CD2-CG2 4.43Å
156T97.8Very high95.7Very high75 Ų7533 Ų3346%0.4620%0.198SC..Hα-helixtrans-64.1-45.8174.550.90000111.2S152 L153 S158 I159 L160S152-T156 VanDerWaalsContact O-CG2 3.29Å; S152-T156 WeakPolarHBondContact O-CG2 3.4Å; S152-T156 PolarHBondContact O-N 2.86Å; S152-T156 VanDerWaalsContact O-N 3.11Å; S152-T156 PolarHBondContact O-OG1 3.23Å; S152-T156 VanDerWaalsContact O-OG1 3.08Å; L153-T156 WeakPolarHBondContact CA-OG1 3.28Å; L153-T156 PolarHBondContact O-N 3.14Å; L153-T156 PolarHBondContact O-OG1 3.4Å; T156-S158 VanDerWaalsContact C-N 3.35Å; T156-S158 PolarHBondContact O-N 2.95Å; T156-I159 PolarHBondContact O-N 3.02Å; T156-L160 VanDerWaalsContact O-CB 3.28Å; T156-L160 WeakPolarHBondContact O-CB 3.13Å; T156-L160 WeakPolarHBondContact O-CD1 3.44Å; T156-L160 VanDerWaalsContact O-CG 3.25Å; T156-L160 WeakPolarHBondContact O-CG 3.29Å; T156-L160 PolarHBondContact O-N 3.36Å
157L98.1Very high95.9Very high13 Ų1339.4 Ų39.47%0.06822%0.22CC..Hα-helixtrans-61-41.5174.3-66.8176.8000112A103 A109 L153 L154 S161A103-L157 HydrophobicContact CB-CD1 4.04Å; A109-L157 VanDerWaalsContact O-CD2 3.24Å; A109-L157 WeakPolarHBondContact O-CD2 3.24Å; L153-L157 HydrophobicContact CD2-CD1 3.61Å; L153-L157 HydrophobicContact CD2-CG 4.28Å; L153-L157 HydrophobicContact CG-CD1 4.41Å; L153-L157 WeakPolarHBondContact O-CG 3.48Å; L153-L157 PolarHBondContact O-N 3.12Å; L154-L157 PolarHBondContact O-N 3.36Å; L157-S161 WeakPolarHBondContact O-CB 3.03Å; L157-S161 PolarHBondContact O-N 3.14Å; L157-S161 PolarHBondContact O-OG 3.11Å
158S98Very high96.2Very high0 Ų034.7 Ų34.70%019%0.193CC..Hα-helixtrans-65-46.7179.362.10000112.2L154 L155 T156 S161 I162 G188L154-S158 PolarHBondContact O-N 3.32Å; L154-S158 PolarHBondContact O-OG 3.37Å; L155-S158 VanDerWaalsContact CA-OG 3.27Å; L155-S158 WeakPolarHBondContact CA-OG 3.39Å; L155-S158 PolarHBondContact O-N 2.94Å; L155-S158 PolarHBondContact O-OG 2.79Å; T156-S158 VanDerWaalsContact C-N 3.35Å; T156-S158 PolarHBondContact O-N 2.95Å; S158-S161 PolarHBondContact O-N 2.91Å; S158-S161 PolarHBondContact O-OG 3.41Å; S158-I162 WeakPolarHBondContact O-CG1 3.42Å; S158-I162 PolarHBondContact O-N 3.49Å; S158-G188 VanDerWaalsContact CB-O 3.24Å; S158-G188 WeakPolarHBondContact CB-O 2.96Å
159I98.2Very high96.5Very high31 Ų3133.2 Ų33.216%0.15918%0.183CC..Hα-helixtrans-65.1-44.7178.8-66.4167.1000110.3L155 T156 S161 I162 M163 I278 I281 M282L155-I159 VanDerWaalsContact O-CG1 3.31Å; L155-I159 WeakPolarHBondContact O-CG1 3.31Å; L155-I159 PolarHBondContact O-N 3.18Å; T156-I159 PolarHBondContact O-N 3.02Å; I159-S161 VanDerWaalsContact C-N 3.26Å; I159-S161 PolarHBondContact O-N 3.34Å; I159-I162 PolarHBondContact O-N 3.21Å; I159-M163 HydrophobicContact CG2-CE 3.74Å; I159-M163 HydrophobicContact CG2-CG 4.44Å; I159-M163 HydrophobicContact CG2-SD 4.17Å; I159-M163 WeakPolarHBondContact O-CB 3.34Å; I159-M163 WeakPolarHBondContact O-CG 3.36Å; I159-M163 PolarHBondContact O-N 2.91Å; I159-I278 HydrophobicContact CD1-CG2 4.29Å; I159-I281 HydrophobicContact CG2-CG2 4.33Å; I159-M282 HydrophobicContact CG1-CG 4.45Å
160L98.3Very high96.7Very high85 Ų8535 Ų3545%0.44519%0.192SC..Hα-helixtrans-58.5-38.3175.8-77.5168.2000112A109 T156 M163 A164A109-L160 HydrophobicContact CB-CB 3.94Å; T156-L160 VanDerWaalsContact O-CB 3.28Å; T156-L160 WeakPolarHBondContact O-CB 3.13Å; T156-L160 WeakPolarHBondContact O-CD1 3.44Å; T156-L160 VanDerWaalsContact O-CG 3.25Å; T156-L160 WeakPolarHBondContact O-CG 3.29Å; T156-L160 PolarHBondContact O-N 3.36Å; L160-M163 WeakPolarHBondContact O-CB 3.31Å; L160-M163 PolarHBondContact O-N 3.42Å; L160-A164 VanDerWaalsContact O-CB 3.3Å; L160-A164 WeakPolarHBondContact O-CB 3.43Å; L160-A164 PolarHBondContact O-N 3.25Å
161S98.2Very high96.8Very high0 Ų039.2 Ų39.20%022%0.215CC..Hα-helixtrans-69.5-38.9177.770.80000112.8L157 S158 I159 M163 A164 G165 I184 G188L157-S161 WeakPolarHBondContact O-CB 3.03Å; L157-S161 PolarHBondContact O-N 3.14Å; L157-S161 PolarHBondContact O-OG 3.11Å; S158-S161 PolarHBondContact O-N 2.91Å; S158-S161 PolarHBondContact O-OG 3.41Å; I159-S161 VanDerWaalsContact C-N 3.26Å; I159-S161 PolarHBondContact O-N 3.34Å; S161-M163 VanDerWaalsContact C-N 3.33Å; S161-A164 PolarHBondContact O-N 2.91Å; S161-G165 PolarHBondContact O-N 3.01Å; S161-I184 WeakPolarHBondContact O-CG2 3.4Å; S161-G188 WeakPolarHBondContact OG-CA 3.32Å; S161-G188 PolarHBondContact OG-N 3.44Å
162I98.3Very high96.8Very high1 Ų138.6 Ų38.61%0.00521%0.208CC..Hα-helixtrans-64.1-43174.5-66.3165.8000109.9S158 I159 S166 W189 M282 I285 T286S158-I162 WeakPolarHBondContact O-CG1 3.42Å; S158-I162 PolarHBondContact O-N 3.49Å; I159-I162 PolarHBondContact O-N 3.21Å; I162-S166 VanDerWaalsContact O-CB 3.23Å; I162-S166 WeakPolarHBondContact O-CB 3.29Å; I162-S166 PolarHBondContact O-N 3.36Å; I162-S166 PolarHBondContact O-OG 3.49Å; I162-W189 HydrophobicContact CD1-CG 4.17Å; I162-M282 HydrophobicContact CD1-CB 4.08Å; I162-M282 HydrophobicContact CD1-CE 3.51Å; I162-M282 HydrophobicContact CD1-CG 3.7Å; I162-M282 HydrophobicContact CD1-SD 4.26Å; I162-I285 HydrophobicContact CG2-CB 4.07Å; I162-I285 HydrophobicContact CG2-CG2 3.77Å; I162-T286 HydrophobicContact CG2-CG2 4.07Å
163M98.1Very high96.8Very high55 Ų5538.4 Ų38.427%0.27120%0.204SC..Hα-helixtrans-58.3-56.1173.7-78.1-176.1177.900112.1I159 L160 S161 G165 S166 W167 I285I159-M163 HydrophobicContact CG2-CE 3.74Å; I159-M163 HydrophobicContact CG2-CG 4.44Å; I159-M163 HydrophobicContact CG2-SD 4.17Å; I159-M163 WeakPolarHBondContact O-CB 3.34Å; I159-M163 WeakPolarHBondContact O-CG 3.36Å; I159-M163 PolarHBondContact O-N 2.91Å; L160-M163 WeakPolarHBondContact O-CB 3.31Å; L160-M163 PolarHBondContact O-N 3.42Å; S161-M163 VanDerWaalsContact C-N 3.33Å; M163-G165 PolarHBondContact O-N 3Å; M163-S166 PolarHBondContact O-N 3.39Å; M163-W167 HydrophobicContact CB-CE3 3.77Å; M163-W167 HydrophobicContact CB-CZ3 3.43Å; M163-W167 VanDerWaalsContact CB-CZ3 3.43Å; M163-W167 HydrophobicContact CG-CE3 4.25Å; M163-W167 HydrophobicContact CG-CH2 4.09Å; M163-W167 HydrophobicContact CG-CZ3 3.43Å; M163-W167 VanDerWaalsContact CG-CZ3 3.43Å; M163-W167 PolarHBondContact O-N 3.03Å; M163-W167 HydrophobicContact SD-CH2 4.43Å; M163-W167 HydrophobicContact SD-CZ3 3.93Å; M163-I285 HydrophobicContact CE-CD1 3.63Å; M163-I285 HydrophobicContact CG-CD1 3.72Å
164A97.9Very high96.8Very high22 Ų2238.7 Ų38.718%0.18221%0.205CC..Hα-helixtrans-61.1-43-176.800000112.6A109 H112 L160 S161 G168A109-A164 HydrophobicContact CB-CB 4.06Å; H112-A164 WeakPolarHBondContact NE2-CB 3.45Å; L160-A164 VanDerWaalsContact O-CB 3.3Å; L160-A164 WeakPolarHBondContact O-CB 3.43Å; L160-A164 PolarHBondContact O-N 3.25Å; S161-A164 PolarHBondContact O-N 2.91Å; A164-G168 WeakPolarHBondContact O-CA 3.38Å; A164-G168 PolarHBondContact O-N 3.22Å
165G96.9Very high96.8Very high0 Ų038.8 Ų38.80%021%0.205CC..Hα-helixtrans-67.6-39177.900000112.8S161 M163 G169 T185S161-G165 PolarHBondContact O-N 3.01Å; M163-G165 PolarHBondContact O-N 3Å; G165-G169 PolarHBondContact O-N 3.5Å; G165-G169 VanDerWaalsContact O-N 3.14Å; G165-T185 VanDerWaalsContact C-CG2 3.47Å; G165-T185 VanDerWaalsContact CA-CG2 3.42Å
166S96.3Very high96.7Very high0 Ų039.8 Ų39.80%021%0.207CC..Hα-helixtrans-71.4-45.3-177.6-51.10000113.1I162 M163 N289I162-S166 VanDerWaalsContact O-CB 3.23Å; I162-S166 WeakPolarHBondContact O-CB 3.29Å; I162-S166 PolarHBondContact O-N 3.36Å; I162-S166 PolarHBondContact O-OG 3.49Å; M163-S166 PolarHBondContact O-N 3.39Å; S166-N289 WeakPolarHBondContact CA-OD1 3.49Å; S166-N289 PolarHBondContact OG-ND2 3.44Å; S166-N289 PolarHBondContact OG-OD1 3.41Å
167W96.1Very high96.7Very high144 Ų14438.5 Ų38.555%0.54520%0.196SC..Hα-helixtrans-72.9-38.8175.8-77.4-60.6000112.8M163 G169 L288M163-W167 HydrophobicContact CB-CE3 3.77Å; M163-W167 HydrophobicContact CB-CZ3 3.43Å; M163-W167 VanDerWaalsContact CB-CZ3 3.43Å; M163-W167 HydrophobicContact CG-CE3 4.25Å; M163-W167 HydrophobicContact CG-CH2 4.09Å; M163-W167 HydrophobicContact CG-CZ3 3.43Å; M163-W167 VanDerWaalsContact CG-CZ3 3.43Å; M163-W167 PolarHBondContact O-N 3.03Å; M163-W167 HydrophobicContact SD-CH2 4.43Å; M163-W167 HydrophobicContact SD-CZ3 3.93Å; W167-G169 VanDerWaalsContact C-N 3.31Å; W167-G169 PolarHBondContact O-N 3.22Å; W167-L288 HydrophobicContact CZ2-CD1 4.42Å
168G95.6Very high96.6Very high20 Ų2038.2 Ų38.221%0.20619%0.194CC..Hα-helixtrans-65.1-31.5-179.400000114A164 Y181A164-G168 WeakPolarHBondContact O-CA 3.38Å; A164-G168 PolarHBondContact O-N 3.22Å; G168-Y181 WeakPolarHBondContact O-CE2 3.48Å
169G94.8Very high96.6Very high1 Ų138.5 Ų38.51%0.0120%0.196CC..Hα-helixtrans-68.4-32.6-178.400000114.8G165 W167 N171 Q172G165-G169 PolarHBondContact O-N 3.5Å; G165-G169 VanDerWaalsContact O-N 3.14Å; W167-G169 VanDerWaalsContact C-N 3.31Å; W167-G169 PolarHBondContact O-N 3.22Å; G169-N171 VanDerWaalsContact C-N 3.25Å; G169-N171 PolarHBondContact O-N 2.9Å; G169-Q172 PolarHBondContact O-N 3.35Å
170L94Very high96.5Very high48 Ų4837 Ų3725%0.25119%0.188SC..THydrogen-bonded Turntrans-60.3-31.7-172.6-70.1164.7000114L288 Y291 F292 R295L170-L288 HydrophobicContact CD1-CD2 4.41Å; L170-Y291 HydrophobicContact CD2-CD1 3.62Å; L170-Y291 HydrophobicContact CD2-CE1 4.17Å; L170-F292 HydrophobicContact CD2-CB 4.09Å; L170-F292 HydrophobicContact CD2-CD1 4.46Å; L170-R295 PolarHBondContact O-NH1 3.4Å
171N95.8Very high96.5Very high137 Ų13734.5 Ų34.573%0.73317%0.173SC*.THydrogen-bonded Turntrans-89.4-4.8-172.9-162.414.4000113.6G169G169-N171 VanDerWaalsContact C-N 3.25Å; G169-N171 PolarHBondContact O-N 2.9Å
172Q95.2Very high96.4Very high43 Ų4334.5 Ų34.520%0.20117%0.173CC..  trans-98.9138.4-171.3-57-60.3-28.700112.5G169 K177 I178 Y181G169-Q172 PolarHBondContact O-N 3.35Å; Q172-K177 HydrophobicContact CB-CB 4.11Å; Q172-K177 HydrophobicContact CG-CB 4Å; Q172-K177 HydrophobicContact CG-CD 4.2Å; Q172-I178 HydrophobicContact CB-CG1 4.07Å; Q172-I178 WeakPolarHBondContact O-CD1 3.23Å; Q172-Y181 HydrophobicContact CG-CD2 4.11Å; Q172-Y181 HydrophobicContact CG-CE2 3.77Å
173T94.9Very high96.4Very high70 Ų7034.5 Ų34.543%0.42917%0.173SC..  trans-108.2-8.6170.358.10000112.8T227T173-T227 WeakPolarHBondContact O-CG2 3.48Å; T173-T227 PolarHBondContact O-N 2.88Å
174Q96.5Very high96.4Very high49 Ų4932 Ų3223%0.22916%0.16CC..BIsolated β-bridgetrans-83.7119.3177.1-63.3-68-36.900109R176 K177 I178Q174-R176 VanDerWaalsContact C-N 3.26Å; Q174-R176 PolarHBondContact O-N 3.47Å; Q174-K177 HydrophobicContact CB-CB 4.28Å; Q174-K177 HydrophobicContact CB-CD 4.39Å; Q174-K177 HydrophobicContact CB-CG 4.22Å; Q174-K177 PolarHBondContact O-N 3.22Å; Q174-I178 WeakPolarHBondContact O-CG1 3.44Å; Q174-I178 PolarHBondContact O-N 3.26Å
175L96.1Very high96.4Very high5 Ų531.1 Ų31.13%0.02615%0.153CC..Hα-helixtrans-61.5-35.7-172.3-61170.3000112.1K177 I178 L179 L219 T225 T227 L230 L296L175-K177 VanDerWaalsContact C-N 3.35Å; L175-K177 PolarHBondContact O-N 3.01Å; L175-I178 HydrophobicContact CD2-CD1 4.43Å; L175-I178 PolarHBondContact O-N 3.32Å; L175-L179 WeakPolarHBondContact O-CG 3.41Å; L175-L179 PolarHBondContact O-N 3.16Å; L175-L219 HydrophobicContact CB-CD1 4.24Å; L175-L219 HydrophobicContact CB-CD2 4.25Å; L175-L219 HydrophobicContact CD1-CD2 3.42Å; L175-L219 VanDerWaalsContact CD1-CD2 3.42Å; L175-L219 HydrophobicContact CG-CD2 4.36Å; L175-T225 WeakPolarHBondContact CB-O 3.27Å; L175-T225 PolarHBondContact N-O 2.66Å; L175-T227 HydrophobicContact CD2-CG2 4.16Å; L175-L230 HydrophobicContact CD1-CB 4.04Å; L175-L230 HydrophobicContact CD1-CD1 4.19Å; L175-L230 HydrophobicContact CD1-CD2 3.98Å; L175-L230 HydrophobicContact CD1-CG 4.32Å; L175-L230 HydrophobicContact CD2-CD2 3.78Å; L175-L296 HydrophobicContact CD2-CD1 3.67Å; L175-L296 HydrophobicContact CD2-CG 4.35Å
176R96.2Very high96.5Very high36 Ų3631.5 Ų31.514%0.13616%0.155CC..Hα-helixtrans-65.7-36.8177-65.3177.8-65.2-124.5-5112.6T119 Q120 L124 Q174 A180 T225T119-R176 WeakPolarHBondContact O-CD 3.36Å; Q120-R176 PolarHBondContact O-NE 3.44Å; Q120-R176 PolarHBondContact O-NH2 3.3Å; Q120-R176 VanDerWaalsContact OE1-NE 3.08Å; L124-R176 HydrophobicContact CD2-CG 3.74Å; Q174-R176 VanDerWaalsContact C-N 3.26Å; Q174-R176 PolarHBondContact O-N 3.47Å; R176-A180 WeakPolarHBondContact O-CB 3.46Å; R176-A180 PolarHBondContact O-N 3.39Å; R176-T225 VanDerWaalsContact NH1-CG2 3.26Å
177K96.9Very high96.5Very high48 Ų4831.6 Ų31.621%0.20916%0.155CC..Hα-helixtrans-70.8-38.4175-71.3-170.5171.5-169.40111.7P116 Q120 Q172 Q174 L175 L179 A180 Y181P116-K177 HydrophobicContact CB-CG 4.33Å; Q120-K177 HydrophobicContact CB-CG 4.06Å; Q120-K177 HydrophobicContact CG-CG 4.37Å; Q172-K177 HydrophobicContact CB-CB 4.11Å; Q172-K177 HydrophobicContact CG-CB 4Å; Q172-K177 HydrophobicContact CG-CD 4.2Å; Q174-K177 HydrophobicContact CB-CB 4.28Å; Q174-K177 HydrophobicContact CB-CD 4.39Å; Q174-K177 HydrophobicContact CB-CG 4.22Å; Q174-K177 PolarHBondContact O-N 3.22Å; L175-K177 VanDerWaalsContact C-N 3.35Å; L175-K177 PolarHBondContact O-N 3.01Å; K177-L179 VanDerWaalsContact C-N 3.34Å; K177-A180 WeakPolarHBondContact O-CB 3.28Å; K177-A180 PolarHBondContact O-N 3.02Å; K177-A180 VanDerWaalsContact O-N 3.17Å; K177-Y181 WeakPolarHBondContact O-CD2 3.26Å; K177-Y181 PolarHBondContact O-N 2.89Å
178I96.8Very high96.6Very high7 Ų724.7 Ų24.74%0.03613%0.129CC..Hα-helixtrans-59.3-47.9174.5-64172.7000109.9Q172 Q174 L175 A180 Y181 S182 F292 Y293 L296Q172-I178 HydrophobicContact CB-CG1 4.07Å; Q172-I178 WeakPolarHBondContact O-CD1 3.23Å; Q174-I178 WeakPolarHBondContact O-CG1 3.44Å; Q174-I178 PolarHBondContact O-N 3.26Å; L175-I178 HydrophobicContact CD2-CD1 4.43Å; L175-I178 PolarHBondContact O-N 3.32Å; I178-A180 VanDerWaalsContact C-N 3.3Å; I178-A180 PolarHBondContact O-N 3.26Å; I178-Y181 PolarHBondContact O-N 3.4Å; I178-S182 PolarHBondContact O-N 3.41Å; I178-F292 HydrophobicContact CG2-CD2 3.81Å; I178-F292 HydrophobicContact CG2-CE2 3.46Å; I178-F292 VanDerWaalsContact CG2-CE2 3.46Å; I178-F292 HydrophobicContact CG2-CZ 4.45Å; I178-Y293 HydrophobicContact CG2-CE1 4.23Å; I178-L296 HydrophobicContact CD1-CD1 4.01Å
179L96.7Very high96.7Very high7 Ų724 Ų244%0.03712%0.12CC..Hα-helixtrans-66.2-29.3175.2-68176.8000113.5L175 K177 S182 S183 A215 F216 L219 L251L175-L179 WeakPolarHBondContact O-CG 3.41Å; L175-L179 PolarHBondContact O-N 3.16Å; K177-L179 VanDerWaalsContact C-N 3.34Å; L179-S182 WeakPolarHBondContact CA-OG 3.4Å; L179-S182 PolarHBondContact O-OG 2.89Å; L179-S183 PolarHBondContact O-N 2.87Å; L179-A215 HydrophobicContact CD1-CB 4.36Å; L179-A215 HydrophobicContact CD2-CB 4.07Å; L179-F216 HydrophobicContact CB-CZ 4.37Å; L179-F216 HydrophobicContact CD1-CD1 4.37Å; L179-F216 HydrophobicContact CD1-CD2 4.29Å; L179-F216 HydrophobicContact CD1-CE1 4.07Å; L179-F216 HydrophobicContact CD1-CE2 3.99Å; L179-F216 HydrophobicContact CD1-CG 4.47Å; L179-F216 HydrophobicContact CD1-CZ 3.87Å; L179-L219 HydrophobicContact CD1-CD1 3.57Å; L179-L251 HydrophobicContact CD2-CD1 4.26Å
180A97.5Very high96.9Very high0 Ų024 Ų240%012%0.12CC..Hα-helixtrans-67.4-46.3172.900000111.4V115 T119 R176 K177 I178 S182 S183 I184V115-A180 HydrophobicContact CG1-CB 4.12Å; T119-A180 HydrophobicContact CG2-CB 4.01Å; T119-A180 WeakPolarHBondContact OG1-CB 3.42Å; R176-A180 WeakPolarHBondContact O-CB 3.46Å; R176-A180 PolarHBondContact O-N 3.39Å; K177-A180 WeakPolarHBondContact O-CB 3.28Å; K177-A180 PolarHBondContact O-N 3.02Å; K177-A180 VanDerWaalsContact O-N 3.17Å; I178-A180 VanDerWaalsContact C-N 3.3Å; I178-A180 PolarHBondContact O-N 3.26Å; A180-S182 VanDerWaalsContact C-N 3.34Å; A180-S182 PolarHBondContact O-N 3.02Å; A180-S183 WeakPolarHBondContact O-CB 3.44Å; A180-S183 PolarHBondContact O-N 3.38Å; A180-S183 VanDerWaalsContact O-N 3.16Å; A180-S183 PolarHBondContact O-OG 3.41Å; A180-I184 WeakPolarHBondContact O-CG1 3.45Å; A180-I184 PolarHBondContact O-N 3.31Å; A180-I184 VanDerWaalsContact O-N 3.12Å
181Y97.9Very high97Very high32 Ų3221.8 Ų21.813%0.12511%0.109CC..Hα-helixtrans-66.8-36177.6-76.2-63.2000112.5P116 G168 Q172 K177 I178 S183 I184 T185P116-Y181 HydrophobicContact CB-CE2 4.23Å; P116-Y181 HydrophobicContact CG-CD1 4.45Å; P116-Y181 HydrophobicContact CG-CE1 3.85Å; P116-Y181 HydrophobicContact CG-CE2 4.01Å; G168-Y181 WeakPolarHBondContact O-CE2 3.48Å; Q172-Y181 HydrophobicContact CG-CD2 4.11Å; Q172-Y181 HydrophobicContact CG-CE2 3.77Å; K177-Y181 WeakPolarHBondContact O-CD2 3.26Å; K177-Y181 PolarHBondContact O-N 2.89Å; I178-Y181 PolarHBondContact O-N 3.4Å; Y181-S183 VanDerWaalsContact C-N 3.33Å; Y181-S183 PolarHBondContact O-N 2.85Å; Y181-I184 HydrophobicContact CD1-CD1 3.86Å; Y181-I184 HydrophobicContact CE1-CD1 4.3Å; Y181-I184 PolarHBondContact O-N 3.05Å; Y181-T185 PolarHBondContact O-N 2.65Å
182S96.8Very high97.1Very high0 Ų015.3 Ų15.30%07%0.074CC..Hα-helixtrans-63.5-38.7170.672.80000112.6I178 L179 A180 I184 T185 H186 Y293I178-S182 PolarHBondContact O-N 3.41Å; L179-S182 WeakPolarHBondContact CA-OG 3.4Å; L179-S182 PolarHBondContact O-OG 2.89Å; A180-S182 VanDerWaalsContact C-N 3.34Å; A180-S182 PolarHBondContact O-N 3.02Å; S182-I184 VanDerWaalsContact C-N 3.27Å; S182-I184 PolarHBondContact O-N 2.94Å; S182-T185 PolarHBondContact O-N 3.14Å; S182-T185 PolarHBondContact O-OG1 2.97Å; S182-H186 PolarHBondContact O-CD2 2.91Å; S182-H186 PolarHBondContact O-N 2.84Å; S182-Y293 WeakPolarHBondContact CB-OH 3.45Å
183S97.4Very high97.2Very high1 Ų113.3 Ų13.31%0.0076%0.064CC..Hα-helixtrans-58.3-40.7173.778.40000112.2L131 L179 A180 Y181 T185 H186 M187 Y208L131-S183 WeakPolarHBondContact CD2-OG 3.3Å; L179-S183 PolarHBondContact O-N 2.87Å; A180-S183 WeakPolarHBondContact O-CB 3.44Å; A180-S183 PolarHBondContact O-N 3.38Å; A180-S183 VanDerWaalsContact O-N 3.16Å; A180-S183 PolarHBondContact O-OG 3.41Å; Y181-S183 VanDerWaalsContact C-N 3.33Å; Y181-S183 PolarHBondContact O-N 2.85Å; S183-T185 PolarHBondContact O-N 3.22Å; S183-H186 PolarHBondContact O-N 3.03Å; S183-M187 WeakPolarHBondContact O-CB 3.36Å; S183-M187 VanDerWaalsContact O-CG 3.24Å; S183-M187 WeakPolarHBondContact O-CG 3.28Å; S183-M187 PolarHBondContact O-N 3.38Å; S183-Y208 WeakPolarHBondContact CA-OH 3.45Å; S183-Y208 WeakPolarHBondContact CB-OH 3.38Å
184I98.3Very high97.3Very high1 Ų110 Ų101%0.0054%0.044CC..Hα-helixtrans-64.4-41.5179.8-63.9160.3000110.5H112 V115 S161 A180 Y181 S182 M187 G188H112-I184 HydrophobicContact CB-CD1 3.8Å; H112-I184 HydrophobicContact CB-CG1 4.17Å; H112-I184 HydrophobicContact CB-CG2 4.12Å; V115-I184 HydrophobicContact CB-CD1 4.27Å; V115-I184 HydrophobicContact CB-CG1 4.48Å; S161-I184 WeakPolarHBondContact O-CG2 3.4Å; A180-I184 WeakPolarHBondContact O-CG1 3.45Å; A180-I184 PolarHBondContact O-N 3.31Å; A180-I184 VanDerWaalsContact O-N 3.12Å; Y181-I184 HydrophobicContact CD1-CD1 3.86Å; Y181-I184 HydrophobicContact CE1-CD1 4.3Å; Y181-I184 PolarHBondContact O-N 3.05Å; S182-I184 VanDerWaalsContact C-N 3.27Å; S182-I184 PolarHBondContact O-N 2.94Å; I184-M187 PolarHBondContact O-N 2.97Å; I184-G188 PolarHBondContact O-N 3.45Å; I184-G188 VanDerWaalsContact O-N 3.13Å
185T97.9Very high97.1Very high4 Ų49.2 Ų9.23%0.0254%0.043CC..Hα-helixtrans-69.8-42.4178.7630000112.2G165 Y181 S182 S183 M187 G188 W189 N289G165-T185 VanDerWaalsContact C-CG2 3.47Å; G165-T185 VanDerWaalsContact CA-CG2 3.42Å; Y181-T185 PolarHBondContact O-N 2.65Å; S182-T185 PolarHBondContact O-N 3.14Å; S182-T185 PolarHBondContact O-OG1 2.97Å; S183-T185 PolarHBondContact O-N 3.22Å; T185-M187 VanDerWaalsContact C-N 3.33Å; T185-M187 PolarHBondContact O-N 3.48Å; T185-G188 WeakPolarHBondContact O-CA 3.45Å; T185-G188 PolarHBondContact O-N 2.96Å; T185-G188 VanDerWaalsContact O-N 3.08Å; T185-W189 PolarHBondContact O-N 3.19Å; T185-W189 VanDerWaalsContact O-N 3.1Å; T185-N289 WeakPolarHBondContact CG2-ND2 3.17Å; T185-N289 PolarHBondContact OG1-ND2 3.43Å
186H97.9Very high97Very high9 Ų912.2 Ų12.24%0.0426%0.055CC..Hα-helixtrans-61.1-40.8174.7-79-74000112.2S182 S183 G188 W189 M190 Y208 L251S182-H186 PolarHBondContact O-CD2 2.91Å; S182-H186 PolarHBondContact O-N 2.84Å; S183-H186 PolarHBondContact O-N 3.03Å; H186-G188 PolarHBondContact O-N 3.31Å; H186-W189 PolarHBondContact O-N 3.43Å; H186-M190 HydrophobicContact CB-CE 4.18Å; H186-M190 VanDerWaalsContact O-CG 3.31Å; H186-M190 WeakPolarHBondContact O-CG 3.24Å; H186-M190 PolarHBondContact O-N 3.47Å; H186-Y208 HydrophobicContact CB-CD2 3.61Å; H186-Y208 HydrophobicContact CB-CE2 3.83Å; H186-Y208 HydrophobicContact CB-CG 4.35Å; H186-Y208 AromaticContact CD2-CD2 3.7Å; H186-Y208 AromaticContact CD2-CE2 3.85Å; H186-Y208 AromaticContact CG-CD2 3.55Å; H186-Y208 AromaticContact CG-CE2 3.97Å; H186-L251 PolarHBondContact CE1-O 3.4Å; H186-L251 PolarHBondContact NE2-O 3.29Å
187M97.9Very high97Very high1 Ų112.2 Ų12.21%0.0056%0.058CC..Hα-helixtrans-59.7-36.1173.3-73.1-52.3-46.100112.2L106 M108 K135 I139 S183 I184 T185 M190 M191L106-M187 HydrophobicContact CB-CE 3.94Å; L106-M187 HydrophobicContact CD1-CE 3.79Å; L106-M187 HydrophobicContact CD2-CE 3.65Å; L106-M187 HydrophobicContact CD2-SD 4.46Å; L106-M187 HydrophobicContact CG-CE 4.01Å; M108-M187 HydrophobicContact CE-CB 4.41Å; M108-M187 HydrophobicContact CE-CE 3.62Å; K135-M187 HydrophobicContact CB-SD 4.48Å; K135-M187 HydrophobicContact CD-CG 4.48Å; K135-M187 HydrophobicContact CD-SD 3.72Å; K135-M187 HydrophobicContact CG-SD 4.11Å; I139-M187 HydrophobicContact CD1-CE 3.8Å; I139-M187 HydrophobicContact CD1-SD 4.33Å; I139-M187 HydrophobicContact CG1-CE 4.32Å; S183-M187 WeakPolarHBondContact O-CB 3.36Å; S183-M187 VanDerWaalsContact O-CG 3.24Å; S183-M187 WeakPolarHBondContact O-CG 3.28Å; S183-M187 PolarHBondContact O-N 3.38Å; I184-M187 PolarHBondContact O-N 2.97Å; T185-M187 VanDerWaalsContact C-N 3.33Å; T185-M187 PolarHBondContact O-N 3.48Å; M187-M190 HydrophobicContact CE-SD 4.45Å; M187-M190 PolarHBondContact O-N 2.93Å; M187-M190 HydrophobicContact SD-SD 3.97Å; M187-M191 HydrophobicContact CE-CE 3.8Å; M187-M191 WeakPolarHBondContact O-CG 3.41Å; M187-M191 PolarHBondContact O-N 2.93Å; M187-M191 VanDerWaalsContact O-N 3.09Å
188G97.6Very high96.9Very high0 Ų011.1 Ų11.10%06%0.055CC..Hα-helixtrans-61.2-49.8172.600000113.1S158 S161 I184 T185 H186 M190 M191 A192S158-G188 VanDerWaalsContact CB-O 3.24Å; S158-G188 WeakPolarHBondContact CB-O 2.96Å; S161-G188 WeakPolarHBondContact OG-CA 3.32Å; S161-G188 PolarHBondContact OG-N 3.44Å; I184-G188 PolarHBondContact O-N 3.45Å; I184-G188 VanDerWaalsContact O-N 3.13Å; T185-G188 WeakPolarHBondContact O-CA 3.45Å; T185-G188 PolarHBondContact O-N 2.96Å; T185-G188 VanDerWaalsContact O-N 3.08Å; H186-G188 PolarHBondContact O-N 3.31Å; G188-M190 VanDerWaalsContact C-N 3.31Å; G188-M190 PolarHBondContact O-N 2.92Å; G188-M191 PolarHBondContact O-N 3.22Å; G188-A192 WeakPolarHBondContact O-CB 3.48Å; G188-A192 PolarHBondContact O-N 3.03Å
189W98Very high96.8Very high4 Ų413.4 Ų13.42%0.0157%0.067CC..Hα-helixtrans-60.7-39.9176.3-8083000112.7I162 T185 H186 K263 I266 I267 M282 A283 T286I162-W189 HydrophobicContact CD1-CG 4.17Å; T185-W189 PolarHBondContact O-N 3.19Å; T185-W189 VanDerWaalsContact O-N 3.1Å; H186-W189 PolarHBondContact O-N 3.43Å; W189-K263 HydrophobicContact CE3-CG 4.42Å; W189-K263 HydrophobicContact CZ3-CB 4.41Å; W189-I266 HydrophobicContact CB-CD1 4.32Å; W189-I266 HydrophobicContact CE3-CB 4.25Å; W189-I266 HydrophobicContact CE3-CD1 4Å; W189-I266 HydrophobicContact CE3-CG2 3.6Å; W189-I266 HydrophobicContact CZ3-CB 4.37Å; W189-I266 HydrophobicContact CZ3-CG2 3.68Å; W189-I267 HydrophobicContact CZ3-CG1 4.32Å; W189-M282 HydrophobicContact CB-CE 4.5Å; W189-M282 HydrophobicContact CD2-CE 3.53Å; W189-M282 HydrophobicContact CE3-CE 3.55Å; W189-M282 HydrophobicContact CG-CE 4Å; W189-M282 HydrophobicContact CH2-CB 3.83Å; W189-M282 HydrophobicContact CH2-CE 4.3Å; W189-M282 HydrophobicContact CZ2-CB 3.59Å; W189-M282 HydrophobicContact CZ2-CE 4.31Å; W189-M282 HydrophobicContact CZ3-CE 3.94Å; W189-A283 HydrophobicContact CH2-CB 4.49Å; W189-T286 HydrophobicContact CZ2-CG2 3.73Å
190M97.9Very high96.8Very high2 Ų214.2 Ų14.21%0.017%0.071CC..Hα-helixtrans-62.2-46.4178.3-69.9172.4-163.800111.8I139 H186 M187 G188 T201 N204 L205 Y208I139-M190 HydrophobicContact CD1-SD 4.1Å; H186-M190 HydrophobicContact CB-CE 4.18Å; H186-M190 VanDerWaalsContact O-CG 3.31Å; H186-M190 WeakPolarHBondContact O-CG 3.24Å; H186-M190 PolarHBondContact O-N 3.47Å; M187-M190 HydrophobicContact CE-SD 4.45Å; M187-M190 PolarHBondContact O-N 2.93Å; M187-M190 HydrophobicContact SD-SD 3.97Å; G188-M190 VanDerWaalsContact C-N 3.31Å; G188-M190 PolarHBondContact O-N 2.92Å; M190-T201 WeakPolarHBondContact O-CB 3.43Å; M190-T201 WeakPolarHBondContact O-CG2 3.24Å; M190-N204 HydrophobicContact CG-CB 3.99Å; M190-N204 WeakPolarHBondContact CG-ND2 3.46Å; M190-L205 HydrophobicContact CE-CB 4.36Å; M190-L205 HydrophobicContact SD-CB 4.15Å; M190-Y208 HydrophobicContact CE-CD1 3.77Å; M190-Y208 HydrophobicContact CE-CD2 4.28Å; M190-Y208 HydrophobicContact CE-CG 3.53Å
191M97.6Very high96.8Very high2 Ų214.3 Ų14.31%0.017%0.072CC..Hα-helixtrans-73.1-29.8-178.3-67.2-65.2127.800113.9L106 M108 I139 M142 L154 M187 G188 V193 L194L106-M191 HydrophobicContact CD1-CE 3.55Å; L106-M191 HydrophobicContact CD1-SD 4.26Å; M108-M191 HydrophobicContact CE-CB 4.31Å; M108-M191 HydrophobicContact CE-CE 3.65Å; M108-M191 HydrophobicContact CE-CG 2.98Å; M108-M191 HydrophobicContact CE-SD 3.46Å; M108-M191 WeakPolarHBondContact CE-SD 3.24Å; M108-M191 HydrophobicContact SD-CB 4.49Å; M108-M191 HydrophobicContact SD-CG 3.57Å; M108-M191 VanDerWaalsContact SD-CG 3.57Å; M108-M191 HydrophobicContact SD-SD 4.3Å; I139-M191 HydrophobicContact CD1-CE 4.17Å; I139-M191 HydrophobicContact CG1-CE 3.63Å; M142-M191 HydrophobicContact CE-SD 4.14Å; M142-M191 HydrophobicContact CG-SD 4.44Å; L154-M191 HydrophobicContact CD1-CB 4.1Å; L154-M191 HydrophobicContact CD1-SD 4.48Å; L154-M191 WeakPolarHBondContact CD2-O 3.46Å; M187-M191 HydrophobicContact CE-CE 3.8Å; M187-M191 WeakPolarHBondContact O-CG 3.41Å; M187-M191 PolarHBondContact O-N 2.93Å; M187-M191 VanDerWaalsContact O-N 3.09Å; G188-M191 PolarHBondContact O-N 3.22Å; M191-V193 PolarHBondContact O-N 2.94Å; M191-L194 HydrophobicContact CE-CD1 3.91Å; M191-L194 HydrophobicContact CG-CD1 4.45Å; M191-L194 PolarHBondContact O-N 3.35Å; M191-L194 HydrophobicContact SD-CD1 3.22Å; M191-L194 WeakPolarHBondContact SD-CD1 3.36Å; M191-L194 HydrophobicContact SD-CG 4.33Å
192A97.4Very high96.7Very high0 Ų014.7 Ų14.70%08%0.076CC..Hα-helixtrans-59-31.6-17700000112.1L155 G188 F270 M282L155-A192 HydrophobicContact CD2-CB 4.4Å; G188-A192 WeakPolarHBondContact O-CB 3.48Å; G188-A192 PolarHBondContact O-N 3.03Å; A192-F270 HydrophobicContact CB-CE2 4.24Å; A192-F270 HydrophobicContact CB-CZ 3.81Å; A192-F270 WeakPolarHBondContact O-CZ 3.42Å; A192-M282 HydrophobicContact CB-CE 3.49Å; A192-M282 VanDerWaalsContact CB-CE 3.49Å; A192-M282 HydrophobicContact CB-SD 3.96Å
193V97.1Very high96.7Very high1 Ų114.9 Ų14.91%0.0068%0.077CC..Hα-helixtrans-95.7-13.5-176-175.50000114.2M191 P195 Y196 N197 M200 T201 I266 E269 F270M191-V193 PolarHBondContact O-N 2.94Å; V193-P195 VanDerWaalsContact C-N 3.34Å; V193-Y196 PolarHBondContact O-N 2.66Å; V193-N197 PolarHBondContact O-N 3.32Å; V193-M200 HydrophobicContact CG1-CB 3.86Å; V193-T201 HydrophobicContact CB-CG2 4.06Å; V193-T201 HydrophobicContact CG1-CG2 4.49Å; V193-I266 HydrophobicContact CB-CG1 4.4Å; V193-I266 HydrophobicContact CG2-CB 3.8Å; V193-I266 HydrophobicContact CG2-CD1 4.21Å; V193-I266 HydrophobicContact CG2-CG1 3.6Å; V193-I266 HydrophobicContact CG2-CG2 3.21Å; V193-E269 HydrophobicContact CG1-CB 4.4Å; V193-F270 HydrophobicContact CG2-CD2 4.2Å; V193-F270 HydrophobicContact CG2-CE2 3.52Å; V193-F270 HydrophobicContact CG2-CZ 4.1Å
194L95.9Very high96.7Very high0 Ų015 Ų150%08%0.077CC..THydrogen-bonded Turntrans-47.8-44.8-179.9-82.4177.5000115.2M142 L154 M191 Y196 P198 T201M142-L194 HydrophobicContact CB-CD1 3.83Å; M142-L194 HydrophobicContact CE-CD1 3.94Å; L154-L194 HydrophobicContact CD2-CB 4.12Å; M191-L194 HydrophobicContact CE-CD1 3.91Å; M191-L194 HydrophobicContact CG-CD1 4.45Å; M191-L194 PolarHBondContact O-N 3.35Å; M191-L194 HydrophobicContact SD-CD1 3.22Å; M191-L194 WeakPolarHBondContact SD-CD1 3.36Å; M191-L194 HydrophobicContact SD-CG 4.33Å; L194-Y196 VanDerWaalsContact C-N 3.25Å; L194-Y196 PolarHBondContact O-N 3.48Å; L194-P198 WeakPolarHBondContact O-CG 3.33Å; L194-T201 HydrophobicContact CB-CG2 4.25Å; L194-T201 HydrophobicContact CD2-CG2 3.62Å; L194-T201 VanDerWaalsContact CD2-OG1 3.32Å; L194-T201 WeakPolarHBondContact CD2-OG1 3.49Å; L194-T201 HydrophobicContact CG-CG2 3.75Å
195P93.8Very high96.7Very high33 Ų3315.6 Ų15.621%0.2148%0.081CC..THydrogen-bonded Turntrans-75.8-16.5-175.729.7-31.7000112.8V151 L154 V193V151-P195 HydrophobicContact CG1-CG 4.32Å; V151-P195 HydrophobicContact CG2-CB 3.86Å; V151-P195 HydrophobicContact CG2-CG 4.37Å; L154-P195 HydrophobicContact CD2-CG 4.13Å; V193-P195 VanDerWaalsContact C-N 3.34Å
196Y93.5Very high96.7Very high69 Ų6918 Ų1827%0.27110%0.095SC..THydrogen-bonded Turntrans-94.2-57.5-178.3-60.7-70.3000111.4V193 L194 F270 N273V193-Y196 PolarHBondContact O-N 2.66Å; L194-Y196 VanDerWaalsContact C-N 3.25Å; L194-Y196 PolarHBondContact O-N 3.48Å; Y196-F270 HydrophobicContact CD2-CD1 4.17Å; Y196-F270 AromaticContact CD2-CE1 3.85Å; Y196-F270 HydrophobicContact CD2-CE1 3.85Å; Y196-F270 HydrophobicContact CD2-CZ 4.37Å; Y196-F270 AromaticContact CE2-CD1 3.76Å; Y196-F270 HydrophobicContact CE2-CD1 3.76Å; Y196-F270 AromaticContact CE2-CE1 3.29Å; Y196-F270 HydrophobicContact CE2-CE1 3.29Å; Y196-F270 HydrophobicContact CE2-CZ 4.11Å; Y196-N273 HydrophobicContact CD1-CB 3.75Å; Y196-N273 VanDerWaalsContact CD1-ND2 3.25Å; Y196-N273 WeakPolarHBondContact CD1-ND2 3.46Å; Y196-N273 HydrophobicContact CE1-CB 3.81Å
197N95.3Very high96.7Very high36 Ų3617.8 Ų17.819%0.1939%0.094CC..  trans-147.299.7178-171.7-9.8000110.2V193 N199 M200 E269V193-N197 PolarHBondContact O-N 3.32Å; N197-N199 PolarHBondContact O-N 3.24Å; N197-N199 VanDerWaalsContact O-N 3.16Å; N197-N199 PolarHBondContact OD1-N 3.19Å; N197-M200 HydrophobicContact CB-CG 4.31Å; N197-M200 PolarHBondContact O-N 3.13Å; N197-E269 HydrophobicContact CB-CG 4.22Å; N197-E269 PolarHBondContact ND2-OE1 2.95Å
198P94.9Very high96.7Very high25 Ų2517.9 Ų17.916%0.1629%0.094CC..Hα-helixtrans-57.2-29.6-179.3-26.935.3000114.2Y143 S146 L194 M200 T201 I202Y143-P198 HydrophobicContact CD2-CB 3.34Å; Y143-P198 HydrophobicContact CE2-CB 3.26Å; Y143-P198 HydrophobicContact CE2-CG 4.47Å; Y143-P198 HydrophobicContact CG-CB 4.31Å; S146-P198 WeakPolarHBondContact OG-CG 3.33Å; L194-P198 WeakPolarHBondContact O-CG 3.33Å; P198-M200 VanDerWaalsContact C-N 3.28Å; P198-M200 PolarHBondContact O-N 3.5Å; P198-T201 WeakPolarHBondContact O-CB 3.34Å; P198-T201 PolarHBondContact O-N 3.14Å; P198-T201 PolarHBondContact O-OG1 2.99Å; P198-I202 PolarHBondContact O-N 2.97Å
199N96.3Very high96.7Very high54 Ų5419.8 Ų19.829%0.28910%0.104SC..Hα-helixtrans-64.2-34-177.3-68.1-3.7000112Y143 N197 T201 I202 L203 L347Y143-N199 PolarHBondContact OH-OD1 3.35Å; Y143-N199 VanDerWaalsContact OH-OD1 3.05Å; N197-N199 PolarHBondContact O-N 3.24Å; N197-N199 VanDerWaalsContact O-N 3.16Å; N197-N199 PolarHBondContact OD1-N 3.19Å; N199-T201 PolarHBondContact O-N 3.1Å; N199-I202 PolarHBondContact O-N 3.34Å; N199-I202 VanDerWaalsContact O-N 3.15Å; N199-L203 PolarHBondContact O-N 3.08Å; N199-L347 WeakPolarHBondContact O-CD1 3.45Å
200M96.1Very high96.7Very high25 Ų2521.2 Ų21.212%0.12311%0.112CC..Hα-helixtrans-67.9-24.4176.5-60.3-45.9167.400112.9V193 N197 P198 L203 N204 V265 E269 L344V193-M200 HydrophobicContact CG1-CB 3.86Å; N197-M200 HydrophobicContact CB-CG 4.31Å; N197-M200 PolarHBondContact O-N 3.13Å; P198-M200 VanDerWaalsContact C-N 3.28Å; P198-M200 PolarHBondContact O-N 3.5Å; M200-L203 HydrophobicContact SD-CD2 4.14Å; M200-N204 PolarHBondContact O-N 3.45Å; M200-V265 HydrophobicContact CE-CG1 3.72Å; M200-V265 HydrophobicContact CG-CG1 3.96Å; M200-V265 HydrophobicContact SD-CB 4.49Å; M200-V265 HydrophobicContact SD-CG1 3.3Å; M200-V265 WeakPolarHBondContact SD-CG1 3.45Å; M200-E269 WeakPolarHBondContact CE-OE1 3.21Å; M200-E269 HydrophobicContact CG-CG 3.81Å; M200-L344 HydrophobicContact CE-CD2 4Å; M200-L344 HydrophobicContact SD-CD2 3.87Å
201T96.6Very high96.6Very high2 Ų221.2 Ų21.21%0.01211%0.112CC..Hα-helixtrans-72.5-37.6174.878.60000111.2M190 V193 L194 P198 N199 N204 L205M190-T201 WeakPolarHBondContact O-CB 3.43Å; M190-T201 WeakPolarHBondContact O-CG2 3.24Å; V193-T201 HydrophobicContact CB-CG2 4.06Å; V193-T201 HydrophobicContact CG1-CG2 4.49Å; L194-T201 HydrophobicContact CB-CG2 4.25Å; L194-T201 HydrophobicContact CD2-CG2 3.62Å; L194-T201 VanDerWaalsContact CD2-OG1 3.32Å; L194-T201 WeakPolarHBondContact CD2-OG1 3.49Å; L194-T201 HydrophobicContact CG-CG2 3.75Å; P198-T201 WeakPolarHBondContact O-CB 3.34Å; P198-T201 PolarHBondContact O-N 3.14Å; P198-T201 PolarHBondContact O-OG1 2.99Å; N199-T201 PolarHBondContact O-N 3.1Å; T201-N204 PolarHBondContact O-N 3.47Å; T201-L205 WeakPolarHBondContact O-CB 2.95Å; T201-L205 PolarHBondContact O-N 3.31Å
202I96.9Very high96.6Very high39 Ų3921.1 Ų21.120%0.211%0.112CC..Hα-helixtrans-67.8-42.3174.2-59.5171.5000110.2Y143 P198 N199 N204 L205 T206 L347Y143-I202 HydrophobicContact CD2-CD1 3.62Å; Y143-I202 HydrophobicContact CD2-CG1 4.08Å; Y143-I202 HydrophobicContact CE2-CD1 3.34Å; Y143-I202 HydrophobicContact CE2-CG1 4.18Å; Y143-I202 HydrophobicContact CG-CD1 4.48Å; P198-I202 PolarHBondContact O-N 2.97Å; N199-I202 PolarHBondContact O-N 3.34Å; N199-I202 VanDerWaalsContact O-N 3.15Å; I202-N204 VanDerWaalsContact C-N 3.34Å; I202-N204 PolarHBondContact O-N 2.69Å; I202-L205 PolarHBondContact O-N 3.46Å; I202-T206 HydrophobicContact CG2-CG2 4.3Å; I202-T206 WeakPolarHBondContact O-CG2 3.27Å; I202-T206 PolarHBondContact O-N 3.38Å; I202-T206 PolarHBondContact O-OG1 2.92Å; I202-L347 HydrophobicContact CB-CD1 3.64Å; I202-L347 HydrophobicContact CB-CD2 4.31Å; I202-L347 HydrophobicContact CD1-CD2 4.45Å; I202-L347 HydrophobicContact CG2-CD1 3.64Å; I202-L347 HydrophobicContact CG2-CD2 3.57Å; I202-L347 HydrophobicContact CG2-CG 4.23Å
203L97.3Very high96.6Very high5 Ų522.2 Ų22.23%0.02612%0.118CC..Hα-helixtrans-56-48.9173.8-179.673.1000111.4N199 M200 L205 T206 I207 L261 M343 L344N199-L203 PolarHBondContact O-N 3.08Å; M200-L203 HydrophobicContact SD-CD2 4.14Å; L203-L205 VanDerWaalsContact C-N 3.34Å; L203-L205 PolarHBondContact O-N 2.95Å; L203-T206 PolarHBondContact O-N 3.25Å; L203-T206 PolarHBondContact O-OG1 2.92Å; L203-I207 HydrophobicContact CD1-CD1 4.21Å; L203-I207 HydrophobicContact CG-CD1 4.22Å; L203-I207 WeakPolarHBondContact O-CG1 3.4Å; L203-I207 PolarHBondContact O-N 3.37Å; L203-L261 HydrophobicContact CD1-CD2 4.29Å; L203-L261 HydrophobicContact CD2-CD2 3.6Å; L203-L261 HydrophobicContact CG-CD2 4.21Å; L203-M343 HydrophobicContact CD1-CB 4.31Å; L203-L344 HydrophobicContact CD2-CD2 3.61Å
204N97.5Very high96.6Very high3 Ų322.2 Ų22.22%0.01612%0.118CC..Hα-helixtrans-63.8-40.5177.4-170.37.2000111.6M190 M200 T201 I202 Y208 P262 I266M190-N204 HydrophobicContact CG-CB 3.99Å; M190-N204 WeakPolarHBondContact CG-ND2 3.46Å; M200-N204 PolarHBondContact O-N 3.45Å; T201-N204 PolarHBondContact O-N 3.47Å; I202-N204 VanDerWaalsContact C-N 3.34Å; I202-N204 PolarHBondContact O-N 2.69Å; N204-Y208 WeakPolarHBondContact O-CB 3.37Å; N204-Y208 PolarHBondContact O-N 3.06Å; N204-P262 HydrophobicContact CB-CB 3.86Å; N204-I266 HydrophobicContact CB-CD1 4.32Å
205L97.9Very high96.6Very high14 Ų1422.5 Ų22.57%0.07312%0.12CC..Hα-helixtrans-59.8-47175.9172.9141.3000112.6L136 I139 M190 T201 I202 L203 Y208 I209L136-L205 HydrophobicContact CD2-CD1 4.27Å; L136-L205 HydrophobicContact CD2-CD2 3.83Å; I139-L205 HydrophobicContact CB-CD1 4.16Å; I139-L205 HydrophobicContact CD1-CD1 3.27Å; I139-L205 HydrophobicContact CG1-CD1 4.27Å; I139-L205 HydrophobicContact CG2-CD1 4.08Å; M190-L205 HydrophobicContact CE-CB 4.36Å; M190-L205 HydrophobicContact SD-CB 4.15Å; T201-L205 WeakPolarHBondContact O-CB 2.95Å; T201-L205 PolarHBondContact O-N 3.31Å; I202-L205 PolarHBondContact O-N 3.46Å; L203-L205 VanDerWaalsContact C-N 3.34Å; L203-L205 PolarHBondContact O-N 2.95Å; L205-Y208 PolarHBondContact O-N 2.85Å; L205-I209 HydrophobicContact CD2-CD1 3.56Å; L205-I209 HydrophobicContact CG-CD1 3.93Å; L205-I209 VanDerWaalsContact O-CG1 3.32Å; L205-I209 WeakPolarHBondContact O-CG1 3.44Å; L205-I209 PolarHBondContact O-N 3.11Å
206T97.1Very high96.7Very high54 Ų5421 Ų2133%0.33111%0.11SC..Hα-helixtrans-64.4-46.3-177.754.30000111.1I202 L203 Y208 I209 I210I202-T206 HydrophobicContact CG2-CG2 4.3Å; I202-T206 WeakPolarHBondContact O-CG2 3.27Å; I202-T206 PolarHBondContact O-N 3.38Å; I202-T206 PolarHBondContact O-OG1 2.92Å; L203-T206 PolarHBondContact O-N 3.25Å; L203-T206 PolarHBondContact O-OG1 2.92Å; T206-Y208 VanDerWaalsContact C-N 3.35Å; T206-Y208 PolarHBondContact O-N 3.05Å; T206-I209 PolarHBondContact O-N 3.45Å; T206-I210 WeakPolarHBondContact O-CG1 3.38Å; T206-I210 PolarHBondContact O-N 3.38Å; T206-I210 VanDerWaalsContact O-N 3.11Å
207I97.3Very high96.7Very high4 Ų419 Ų192%0.02111%0.105CC..Hα-helixtrans-61.8-44.6175.8-65.6174.3000110.3L203 I209 I210 L211 L261 P262L203-I207 HydrophobicContact CD1-CD1 4.21Å; L203-I207 HydrophobicContact CG-CD1 4.22Å; L203-I207 WeakPolarHBondContact O-CG1 3.4Å; L203-I207 PolarHBondContact O-N 3.37Å; I207-I209 VanDerWaalsContact C-N 3.34Å; I207-I209 PolarHBondContact O-N 3.44Å; I207-I210 PolarHBondContact O-N 3.4Å; I207-L211 HydrophobicContact CG2-CD1 3.86Å; I207-L211 HydrophobicContact CG2-CG 4.18Å; I207-L211 VanDerWaalsContact O-CG 3.25Å; I207-L211 WeakPolarHBondContact O-CG 3.45Å; I207-L211 PolarHBondContact O-N 3.31Å; I207-L261 HydrophobicContact CD1-CD2 4.11Å; I207-P262 HydrophobicContact CB-CG 4.47Å; I207-P262 HydrophobicContact CD1-CB 4.29Å; I207-P262 HydrophobicContact CD1-CG 4Å; I207-P262 HydrophobicContact CG2-CG 4.21Å
208Y97.9Very high96.7Very high3 Ų317.4 Ų17.41%0.01210%0.096CC..Hα-helixtrans-59.2-41.1176.8169-99.9000113.1L131 S183 H186 M190 N204 L205 T206 L211 T212L131-Y208 WeakPolarHBondContact O-CE1 3.35Å; L131-Y208 PolarHBondContact O-OH 3.39Å; S183-Y208 WeakPolarHBondContact CA-OH 3.45Å; S183-Y208 WeakPolarHBondContact CB-OH 3.38Å; H186-Y208 HydrophobicContact CB-CD2 3.61Å; H186-Y208 HydrophobicContact CB-CE2 3.83Å; H186-Y208 HydrophobicContact CB-CG 4.35Å; H186-Y208 AromaticContact CD2-CD2 3.7Å; H186-Y208 AromaticContact CD2-CE2 3.85Å; H186-Y208 AromaticContact CG-CD2 3.55Å; H186-Y208 AromaticContact CG-CE2 3.97Å; M190-Y208 HydrophobicContact CE-CD1 3.77Å; M190-Y208 HydrophobicContact CE-CD2 4.28Å; M190-Y208 HydrophobicContact CE-CG 3.53Å; N204-Y208 WeakPolarHBondContact O-CB 3.37Å; N204-Y208 PolarHBondContact O-N 3.06Å; L205-Y208 PolarHBondContact O-N 2.85Å; T206-Y208 VanDerWaalsContact C-N 3.35Å; T206-Y208 PolarHBondContact O-N 3.05Å; Y208-L211 PolarHBondContact O-N 2.77Å; Y208-T212 HydrophobicContact CD2-CG2 3.89Å; Y208-T212 HydrophobicContact CE1-CG2 4.17Å; Y208-T212 HydrophobicContact CE2-CG2 3.32Å; Y208-T212 VanDerWaalsContact CZ-CG2 3.47Å; Y208-T212 WeakPolarHBondContact O-CB 3.37Å; Y208-T212 WeakPolarHBondContact O-CG2 3.29Å; Y208-T212 PolarHBondContact O-N 3.08Å; Y208-T212 PolarHBondContact O-OG1 3.39Å
209I98.1Very high96.6Very high41 Ų4116.7 Ų16.721%0.219%0.091CC..Hα-helixtrans-63.6-42.9176.3-69.6169.6000110.4T132 L136 L205 T206 I207 L211 T212 T213T132-I209 HydrophobicContact CG2-CG1 4.38Å; T132-I209 HydrophobicContact CG2-CG2 4.3Å; L136-I209 HydrophobicContact CD2-CD1 3.9Å; L205-I209 HydrophobicContact CD2-CD1 3.56Å; L205-I209 HydrophobicContact CG-CD1 3.93Å; L205-I209 VanDerWaalsContact O-CG1 3.32Å; L205-I209 WeakPolarHBondContact O-CG1 3.44Å; L205-I209 PolarHBondContact O-N 3.11Å; T206-I209 PolarHBondContact O-N 3.45Å; I207-I209 VanDerWaalsContact C-N 3.34Å; I207-I209 PolarHBondContact O-N 3.44Å; I209-L211 PolarHBondContact O-N 3.19Å; I209-T212 PolarHBondContact O-OG1 3.03Å; I209-T213 HydrophobicContact CG2-CG2 4.14Å; I209-T213 WeakPolarHBondContact O-CB 3.41Å; I209-T213 WeakPolarHBondContact O-CG2 3.39Å; I209-T213 PolarHBondContact O-N 2.9Å; I209-T213 PolarHBondContact O-OG1 3.08Å
210I97.5Very high96.4Very high34 Ų3415.9 Ų15.917%0.1749%0.086CC..Hα-helixtrans-60.6-46.6175.7-64.7167.3000110.6T206 I207 T213 T214 L329 L332 T333T206-I210 WeakPolarHBondContact O-CG1 3.38Å; T206-I210 PolarHBondContact O-N 3.38Å; T206-I210 VanDerWaalsContact O-N 3.11Å; I207-I210 PolarHBondContact O-N 3.4Å; I210-T213 PolarHBondContact O-OG1 3.15Å; I210-T214 WeakPolarHBondContact O-CG2 3.33Å; I210-T214 PolarHBondContact O-N 3.38Å; I210-T214 VanDerWaalsContact O-N 3.17Å; I210-T214 PolarHBondContact O-OG1 3.32Å; I210-L329 HydrophobicContact CG2-CD2 4.17Å; I210-L332 HydrophobicContact CG2-CB 4.02Å; I210-T333 HydrophobicContact CG2-CG2 4.11Å
211L97.4Very high96.1Very high2 Ų215.4 Ų15.41%0.018%0.084CC..Hα-helixtrans-66.3-40.1-178.2-67.5178.8000113.1I207 Y208 I209 T214 A215 S250 L251 T333I207-L211 HydrophobicContact CG2-CD1 3.86Å; I207-L211 HydrophobicContact CG2-CG 4.18Å; I207-L211 VanDerWaalsContact O-CG 3.25Å; I207-L211 WeakPolarHBondContact O-CG 3.45Å; I207-L211 PolarHBondContact O-N 3.31Å; Y208-L211 PolarHBondContact O-N 2.77Å; I209-L211 PolarHBondContact O-N 3.19Å; L211-T214 PolarHBondContact O-OG1 3.19Å; L211-A215 PolarHBondContact O-N 3.33Å; L211-S250 WeakPolarHBondContact CD2-OG 3.36Å; L211-L251 HydrophobicContact CB-CD2 3.51Å; L211-L251 HydrophobicContact CB-CG 3.97Å; L211-L251 HydrophobicContact CD1-CD2 3.92Å; L211-L251 HydrophobicContact CD1-CG 4.31Å; L211-L251 HydrophobicContact CG-CD2 4.34Å; L211-T333 HydrophobicContact CD2-CG2 3.73Å
212T97.1Very high95.7Very high0 Ų016.4 Ų16.40%09%0.09CC..Hα-helixtrans-77-38-179.649.80000112.8T132 Y208 I209 T214 A215 F216 L251T132-T212 WeakPolarHBondContact CG2-OG1 3.33Å; Y208-T212 HydrophobicContact CD2-CG2 3.89Å; Y208-T212 HydrophobicContact CE1-CG2 4.17Å; Y208-T212 HydrophobicContact CE2-CG2 3.32Å; Y208-T212 VanDerWaalsContact CZ-CG2 3.47Å; Y208-T212 WeakPolarHBondContact O-CB 3.37Å; Y208-T212 WeakPolarHBondContact O-CG2 3.29Å; Y208-T212 PolarHBondContact O-N 3.08Å; Y208-T212 PolarHBondContact O-OG1 3.39Å; I209-T212 PolarHBondContact O-OG1 3.03Å; T212-T214 VanDerWaalsContact C-N 3.34Å; T212-T214 PolarHBondContact O-N 2.86Å; T212-A215 PolarHBondContact O-N 2.91Å; T212-F216 VanDerWaalsContact O-CD2 3.28Å; T212-F216 WeakPolarHBondContact O-CD2 3.19Å; T212-F216 PolarHBondContact O-N 2.76Å; T212-L251 HydrophobicContact CG2-CD2 4.43Å
213T97Very high95.3Very high23 Ų2318.2 Ų18.214%0.14111%0.105CC..Hα-helixtrans-58.9-45.2173.652.30000111.3L128 T132 I209 I210 F216 L217L128-T213 HydrophobicContact CD1-CG2 3.8Å; T132-T213 HydrophobicContact CG2-CG2 4.28Å; I209-T213 HydrophobicContact CG2-CG2 4.14Å; I209-T213 WeakPolarHBondContact O-CB 3.41Å; I209-T213 WeakPolarHBondContact O-CG2 3.39Å; I209-T213 PolarHBondContact O-N 2.9Å; I209-T213 PolarHBondContact O-OG1 3.08Å; I210-T213 PolarHBondContact O-OG1 3.15Å; T213-F216 PolarHBondContact O-N 3.34Å; T213-L217 WeakPolarHBondContact O-CB 3.31Å; T213-L217 VanDerWaalsContact O-CG 3.23Å; T213-L217 WeakPolarHBondContact O-CG 3.28Å; T213-L217 PolarHBondContact O-N 2.87Å
214T96.8Very high94.8Very high0 Ų018 Ų180%011%0.105CC..Hα-helixtrans-61.6-46.6175.456.40000112.5I210 L211 T212 F216 L217 L218 L329 I330 T333I210-T214 WeakPolarHBondContact O-CG2 3.33Å; I210-T214 PolarHBondContact O-N 3.38Å; I210-T214 VanDerWaalsContact O-N 3.17Å; I210-T214 PolarHBondContact O-OG1 3.32Å; L211-T214 PolarHBondContact O-OG1 3.19Å; T212-T214 VanDerWaalsContact C-N 3.34Å; T212-T214 PolarHBondContact O-N 2.86Å; T214-F216 PolarHBondContact O-N 2.94Å; T214-L217 PolarHBondContact O-N 3.5Å; T214-L218 WeakPolarHBondContact O-CB 3.42Å; T214-L218 WeakPolarHBondContact O-CG 3.43Å; T214-L218 PolarHBondContact O-N 3.05Å; T214-L329 HydrophobicContact CG2-CB 3.27Å; T214-L329 HydrophobicContact CG2-CD1 4.36Å; T214-L329 HydrophobicContact CG2-CG 4.37Å; T214-I330 HydrophobicContact CG2-CG1 4.43Å; T214-T333 HydrophobicContact CG2-CG2 3.59Å
215A95.6Very high94.5Very high6 Ų619.5 Ų19.55%0.0511%0.114CC..Hα-helixtrans-57.5-49.5177.900000111.9L179 L211 T212 L217 L218 L219L179-A215 HydrophobicContact CD1-CB 4.36Å; L179-A215 HydrophobicContact CD2-CB 4.07Å; L211-A215 PolarHBondContact O-N 3.33Å; T212-A215 PolarHBondContact O-N 2.91Å; A215-L217 PolarHBondContact O-N 3.13Å; A215-L218 PolarHBondContact O-N 3.47Å; A215-L219 VanDerWaalsContact O-CG 3.27Å; A215-L219 WeakPolarHBondContact O-CG 3.4Å; A215-L219 PolarHBondContact O-N 2.92Å
216F95.6Very high94.4Very high1 Ų120.2 Ų20.20%0.00412%0.119CC..Hα-helixtrans-66.1-37178.9-84-74.2000113.4L124 L128 L131 L179 T212 T213 T214 L219 N220L124-F216 HydrophobicContact CB-CD1 4.38Å; L124-F216 HydrophobicContact CD2-CD1 3.95Å; L124-F216 HydrophobicContact CD2-CE1 4.07Å; L128-F216 HydrophobicContact CB-CB 4.11Å; L128-F216 HydrophobicContact CB-CD1 4.42Å; L128-F216 HydrophobicContact CB-CD2 4.05Å; L128-F216 HydrophobicContact CB-CG 3.95Å; L128-F216 HydrophobicContact CD1-CB 4.01Å; L128-F216 HydrophobicContact CD1-CD2 3.68Å; L128-F216 HydrophobicContact CD1-CG 4.12Å; L128-F216 HydrophobicContact CD2-CB 4.41Å; L128-F216 HydrophobicContact CG-CB 4.4Å; L128-F216 HydrophobicContact CG-CD2 4.48Å; L131-F216 HydrophobicContact CB-CE2 4.47Å; L131-F216 HydrophobicContact CD1-CE2 3.86Å; L131-F216 HydrophobicContact CD1-CZ 3.82Å; L179-F216 HydrophobicContact CB-CZ 4.37Å; L179-F216 HydrophobicContact CD1-CD1 4.37Å; L179-F216 HydrophobicContact CD1-CD2 4.29Å; L179-F216 HydrophobicContact CD1-CE1 4.07Å; L179-F216 HydrophobicContact CD1-CE2 3.99Å; L179-F216 HydrophobicContact CD1-CG 4.47Å; L179-F216 HydrophobicContact CD1-CZ 3.87Å; T212-F216 VanDerWaalsContact O-CD2 3.28Å; T212-F216 WeakPolarHBondContact O-CD2 3.19Å; T212-F216 PolarHBondContact O-N 2.76Å; T213-F216 PolarHBondContact O-N 3.34Å; T214-F216 PolarHBondContact O-N 2.94Å; F216-L219 PolarHBondContact O-N 3.37Å; F216-N220 WeakPolarHBondContact O-CB 3.31Å; F216-N220 PolarHBondContact O-N 2.76Å; F216-N220 PolarHBondContact O-ND2 3.42Å
217L94.9Very high94.2Very high28 Ų2819 Ų1915%0.14711%0.111CC..Hα-helixtrans-68.8-39.2177.2-68.7172.2000111.5T213 T214 A215 N220 L221 T323 L326 L329T213-L217 WeakPolarHBondContact O-CB 3.31Å; T213-L217 VanDerWaalsContact O-CG 3.23Å; T213-L217 WeakPolarHBondContact O-CG 3.28Å; T213-L217 PolarHBondContact O-N 2.87Å; T214-L217 PolarHBondContact O-N 3.5Å; A215-L217 PolarHBondContact O-N 3.13Å; L217-N220 WeakPolarHBondContact O-CB 3.48Å; L217-N220 PolarHBondContact O-N 3.46Å; L217-N220 VanDerWaalsContact O-N 3.16Å; L217-L221 PolarHBondContact O-N 2.87Å; L217-T323 HydrophobicContact CD2-CG2 4.47Å; L217-L326 HydrophobicContact CB-CD1 3.64Å; L217-L326 HydrophobicContact CD1-CB 4.39Å; L217-L329 HydrophobicContact CD1-CD1 4.09Å
218L93.9Very high94Very high3 Ų324.6 Ų24.62%0.01614%0.141CC..Hα-helixtrans-62.3-41.1171.8-72.1169.5000111.9T214 A215 N220 L221 N222 L243 I244 T247 L326 I330T214-L218 WeakPolarHBondContact O-CB 3.42Å; T214-L218 WeakPolarHBondContact O-CG 3.43Å; T214-L218 PolarHBondContact O-N 3.05Å; A215-L218 PolarHBondContact O-N 3.47Å; L218-N220 VanDerWaalsContact C-N 3.32Å; L218-N220 PolarHBondContact O-N 3.3Å; L218-L221 HydrophobicContact CD2-CD1 4.4Å; L218-L221 PolarHBondContact O-N 2.81Å; L218-N222 PolarHBondContact O-N 3.22Å; L218-L243 HydrophobicContact CD1-CB 4.26Å; L218-L243 HydrophobicContact CD2-CB 4.09Å; L218-L243 HydrophobicContact CD2-CD1 4.44Å; L218-I244 HydrophobicContact CB-CG1 4Å; L218-I244 HydrophobicContact CD1-CG1 4.01Å; L218-I244 HydrophobicContact CD2-CG1 4.44Å; L218-I244 HydrophobicContact CG-CG1 4.39Å; L218-T247 HydrophobicContact CD1-CG2 3.97Å; L218-L326 HydrophobicContact CD2-CD1 4.21Å; L218-L326 HydrophobicContact CG-CD1 4.37Å; L218-I330 HydrophobicContact CD2-CD1 4.34Å
219L92.8Very high93.7Very high10 Ų1027.1 Ų27.15%0.05215%0.154CC..Hα-helixtrans-62.8-39172.5-68.4178.5000111.9L124 L175 L179 A215 F216 N222 S223 S224 L230L124-L219 HydrophobicContact CD1-CB 4.16Å; L124-L219 HydrophobicContact CD2-CB 4.43Å; L124-L219 HydrophobicContact CD2-CD1 4.3Å; L175-L219 HydrophobicContact CB-CD1 4.24Å; L175-L219 HydrophobicContact CB-CD2 4.25Å; L175-L219 HydrophobicContact CD1-CD2 3.42Å; L175-L219 VanDerWaalsContact CD1-CD2 3.42Å; L175-L219 HydrophobicContact CG-CD2 4.36Å; L179-L219 HydrophobicContact CD1-CD1 3.57Å; A215-L219 VanDerWaalsContact O-CG 3.27Å; A215-L219 WeakPolarHBondContact O-CG 3.4Å; A215-L219 PolarHBondContact O-N 2.92Å; F216-L219 PolarHBondContact O-N 3.37Å; L219-N222 PolarHBondContact O-N 3.21Å; L219-S223 WeakPolarHBondContact O-CA 3.4Å; L219-S223 PolarHBondContact O-N 3.02Å; L219-S224 PolarHBondContact O-N 3.09Å; L219-L230 HydrophobicContact CD2-CD1 4.01Å
220N92.3Very high93.5Very high36 Ų3625.2 Ų25.219%0.19314%0.144CC..Hα-helixtrans-64.2-43.5175.3-81.4-29.5000111.5L124 F216 L217 L218 N222 S223 K321L124-N220 WeakPolarHBondContact CB-OD1 3.43Å; L124-N220 WeakPolarHBondContact CD1-OD1 3.38Å; F216-N220 WeakPolarHBondContact O-CB 3.31Å; F216-N220 PolarHBondContact O-N 2.76Å; F216-N220 PolarHBondContact O-ND2 3.42Å; L217-N220 WeakPolarHBondContact O-CB 3.48Å; L217-N220 PolarHBondContact O-N 3.46Å; L217-N220 VanDerWaalsContact O-N 3.16Å; L218-N220 VanDerWaalsContact C-N 3.32Å; L218-N220 PolarHBondContact O-N 3.3Å; N220-N222 VanDerWaalsContact C-N 3.33Å; N220-N222 PolarHBondContact O-N 3.5Å; N220-S223 PolarHBondContact O-N 3.32Å; N220-S223 VanDerWaalsContact O-N 3.16Å; N220-K321 WeakPolarHBondContact O-CD 3.46Å; N220-K321 WeakPolarHBondContact O-CE 3.42Å; N220-K321 PolarHBondContact O-NZ 3.17Å
221L90.8Very high93.2Very high15 Ų1524.1 Ų24.18%0.07914%0.14CC..Hα-helixtrans-54.3-49.9175.3-74.3177.7000111.2L217 L218 S223 L240 H319 K321 T323 L326L217-L221 PolarHBondContact O-N 2.87Å; L218-L221 HydrophobicContact CD2-CD1 4.4Å; L218-L221 PolarHBondContact O-N 2.81Å; L221-S223 PolarHBondContact O-N 3.41Å; L221-L240 HydrophobicContact CD1-CD1 4.23Å; L221-H319 PolarHBondContact O-CE1 3.03Å; L221-H319 PolarHBondContact O-ND1 3.05Å; L221-K321 HydrophobicContact CD2-CB 4.36Å; L221-K321 PolarHBondContact O-NZ 3.47Å; L221-T323 HydrophobicContact CD1-CG2 4.48Å; L221-T323 HydrophobicContact CD2-CG2 3.44Å; L221-T323 VanDerWaalsContact CD2-CG2 3.44Å; L221-T323 HydrophobicContact CG-CG2 3.77Å; L221-L326 HydrophobicContact CD1-CD1 3.59Å; L221-L326 HydrophobicContact CD1-CD2 4.29Å; L221-L326 HydrophobicContact CG-CD1 4.29Å
222N87.6Confident92.8Very high24 Ų2428.1 Ų28.113%0.12815%0.154CC..Hα-helixtrans-76.6-18.4-180-69.7-34.1000114.4L218 L219 N220 S224 T233 L237 I244L218-N222 PolarHBondContact O-N 3.22Å; L219-N222 PolarHBondContact O-N 3.21Å; N220-N222 VanDerWaalsContact C-N 3.33Å; N220-N222 PolarHBondContact O-N 3.5Å; N222-S224 VanDerWaalsContact CB-OG 3.31Å; N222-S224 WeakPolarHBondContact CB-OG 3.13Å; N222-S224 PolarHBondContact O-N 3.02Å; N222-T233 WeakPolarHBondContact ND2-CG2 3.47Å; N222-L237 WeakPolarHBondContact OD1-CD1 3.15Å; N222-I244 WeakPolarHBondContact ND2-CD1 3.39Å
223S87.9Confident92.4Very high76 Ų7628.2 Ų28.253%0.53116%0.155SC..THydrogen-bonded Turntrans49.934.4-168.338.70000112.9L219 N220 L221 K321L219-S223 WeakPolarHBondContact O-CA 3.4Å; L219-S223 PolarHBondContact O-N 3.02Å; N220-S223 PolarHBondContact O-N 3.32Å; N220-S223 VanDerWaalsContact O-N 3.16Å; L221-S223 PolarHBondContact O-N 3.41Å; S223-K321 PolarHBondContact OG-NZ 2.9Å
224S86.8Confident92Very high2 Ų232.7 Ų32.71%0.01417%0.17CC..  trans-104.6129-179.453.10000109.8L219 N222 L230L219-S224 PolarHBondContact O-N 3.09Å; N222-S224 VanDerWaalsContact CB-OG 3.31Å; N222-S224 WeakPolarHBondContact CB-OG 3.13Å; N222-S224 PolarHBondContact O-N 3.02Å; S224-L230 WeakPolarHBondContact OG-CD1 3.43Å
225T92Very high91.6Very high34 Ų3434.2 Ų34.221%0.20918%0.178CC..  trans-113.9-7.9178.7600000113L124 L175 R176L124-T225 HydrophobicContact CD1-CG2 4.48Å; L175-T225 WeakPolarHBondContact CB-O 3.27Å; L175-T225 PolarHBondContact N-O 2.66Å; R176-T225 VanDerWaalsContact NH1-CG2 3.26Å
226T95.3Very high91Very high29 Ų2936.9 Ų36.918%0.17819%0.188CC..BIsolated β-bridgetrans-125.8156.7179.862.90000110.4L228 L229 L230T226-L228 VanDerWaalsContact C-N 3.32Å; T226-L228 PolarHBondContact O-N 3.03Å; T226-L229 PolarHBondContact O-N 3.22Å; T226-L229 VanDerWaalsContact O-N 3.08Å; T226-L229 VanDerWaalsContact OG1-CG 3.29Å; T226-L229 WeakPolarHBondContact OG1-CG 3.25Å; T226-L229 PolarHBondContact OG1-N 3.05Å; T226-L230 PolarHBondContact O-N 3.42Å
227T93.7Very high90.6Very high27 Ų2738.3 Ų38.317%0.16620%0.196CC..Hα-helixtrans-54.6-44.1176.950.60000112.9T173 L175 L229 L230 S231 L296T173-T227 WeakPolarHBondContact O-CG2 3.48Å; T173-T227 PolarHBondContact O-N 2.88Å; L175-T227 HydrophobicContact CD2-CG2 4.16Å; T227-L229 VanDerWaalsContact C-N 3.31Å; T227-L229 PolarHBondContact O-N 3.48Å; T227-L230 WeakPolarHBondContact O-CA 3.26Å; T227-L230 VanDerWaalsContact O-CB 3.31Å; T227-L230 WeakPolarHBondContact O-CB 3.14Å; T227-L230 PolarHBondContact O-N 3.24Å; T227-S231 PolarHBondContact O-N 2.75Å; T227-S231 VanDerWaalsContact O-N 3.08Å; T227-L296 HydrophobicContact CG2-CG 4.42Å
228L93.3Very high90.3Very high123 Ų12340.1 Ų40.164%0.64421%0.208SC*.Hα-helixtrans-65.2-29.3176.8-70.7172.4000113.9T226 S231T226-L228 VanDerWaalsContact C-N 3.32Å; T226-L228 PolarHBondContact O-N 3.03Å; L228-S231 PolarHBondContact O-OG 3.19Å
229L92Very high90.1Very high55 Ų5551.3 Ų51.329%0.28825%0.25SS..Hα-helixtrans-77.8-29.6172.9-71.4174.6000111.3T226 T227 S231 R232T226-L229 PolarHBondContact O-N 3.22Å; T226-L229 VanDerWaalsContact O-N 3.08Å; T226-L229 VanDerWaalsContact OG1-CG 3.29Å; T226-L229 WeakPolarHBondContact OG1-CG 3.25Å; T226-L229 PolarHBondContact OG1-N 3.05Å; T227-L229 VanDerWaalsContact C-N 3.31Å; T227-L229 PolarHBondContact O-N 3.48Å; L229-S231 VanDerWaalsContact C-N 3.34Å; L229-R232 VanDerWaalsContact CD2-CZ 3.49Å; L229-R232 VanDerWaalsContact CD2-NH1 3.31Å; L229-R232 WeakPolarHBondContact O-CB 3.12Å; L229-R232 PolarHBondContact O-N 3.47Å
230L92.4Very high89.9Confident2 Ų253.1 Ų53.11%0.0126%0.26CS..Hα-helixtrans-70.3-31178.5-164.664.1000111.9L175 L219 S224 T226 T227 R232 T233 I244 L296 T300L175-L230 HydrophobicContact CD1-CB 4.04Å; L175-L230 HydrophobicContact CD1-CD1 4.19Å; L175-L230 HydrophobicContact CD1-CD2 3.98Å; L175-L230 HydrophobicContact CD1-CG 4.32Å; L175-L230 HydrophobicContact CD2-CD2 3.78Å; L219-L230 HydrophobicContact CD2-CD1 4.01Å; S224-L230 WeakPolarHBondContact OG-CD1 3.43Å; T226-L230 PolarHBondContact O-N 3.42Å; T227-L230 WeakPolarHBondContact O-CA 3.26Å; T227-L230 VanDerWaalsContact O-CB 3.31Å; T227-L230 WeakPolarHBondContact O-CB 3.14Å; T227-L230 PolarHBondContact O-N 3.24Å; L230-R232 PolarHBondContact O-N 2.98Å; L230-T233 HydrophobicContact CD1-CG2 4.3Å; L230-T233 WeakPolarHBondContact O-CB 3.48Å; L230-T233 WeakPolarHBondContact O-CG2 3.29Å; L230-T233 PolarHBondContact O-N 3.1Å; L230-T233 VanDerWaalsContact O-N 3.1Å; L230-T233 PolarHBondContact O-OG1 3.36Å; L230-T233 VanDerWaalsContact O-OG1 3.08Å; L230-I244 HydrophobicContact CD1-CD1 3.98Å; L230-I244 HydrophobicContact CD1-CG2 4.32Å; L230-I244 HydrophobicContact CD2-CG2 4.03Å; L230-I244 HydrophobicContact CG-CG2 4.49Å; L230-L296 HydrophobicContact CD2-CD2 3.51Å; L230-L296 HydrophobicContact CD2-CG 4.3Å; L230-T300 HydrophobicContact CB-CG2 3.88Å; L230-T300 HydrophobicContact CD2-CG2 3.57Å; L230-T300 HydrophobicContact CG-CG2 3.53Å
231S92.4Very high89.8Confident10 Ų1052.9 Ų52.97%0.0726%0.26CS..THydrogen-bonded Turntrans-64.8-7.317666.80000114.4T227 L228 L229 T233 S299 M307T227-S231 PolarHBondContact O-N 2.75Å; T227-S231 VanDerWaalsContact O-N 3.08Å; L228-S231 PolarHBondContact O-OG 3.19Å; L229-S231 VanDerWaalsContact C-N 3.34Å; S231-T233 PolarHBondContact O-N 2.97Å; S231-S299 WeakPolarHBondContact CB-O 3.3Å; S231-M307 VanDerWaalsContact C-CE 3.48Å; S231-M307 WeakPolarHBondContact OG-CE 3.47Å
232R89.1Confident89.8Confident86 Ų8655.7 Ų55.733%0.32528%0.279SS..THydrogen-bonded Turntrans-73.5-9.1171.8-63.9179.5176.9174.3-2113.5L229 L230 W234 N235 K236 M307L229-R232 VanDerWaalsContact CD2-CZ 3.49Å; L229-R232 VanDerWaalsContact CD2-NH1 3.31Å; L229-R232 WeakPolarHBondContact O-CB 3.12Å; L229-R232 PolarHBondContact O-N 3.47Å; L230-R232 PolarHBondContact O-N 2.98Å; R232-W234 VanDerWaalsContact C-N 3.34Å; R232-W234 PolarHBondContact O-N 3.46Å; R232-N235 PolarHBondContact O-N 3.19Å; R232-N235 VanDerWaalsContact O-N 3.07Å; R232-K236 PolarHBondContact O-N 2.83Å; R232-M307 HydrophobicContact CB-CE 4.1Å; R232-M307 HydrophobicContact CG-CE 3.25Å; R232-M307 HydrophobicContact CG-SD 3.72Å
233T89.3Confident90.1Very high3 Ų356.2 Ų56.22%0.01828%0.281CS..Hα-helixtrans-53.9-48.7-178.346.20000112.1N222 L230 S231 N235 K236 L237 I244N222-T233 WeakPolarHBondContact ND2-CG2 3.47Å; L230-T233 HydrophobicContact CD1-CG2 4.3Å; L230-T233 WeakPolarHBondContact O-CB 3.48Å; L230-T233 WeakPolarHBondContact O-CG2 3.29Å; L230-T233 PolarHBondContact O-N 3.1Å; L230-T233 VanDerWaalsContact O-N 3.1Å; L230-T233 PolarHBondContact O-OG1 3.36Å; L230-T233 VanDerWaalsContact O-OG1 3.08Å; S231-T233 PolarHBondContact O-N 2.97Å; T233-N235 PolarHBondContact O-N 2.95Å; T233-K236 PolarHBondContact O-N 3.47Å; T233-L237 CarbonylContact O-C 3.07Å; T233-L237 WeakPolarHBondContact O-CA 3.1Å; T233-L237 PolarHBondContact O-N 2.82Å; T233-I244 HydrophobicContact CG2-CD1 3.36Å
234W88.3Confident90.3Very high116 Ų11653.1 Ų53.144%0.43926%0.259SS..Hα-helixtrans-60.2-33178.7175.786.7000112.7R232 T238 T241 L304R232-W234 VanDerWaalsContact C-N 3.34Å; R232-W234 PolarHBondContact O-N 3.46Å; W234-T238 WeakPolarHBondContact O-CG2 3.14Å; W234-T241 VanDerWaalsContact CA-CG2 3.46Å; W234-T241 HydrophobicContact CB-CG2 3.92Å; W234-L304 HydrophobicContact CB-CD2 4.24Å; W234-L304 HydrophobicContact CD2-CD2 3.38Å; W234-L304 HydrophobicContact CE3-CD2 3.8Å; W234-L304 HydrophobicContact CG-CD2 3.56Å; W234-L304 HydrophobicContact CZ2-CD1 4.46Å; W234-L304 HydrophobicContact CZ2-CD2 4.23Å; W234-L304 HydrophobicContact CZ3-CD2 4.36Å
235N86.9Confident90.5Very high32 Ų3253.4 Ų53.417%0.17126%0.261CS..Hα-helixtrans-81-41.6179.1-87.3-47.2000113.8R232 T233 V311 W315R232-N235 PolarHBondContact O-N 3.19Å; R232-N235 VanDerWaalsContact O-N 3.07Å; T233-N235 PolarHBondContact O-N 2.95Å; N235-V311 HydrophobicContact CB-CG1 3.66Å; N235-W315 VanDerWaalsContact O-CD1 3.29Å; N235-W315 PolarHBondContact O-NE1 3.02Å
236K84.6Confident90.5Very high63 Ų6353 Ų5327%0.27426%0.259SS..Hα-helixtrans-88.6-36.9-172.7-162.8-177.5-174.1-147.70112.7R232 T233 H319R232-K236 PolarHBondContact O-N 2.83Å; T233-K236 PolarHBondContact O-N 3.47Å; K236-H319 WeakPolarHBondContact CD-NE2 3.31Å; K236-H319 WeakPolarHBondContact CE-NE2 3.39Å; K236-H319 PolarHBondContact NZ-CE1 3.35Å; K236-H319 PolarHBondContact NZ-NE2 3.5Å
237L87Confident90.5Very high31 Ų3151.6 Ų51.616%0.16225%0.251CS..  trans-140.562.9-170.8-72.7164.7000108.6N222 T233 W239 L240 T241 H319N222-L237 WeakPolarHBondContact OD1-CD1 3.15Å; T233-L237 CarbonylContact O-C 3.07Å; T233-L237 WeakPolarHBondContact O-CA 3.1Å; T233-L237 PolarHBondContact O-N 2.82Å; L237-W239 PolarHBondContact O-N 3.23Å; L237-W239 VanDerWaalsContact O-N 3.13Å; L237-L240 HydrophobicContact CB-CB 4.09Å; L237-L240 HydrophobicContact CB-CD1 4.12Å; L237-L240 HydrophobicContact CB-CG 4.2Å; L237-L240 HydrophobicContact CD1-CD1 3.8Å; L237-L240 HydrophobicContact CD2-CD1 3.83Å; L237-L240 HydrophobicContact CD2-CG 4.39Å; L237-L240 HydrophobicContact CG-CD1 4.12Å; L237-L240 PolarHBondContact O-N 3.32Å; L237-T241 PolarHBondContact O-N 3.14Å; L237-H319 WeakPolarHBondContact CD1-CE1 3.46Å; L237-H319 WeakPolarHBondContact CD1-NE2 3.49Å; L237-H319 WeakPolarHBondContact CG-NE2 3.46Å
238T88Confident90.5Very high66 Ų6650.8 Ų50.841%0.40525%0.245SC..G310 helixtrans-47.6-42.4179.338.50000111.7W234 L240 T241W234-T238 WeakPolarHBondContact O-CG2 3.14Å; T238-L240 VanDerWaalsContact C-N 3.29Å; T238-L240 PolarHBondContact O-N 3.05Å; T238-T241 WeakPolarHBondContact O-CB 3.39Å; T238-T241 WeakPolarHBondContact O-CG2 3.39Å; T238-T241 PolarHBondContact O-N 3.24Å; T238-T241 PolarHBondContact O-OG1 2.85Å
239W89.4Confident90.6Very high237 Ų23746.7 Ų46.790%0.89822%0.224SC*.G310 helixtrans-68.4-25.2-177.3-63.953.5000113.1L237L237-W239 PolarHBondContact O-N 3.23Å; L237-W239 VanDerWaalsContact O-N 3.13Å
240L89.6Confident90.8Very high49 Ų4944.1 Ų44.126%0.25721%0.21SC..G310 helixtrans-952.9-179.4-55.5-177.8000113L221 L237 T238 P242 L243L221-L240 HydrophobicContact CD1-CD1 4.23Å; L237-L240 HydrophobicContact CB-CB 4.09Å; L237-L240 HydrophobicContact CB-CD1 4.12Å; L237-L240 HydrophobicContact CB-CG 4.2Å; L237-L240 HydrophobicContact CD1-CD1 3.8Å; L237-L240 HydrophobicContact CD2-CD1 3.83Å; L237-L240 HydrophobicContact CD2-CG 4.39Å; L237-L240 HydrophobicContact CG-CD1 4.12Å; L237-L240 PolarHBondContact O-N 3.32Å; T238-L240 VanDerWaalsContact C-N 3.29Å; T238-L240 PolarHBondContact O-N 3.05Å; L240-P242 VanDerWaalsContact C-CD 3.44Å; L240-L243 HydrophobicContact CB-CD1 3.92Å; L240-L243 HydrophobicContact CD2-CD1 3.32Å; L240-L243 HydrophobicContact CG-CD1 4.15Å; L240-L243 WeakPolarHBondContact O-CB 3.36Å; L240-L243 PolarHBondContact O-N 3.01Å
241T88.4Confident90.9Very high31 Ų3144.1 Ų44.119%0.1921%0.21CC..THydrogen-bonded Turntrans-53.7-40179.451.70000115.2W234 L237 T238 L243 P245W234-T241 VanDerWaalsContact CA-CG2 3.46Å; W234-T241 HydrophobicContact CB-CG2 3.92Å; L237-T241 PolarHBondContact O-N 3.14Å; T238-T241 WeakPolarHBondContact O-CB 3.39Å; T238-T241 WeakPolarHBondContact O-CG2 3.39Å; T238-T241 PolarHBondContact O-N 3.24Å; T238-T241 PolarHBondContact O-OG1 2.85Å; T241-L243 VanDerWaalsContact C-N 3.33Å; T241-L243 PolarHBondContact O-N 3.47Å; T241-P245 WeakPolarHBondContact O-CD 3.23Å
242P92.9Very high91Very high74 Ų7443.9 Ų43.948%0.48121%0.21SC..THydrogen-bonded Turntrans-75.8-17.9-179.429.3-35.7000114L240 P245 S246L240-P242 VanDerWaalsContact C-CD 3.44Å; P242-P245 WeakPolarHBondContact O-CD 3.39Å; P242-S246 WeakPolarHBondContact O-CB 3.21Å; P242-S246 PolarHBondContact O-N 2.67Å; P242-S246 PolarHBondContact O-OG 2.92Å
243L93.5Very high91.2Very high34 Ų3440.3 Ų40.318%0.17820%0.2CC..Hα-helixtrans-73.4-35.1-168.9-60.9175.1000113.8L218 L240 T241 S246 T247 I330L218-L243 HydrophobicContact CD1-CB 4.26Å; L218-L243 HydrophobicContact CD2-CB 4.09Å; L218-L243 HydrophobicContact CD2-CD1 4.44Å; L240-L243 HydrophobicContact CB-CD1 3.92Å; L240-L243 HydrophobicContact CD2-CD1 3.32Å; L240-L243 HydrophobicContact CG-CD1 4.15Å; L240-L243 WeakPolarHBondContact O-CB 3.36Å; L240-L243 PolarHBondContact O-N 3.01Å; T241-L243 VanDerWaalsContact C-N 3.33Å; T241-L243 PolarHBondContact O-N 3.47Å; L243-S246 WeakPolarHBondContact CA-OG 3.24Å; L243-S246 PolarHBondContact O-OG 3.16Å; L243-T247 WeakPolarHBondContact O-CG2 3.24Å; L243-T247 PolarHBondContact O-N 2.84Å; L243-T247 PolarHBondContact O-OG1 3.12Å; L243-I330 HydrophobicContact CD1-CD1 3.9Å; L243-I330 HydrophobicContact CD2-CD1 4.18Å; L243-I330 HydrophobicContact CD2-CG2 3.7Å; L243-I330 HydrophobicContact CG-CD1 4.43Å
244I90.7Very high91.4Very high11 Ų1142.8 Ų42.86%0.05621%0.213CC..Hα-helixtrans-72.7-47.5178.8-64.1151.1000110.8L218 N222 L230 T233 T247 L248L218-I244 HydrophobicContact CB-CG1 4Å; L218-I244 HydrophobicContact CD1-CG1 4.01Å; L218-I244 HydrophobicContact CD2-CG1 4.44Å; L218-I244 HydrophobicContact CG-CG1 4.39Å; N222-I244 WeakPolarHBondContact ND2-CD1 3.39Å; L230-I244 HydrophobicContact CD1-CD1 3.98Å; L230-I244 HydrophobicContact CD1-CG2 4.32Å; L230-I244 HydrophobicContact CD2-CG2 4.03Å; L230-I244 HydrophobicContact CG-CG2 4.49Å; T233-I244 HydrophobicContact CG2-CD1 3.36Å; I244-T247 PolarHBondContact O-OG1 3.28Å; I244-L248 HydrophobicContact CG2-CD1 4.06Å; I244-L248 VanDerWaalsContact O-CG 3.26Å; I244-L248 WeakPolarHBondContact O-CG 3.19Å; I244-L248 PolarHBondContact O-N 3.33Å; I244-L248 VanDerWaalsContact O-N 3.14Å
245P90.9Very high91.4Very high9 Ų940.8 Ų40.86%0.05821%0.214CC..Hα-helixtrans-56.8-46.5170.4-25.231.8000113.9T241 P242 T247 L248 L249 I297 S301T241-P245 WeakPolarHBondContact O-CD 3.23Å; P242-P245 WeakPolarHBondContact O-CD 3.39Å; P245-T247 VanDerWaalsContact C-N 3.34Å; P245-T247 PolarHBondContact O-N 3.4Å; P245-L248 PolarHBondContact O-N 2.72Å; P245-L249 WeakPolarHBondContact O-CB 3.27Å; P245-L249 VanDerWaalsContact O-CG 3.28Å; P245-L249 WeakPolarHBondContact O-CG 3.2Å; P245-L249 PolarHBondContact O-N 3.17Å; P245-I297 HydrophobicContact CB-CB 4.49Å; P245-I297 HydrophobicContact CB-CD1 4.17Å; P245-I297 HydrophobicContact CB-CG1 3.85Å; P245-I297 HydrophobicContact CB-CG2 3.92Å; P245-I297 HydrophobicContact CG-CG1 4.43Å; P245-I297 HydrophobicContact CG-CG2 4.2Å; P245-S301 WeakPolarHBondContact CG-OG 3.47Å
246S93.8Very high91.7Very high24 Ų2443.7 Ų43.717%0.16824%0.235CC..Hα-helixtrans-62-42.7-176.164.10000111.8P242 L243 L249 S250P242-S246 WeakPolarHBondContact O-CB 3.21Å; P242-S246 PolarHBondContact O-N 2.67Å; P242-S246 PolarHBondContact O-OG 2.92Å; L243-S246 WeakPolarHBondContact CA-OG 3.24Å; L243-S246 PolarHBondContact O-OG 3.16Å; S246-L249 PolarHBondContact O-N 3.35Å; S246-S250 WeakPolarHBondContact O-CB 3.4Å; S246-S250 PolarHBondContact O-N 2.9Å; S246-S250 PolarHBondContact O-OG 3.42Å
247T94.6Very high92.3Very high1 Ų141.9 Ų41.91%0.00623%0.228CC..Hα-helixtrans-64.5-40.8175.551.60000112.2L218 L243 I244 P245 S250 L251 T333L218-T247 HydrophobicContact CD1-CG2 3.97Å; L243-T247 WeakPolarHBondContact O-CG2 3.24Å; L243-T247 PolarHBondContact O-N 2.84Å; L243-T247 PolarHBondContact O-OG1 3.12Å; I244-T247 PolarHBondContact O-OG1 3.28Å; P245-T247 VanDerWaalsContact C-N 3.34Å; P245-T247 PolarHBondContact O-N 3.4Å; T247-S250 WeakPolarHBondContact CA-OG 3.23Å; T247-S250 PolarHBondContact O-N 3.47Å; T247-S250 PolarHBondContact O-OG 3.44Å; T247-L251 PolarHBondContact O-N 3.45Å; T247-T333 HydrophobicContact CG2-CG2 4.21Å
248L93.9Very high92.7Very high10 Ų1040.5 Ų40.55%0.05222%0.221CC..Hα-helixtrans-66.1-39.9175.6-67.5169.8000112.9I244 P245 S250 L251 G252 Y293 L296I244-L248 HydrophobicContact CG2-CD1 4.06Å; I244-L248 VanDerWaalsContact O-CG 3.26Å; I244-L248 WeakPolarHBondContact O-CG 3.19Å; I244-L248 PolarHBondContact O-N 3.33Å; I244-L248 VanDerWaalsContact O-N 3.14Å; P245-L248 PolarHBondContact O-N 2.72Å; L248-S250 VanDerWaalsContact C-N 3.32Å; L248-L251 HydrophobicContact CD2-CD1 4.39Å; L248-L251 WeakPolarHBondContact O-CB 3.42Å; L248-L251 PolarHBondContact O-N 2.91Å; L248-G252 PolarHBondContact O-N 3.05Å; L248-Y293 HydrophobicContact CB-CD1 4.16Å; L248-Y293 HydrophobicContact CB-CG 4.27Å; L248-Y293 HydrophobicContact CD2-CD1 3.82Å; L248-Y293 HydrophobicContact CD2-CE1 3.83Å; L248-Y293 HydrophobicContact CG-CD1 4.47Å; L248-Y293 WeakPolarHBondContact O-CD2 3.31Å; L248-L296 HydrophobicContact CD1-CD1 3.89Å; L248-L296 HydrophobicContact CD1-CD2 3.34Å; L248-L296 HydrophobicContact CD1-CG 4.13Å
249L95.5Very high93Very high37 Ų3737.5 Ų37.519%0.19420%0.203CC..Hα-helixtrans-66.5-36.3175.2-70.2173.2000111.7P245 S246 G252 G253 L254 L257 L294 I297P245-L249 WeakPolarHBondContact O-CB 3.27Å; P245-L249 VanDerWaalsContact O-CG 3.28Å; P245-L249 WeakPolarHBondContact O-CG 3.2Å; P245-L249 PolarHBondContact O-N 3.17Å; S246-L249 PolarHBondContact O-N 3.35Å; L249-G252 CarbonylContact O-C 3.54Å; L249-G252 WeakPolarHBondContact O-CA 3.43Å; L249-G252 PolarHBondContact O-N 3.19Å; L249-G252 VanDerWaalsContact O-N 3.15Å; L249-G253 PolarHBondContact O-N 2.98Å; L249-G253 VanDerWaalsContact O-N 3.08Å; L249-L254 HydrophobicContact CB-CD1 4.07Å; L249-L254 HydrophobicContact CD1-CD1 4.44Å; L249-L254 HydrophobicContact CD2-CD1 3.61Å; L249-L254 HydrophobicContact CG-CD1 4.22Å; L249-L254 PolarHBondContact O-N 3.17Å; L249-L257 HydrophobicContact CB-CD1 3.53Å; L249-L294 HydrophobicContact CD2-CD2 4.08Å; L249-I297 HydrophobicContact CD1-CD1 4.06Å; L249-I297 HydrophobicContact CD2-CD1 3.46Å; L249-I297 VanDerWaalsContact CD2-CD1 3.46Å; L249-I297 HydrophobicContact CG-CD1 3.52Å
250S96.4Very high93.4Very high0 Ų029.3 Ų29.30%017%0.174CC..Hα-helixtrans-67.6-38.8173.768.70000111.8L211 S246 T247 L248 G252 G253 G259L211-S250 WeakPolarHBondContact CD2-OG 3.36Å; S246-S250 WeakPolarHBondContact O-CB 3.4Å; S246-S250 PolarHBondContact O-N 2.9Å; S246-S250 PolarHBondContact O-OG 3.42Å; T247-S250 WeakPolarHBondContact CA-OG 3.23Å; T247-S250 PolarHBondContact O-N 3.47Å; T247-S250 PolarHBondContact O-OG 3.44Å; L248-S250 VanDerWaalsContact C-N 3.32Å; S250-G252 VanDerWaalsContact C-N 3.25Å; S250-G252 PolarHBondContact O-N 3.02Å; S250-G253 WeakPolarHBondContact O-CA 3.38Å; S250-G253 PolarHBondContact O-N 3.12Å; S250-G259 VanDerWaalsContact O-CA 3.28Å; S250-G259 WeakPolarHBondContact O-CA 3.47Å
251L94.5Very high93.7Very high2 Ų227 Ų271%0.0116%0.162CC..Hα-helixtrans-60.3-35.3167.8-76.2166.4000112.1L179 H186 L211 T212 T247 L248 G253 Y293L179-L251 HydrophobicContact CD2-CD1 4.26Å; H186-L251 PolarHBondContact CE1-O 3.4Å; H186-L251 PolarHBondContact NE2-O 3.29Å; L211-L251 HydrophobicContact CB-CD2 3.51Å; L211-L251 HydrophobicContact CB-CG 3.97Å; L211-L251 HydrophobicContact CD1-CD2 3.92Å; L211-L251 HydrophobicContact CD1-CG 4.31Å; L211-L251 HydrophobicContact CG-CD2 4.34Å; T212-L251 HydrophobicContact CG2-CD2 4.43Å; T247-L251 PolarHBondContact O-N 3.45Å; L248-L251 HydrophobicContact CD2-CD1 4.39Å; L248-L251 WeakPolarHBondContact O-CB 3.42Å; L248-L251 PolarHBondContact O-N 2.91Å; L251-G253 PolarHBondContact O-N 3.21Å; L251-Y293 HydrophobicContact CB-CE2 4.04Å
252G93.1Very high94Very high6 Ų625.7 Ų25.76%0.06215%0.154CC..Hα-helixtrans-63.9-21.8170.800000113.7L248 L249 S250 K263L248-G252 PolarHBondContact O-N 3.05Å; L249-G252 CarbonylContact O-C 3.54Å; L249-G252 WeakPolarHBondContact O-CA 3.43Å; L249-G252 PolarHBondContact O-N 3.19Å; L249-G252 VanDerWaalsContact O-N 3.15Å; S250-G252 VanDerWaalsContact C-N 3.25Å; S250-G252 PolarHBondContact O-N 3.02Å; G252-K263 PolarHBondContact O-NZ 2.96Å
253G93.8Very high94.1Very high11 Ų1123.3 Ų23.311%0.11314%0.136CC..THydrogen-bonded Turntrans74.143.1-179.300000113.1L249 S250 L251 G259 F260L249-G253 PolarHBondContact O-N 2.98Å; L249-G253 VanDerWaalsContact O-N 3.08Å; S250-G253 WeakPolarHBondContact O-CA 3.38Å; S250-G253 PolarHBondContact O-N 3.12Å; L251-G253 PolarHBondContact O-N 3.21Å; G253-G259 WeakPolarHBondContact CA-O 3.41Å; G253-F260 WeakPolarHBondContact O-CD2 3.26Å
254L93Very high94.2Very high55 Ų5527.6 Ų27.629%0.28815%0.15SC..  trans-71.9142.6173.5-81.5-179.7000112.1L249 P256 L257 F260 L290L249-L254 HydrophobicContact CB-CD1 4.07Å; L249-L254 HydrophobicContact CD1-CD1 4.44Å; L249-L254 HydrophobicContact CD2-CD1 3.61Å; L249-L254 HydrophobicContact CG-CD1 4.22Å; L249-L254 PolarHBondContact O-N 3.17Å; L254-P256 VanDerWaalsContact C-CD 3.44Å; L254-L257 HydrophobicContact CB-CD1 4.46Å; L254-L257 PolarHBondContact O-N 3.34Å; L254-F260 WeakPolarHBondContact O-CB 3.35Å; L254-L290 HydrophobicContact CD2-CD1 3.67Å; L254-L290 HydrophobicContact CG-CD1 3.84Å
255P89.8Confident94.5Very high74 Ų7427.2 Ų27.248%0.48115%0.148SC..THydrogen-bonded Turntrans-55.7-33.7-169.817.8-28.5000117.1L257 F260 L337P255-L257 PolarHBondContact O-N 2.58Å; P255-F260 HydrophobicContact CB-CD1 4.37Å; P255-F260 HydrophobicContact CB-CD2 4.23Å; P255-F260 HydrophobicContact CB-CE1 4.43Å; P255-F260 HydrophobicContact CB-CE2 4.29Å; P255-F260 HydrophobicContact CB-CG 4.28Å; P255-F260 HydrophobicContact CB-CZ 4.39Å; P255-L337 WeakPolarHBondContact O-CD2 3.48Å
256P93.4Very high94.8Very high93 Ų9326.9 Ų26.960%0.60415%0.146SC*.THydrogen-bonded Turntrans-75.7-5.6176.228.5-34.6000114.3L254L254-P256 VanDerWaalsContact C-CD 3.44Å
257L96.2Very high95Very high24 Ų2428.5 Ų28.513%0.12615%0.152CC..SBendtrans-117166.1-171.4-56.7171.8000111.7L249 L254 P255 G259 F260 T334L249-L257 HydrophobicContact CB-CD1 3.53Å; L254-L257 HydrophobicContact CB-CD1 4.46Å; L254-L257 PolarHBondContact O-N 3.34Å; P255-L257 PolarHBondContact O-N 2.58Å; L257-G259 PolarHBondContact O-N 3.48Å; L257-F260 WeakPolarHBondContact O-CB 3.48Å; L257-F260 PolarHBondContact O-N 2.91Å; L257-T334 HydrophobicContact CD2-CG2 3.9Å
258T95.4Very high95.1Very high3 Ų331.9 Ų31.92%0.01817%0.168CC..THydrogen-bonded Turntrans-73.9-30.5-16566.90000113.4F260 L261 P262 L332 T333 T334 L336T258-F260 PolarHBondContact O-N 3.3Å; T258-F260 VanDerWaalsContact O-N 3.14Å; T258-L261 VanDerWaalsContact O-CB 3.3Å; T258-L261 WeakPolarHBondContact O-CB 2.89Å; T258-L261 PolarHBondContact O-N 3.16Å; T258-L261 VanDerWaalsContact O-N 3.12Å; T258-P262 WeakPolarHBondContact O-CD 3.28Å; T258-L332 WeakPolarHBondContact CG2-O 3.41Å; T258-L332 PolarHBondContact OG1-O 3.38Å; T258-T333 VanDerWaalsContact CG2-O 3.28Å; T258-T333 WeakPolarHBondContact CG2-O 3.38Å; T258-T333 VanDerWaalsContact OG1-C 3.29Å; T258-T333 PolarHBondContact OG1-O 2.93Å; T258-T334 WeakPolarHBondContact CG2-O 3.33Å; T258-L336 HydrophobicContact CG2-CB 3.56Å; T258-L336 HydrophobicContact CG2-CD2 4.49Å
259G94.5Very high95.2Very high3 Ų332.4 Ų32.43%0.03117%0.17CC..THydrogen-bonded Turntrans-70-4.1176.100000114.8S250 G253 L257S250-G259 VanDerWaalsContact O-CA 3.28Å; S250-G259 WeakPolarHBondContact O-CA 3.47Å; G253-G259 WeakPolarHBondContact CA-O 3.41Å; L257-G259 PolarHBondContact O-N 3.48Å
260F96.8Very high95.3Very high65 Ų6530.7 Ų30.729%0.28516%0.161SC..Hα-helixtrans-71.6-39.5167177.8-109000112.1G253 L254 P255 L257 T258 K263 W264 L337G253-F260 WeakPolarHBondContact O-CD2 3.26Å; L254-F260 WeakPolarHBondContact O-CB 3.35Å; P255-F260 HydrophobicContact CB-CD1 4.37Å; P255-F260 HydrophobicContact CB-CD2 4.23Å; P255-F260 HydrophobicContact CB-CE1 4.43Å; P255-F260 HydrophobicContact CB-CE2 4.29Å; P255-F260 HydrophobicContact CB-CG 4.28Å; P255-F260 HydrophobicContact CB-CZ 4.39Å; L257-F260 WeakPolarHBondContact O-CB 3.48Å; L257-F260 PolarHBondContact O-N 2.91Å; T258-F260 PolarHBondContact O-N 3.3Å; T258-F260 VanDerWaalsContact O-N 3.14Å; F260-K263 PolarHBondContact O-N 2.79Å; F260-K263 VanDerWaalsContact O-N 3.14Å; F260-W264 HydrophobicContact CD1-CB 4.29Å; F260-W264 HydrophobicContact CE1-CB 3.89Å; F260-W264 HydrophobicContact CE1-CG 4.08Å; F260-W264 HydrophobicContact CZ-CB 4.02Å; F260-W264 HydrophobicContact CZ-CG 4.25Å; F260-W264 PolarHBondContact O-N 3.48Å; F260-L337 HydrophobicContact CD1-CD1 4.37Å
261L96.3Very high95.3Very high0 Ų033.5 Ų33.50%018%0.178CC..Hα-helixtrans-49.1-54.8-176.9-171.6164.3000113.2L203 I207 T258 K263 W264 V265 L336 L337 M343L203-L261 HydrophobicContact CD1-CD2 4.29Å; L203-L261 HydrophobicContact CD2-CD2 3.6Å; L203-L261 HydrophobicContact CG-CD2 4.21Å; I207-L261 HydrophobicContact CD1-CD2 4.11Å; T258-L261 VanDerWaalsContact O-CB 3.3Å; T258-L261 WeakPolarHBondContact O-CB 2.89Å; T258-L261 PolarHBondContact O-N 3.16Å; T258-L261 VanDerWaalsContact O-N 3.12Å; L261-K263 VanDerWaalsContact C-N 3.33Å; L261-K263 PolarHBondContact O-N 3.45Å; L261-W264 PolarHBondContact O-N 3.09Å; L261-V265 HydrophobicContact CD2-CG2 4.17Å; L261-V265 VanDerWaalsContact O-CG2 3.32Å; L261-V265 WeakPolarHBondContact O-CG2 3.19Å; L261-V265 PolarHBondContact O-N 3.13Å; L261-V265 VanDerWaalsContact O-N 3.08Å; L261-L336 HydrophobicContact CD1-CD2 4.36Å; L261-L337 HydrophobicContact CB-CD1 4.16Å; L261-M343 HydrophobicContact CD1-CB 4.37Å
262P95.6Very high95.3Very high3 Ų339 Ų392%0.01920%0.202CC..Hα-helixtrans-65.5-36.6-176.825.3-33.5000111.9N204 I207 T258 I266N204-P262 HydrophobicContact CB-CB 3.86Å; I207-P262 HydrophobicContact CB-CG 4.47Å; I207-P262 HydrophobicContact CD1-CB 4.29Å; I207-P262 HydrophobicContact CD1-CG 4Å; I207-P262 HydrophobicContact CG2-CG 4.21Å; T258-P262 WeakPolarHBondContact O-CD 3.28Å; P262-I266 VanDerWaalsContact O-CB 3.28Å; P262-I266 WeakPolarHBondContact O-CB 3.4Å; P262-I266 VanDerWaalsContact O-CD1 3.3Å; P262-I266 WeakPolarHBondContact O-CD1 3.3Å; P262-I266 WeakPolarHBondContact O-CG1 3.46Å; P262-I266 PolarHBondContact O-N 3.14Å
263K95.3Very high95.4Very high24 Ų2442.4 Ų42.410%0.10422%0.219CC..Hα-helixtrans-66.9-40.8178.2-66.3-175-177.6-177.60111.7W189 G252 F260 L261 I267W189-K263 HydrophobicContact CE3-CG 4.42Å; W189-K263 HydrophobicContact CZ3-CB 4.41Å; G252-K263 PolarHBondContact O-NZ 2.96Å; F260-K263 PolarHBondContact O-N 2.79Å; F260-K263 VanDerWaalsContact O-N 3.14Å; L261-K263 VanDerWaalsContact C-N 3.33Å; L261-K263 PolarHBondContact O-N 3.45Å; K263-I267 VanDerWaalsContact O-CG1 3.28Å; K263-I267 WeakPolarHBondContact O-CG1 3.48Å; K263-I267 PolarHBondContact O-N 3.19Å; K263-I267 VanDerWaalsContact O-N 3.1Å
264W95.9Very high95.4Very high124 Ų12449 Ų4947%0.4725%0.251SS..Hα-helixtrans-62.9-48.7178.6175.847.8000111.6F260 L261 I266 I267 E268F260-W264 HydrophobicContact CD1-CB 4.29Å; F260-W264 HydrophobicContact CE1-CB 3.89Å; F260-W264 HydrophobicContact CE1-CG 4.08Å; F260-W264 HydrophobicContact CZ-CB 4.02Å; F260-W264 HydrophobicContact CZ-CG 4.25Å; F260-W264 PolarHBondContact O-N 3.48Å; L261-W264 PolarHBondContact O-N 3.09Å; W264-I266 VanDerWaalsContact C-N 3.34Å; W264-I266 PolarHBondContact O-N 3.29Å; W264-I267 WeakPolarHBondContact O-CB 3.25Å; W264-I267 PolarHBondContact O-N 2.95Å; W264-I267 VanDerWaalsContact O-N 3.16Å; W264-E268 PolarHBondContact O-N 3.34Å
265V96.1Very high95.4Very high4 Ų447.4 Ų47.42%0.02425%0.245CC..Hα-helixtrans-67.1-37.1-179.4-1800000111.6M200 L261 I267 E268 E269 L344M200-V265 HydrophobicContact CE-CG1 3.72Å; M200-V265 HydrophobicContact CG-CG1 3.96Å; M200-V265 HydrophobicContact SD-CB 4.49Å; M200-V265 HydrophobicContact SD-CG1 3.3Å; M200-V265 WeakPolarHBondContact SD-CG1 3.45Å; L261-V265 HydrophobicContact CD2-CG2 4.17Å; L261-V265 VanDerWaalsContact O-CG2 3.32Å; L261-V265 WeakPolarHBondContact O-CG2 3.19Å; L261-V265 PolarHBondContact O-N 3.13Å; L261-V265 VanDerWaalsContact O-N 3.08Å; V265-I267 VanDerWaalsContact C-N 3.32Å; V265-I267 PolarHBondContact O-N 3.14Å; V265-E268 WeakPolarHBondContact O-CB 3.11Å; V265-E268 PolarHBondContact O-N 3.17Å; V265-E269 PolarHBondContact O-N 3.45Å; V265-L344 HydrophobicContact CB-CD2 4.48Å; V265-L344 HydrophobicContact CG1-CD2 3.85Å; V265-L344 HydrophobicContact CG2-CD1 4.44Å; V265-L344 HydrophobicContact CG2-CD2 3.98Å
266I97.3Very high95.6Very high1 Ų149 Ų491%0.00525%0.249CC..Hα-helixtrans-57.4-46.3172.3-74.7169.3000110.8W189 V193 N204 P262 W264 E268 E269 F270W189-I266 HydrophobicContact CB-CD1 4.32Å; W189-I266 HydrophobicContact CE3-CB 4.25Å; W189-I266 HydrophobicContact CE3-CD1 4Å; W189-I266 HydrophobicContact CE3-CG2 3.6Å; W189-I266 HydrophobicContact CZ3-CB 4.37Å; W189-I266 HydrophobicContact CZ3-CG2 3.68Å; V193-I266 HydrophobicContact CB-CG1 4.4Å; V193-I266 HydrophobicContact CG2-CB 3.8Å; V193-I266 HydrophobicContact CG2-CD1 4.21Å; V193-I266 HydrophobicContact CG2-CG1 3.6Å; V193-I266 HydrophobicContact CG2-CG2 3.21Å; N204-I266 HydrophobicContact CB-CD1 4.32Å; P262-I266 VanDerWaalsContact O-CB 3.28Å; P262-I266 WeakPolarHBondContact O-CB 3.4Å; P262-I266 VanDerWaalsContact O-CD1 3.3Å; P262-I266 WeakPolarHBondContact O-CD1 3.3Å; P262-I266 WeakPolarHBondContact O-CG1 3.46Å; P262-I266 PolarHBondContact O-N 3.14Å; W264-I266 VanDerWaalsContact C-N 3.34Å; W264-I266 PolarHBondContact O-N 3.29Å; I266-E268 VanDerWaalsContact C-N 3.29Å; I266-E268 PolarHBondContact O-N 2.94Å; I266-E269 PolarHBondContact O-N 3.31Å; I266-F270 HydrophobicContact CG2-CD2 3.74Å; I266-F270 HydrophobicContact CG2-CE2 3.61Å; I266-F270 WeakPolarHBondContact O-CD2 3.39Å; I266-F270 PolarHBondContact O-N 2.87Å; I266-F270 VanDerWaalsContact O-N 3.12Å
267I97.4Very high95.8Very high59 Ų5950.6 Ų50.630%0.30325%0.251SS..Hα-helixtrans-61.8-40.5178.4-68.5165.3000110.6W189 K263 W264 V265 E269 F270 T271 P279W189-I267 HydrophobicContact CZ3-CG1 4.32Å; K263-I267 VanDerWaalsContact O-CG1 3.28Å; K263-I267 WeakPolarHBondContact O-CG1 3.48Å; K263-I267 PolarHBondContact O-N 3.19Å; K263-I267 VanDerWaalsContact O-N 3.1Å; W264-I267 WeakPolarHBondContact O-CB 3.25Å; W264-I267 PolarHBondContact O-N 2.95Å; W264-I267 VanDerWaalsContact O-N 3.16Å; V265-I267 VanDerWaalsContact C-N 3.32Å; V265-I267 PolarHBondContact O-N 3.14Å; I267-E269 PolarHBondContact O-N 2.86Å; I267-F270 PolarHBondContact O-N 2.98Å; I267-T271 HydrophobicContact CG2-CG2 4.26Å; I267-T271 VanDerWaalsContact O-CG2 3.24Å; I267-T271 WeakPolarHBondContact O-CG2 3.06Å; I267-T271 PolarHBondContact O-N 3.49Å; I267-P279 HydrophobicContact CG1-CB 4.1Å; I267-P279 HydrophobicContact CG2-CB 4.39Å
268E96.8Very high95.8Very high71 Ų7151 Ų5133%0.33225%0.253SS..Hα-helixtrans-61.2-41.9176.9-164.2-167.9143.200112.5W264 V265 I266 F270 T271 K272W264-E268 PolarHBondContact O-N 3.34Å; V265-E268 WeakPolarHBondContact O-CB 3.11Å; V265-E268 PolarHBondContact O-N 3.17Å; I266-E268 VanDerWaalsContact C-N 3.29Å; I266-E268 PolarHBondContact O-N 2.94Å; E268-F270 VanDerWaalsContact C-N 3.33Å; E268-F270 PolarHBondContact O-N 2.73Å; E268-T271 PolarHBondContact O-N 3.4Å; E268-T271 PolarHBondContact O-OG1 3.4Å; E268-K272 WeakPolarHBondContact O-CG 3.32Å; E268-K272 PolarHBondContact O-N 3.19Å; E268-K272 WeakPolarHBondContact OE1-CE 3.41Å; E268-K272 IonicContact OE1-NZ 2.74Å; E268-K272 PolarHBondContact OE1-NZ 2.9Å
269E96.2Very high95.8Very high22 Ų2251.1 Ų51.110%0.10325%0.254CS..Hα-helixtrans-67.4-34176.3-68.9-65.3-176.400112.7V193 N197 M200 V265 I266 I267 N273V193-E269 HydrophobicContact CG1-CB 4.4Å; N197-E269 HydrophobicContact CB-CG 4.22Å; N197-E269 PolarHBondContact ND2-OE1 2.95Å; M200-E269 WeakPolarHBondContact CE-OE1 3.21Å; M200-E269 HydrophobicContact CG-CG 3.81Å; V265-E269 PolarHBondContact O-N 3.45Å; I266-E269 PolarHBondContact O-N 3.31Å; I267-E269 PolarHBondContact O-N 2.86Å; E269-N273 PolarHBondContact O-N 3.45Å; E269-N273 PolarHBondContact O-ND2 3Å
270F96.6Very high95.9Very high1 Ų154.9 Ų54.90%0.00428%0.276CS..Hα-helixtrans-68.1-37.2173.6-83.7-69.6000112.6L155 A192 V193 Y196 I266 I267 E268 N273 N274 S275 I278 P279 M282L155-F270 HydrophobicContact CD2-CE1 4.19Å; L155-F270 HydrophobicContact CD2-CZ 4.3Å; A192-F270 HydrophobicContact CB-CE2 4.24Å; A192-F270 HydrophobicContact CB-CZ 3.81Å; A192-F270 WeakPolarHBondContact O-CZ 3.42Å; V193-F270 HydrophobicContact CG2-CD2 4.2Å; V193-F270 HydrophobicContact CG2-CE2 3.52Å; V193-F270 HydrophobicContact CG2-CZ 4.1Å; Y196-F270 HydrophobicContact CD2-CD1 4.17Å; Y196-F270 AromaticContact CD2-CE1 3.85Å; Y196-F270 HydrophobicContact CD2-CE1 3.85Å; Y196-F270 HydrophobicContact CD2-CZ 4.37Å; Y196-F270 AromaticContact CE2-CD1 3.76Å; Y196-F270 HydrophobicContact CE2-CD1 3.76Å; Y196-F270 AromaticContact CE2-CE1 3.29Å; Y196-F270 HydrophobicContact CE2-CE1 3.29Å; Y196-F270 HydrophobicContact CE2-CZ 4.11Å; I266-F270 HydrophobicContact CG2-CD2 3.74Å; I266-F270 HydrophobicContact CG2-CE2 3.61Å; I266-F270 WeakPolarHBondContact O-CD2 3.39Å; I266-F270 PolarHBondContact O-N 2.87Å; I266-F270 VanDerWaalsContact O-N 3.12Å; I267-F270 PolarHBondContact O-N 2.98Å; E268-F270 VanDerWaalsContact C-N 3.33Å; E268-F270 PolarHBondContact O-N 2.73Å; F270-N273 CarbonylContact O-C 3.59Å; F270-N273 PolarHBondContact O-N 3.24Å; F270-N274 PolarHBondContact O-N 3.22Å; F270-S275 WeakPolarHBondContact CD1-OG 3.28Å; F270-S275 PolarHBondContact O-N 3.28Å; F270-S275 VanDerWaalsContact O-N 3.1Å; F270-S275 PolarHBondContact O-OG 3.37Å; F270-I278 HydrophobicContact CE1-CG2 4.01Å; F270-I278 HydrophobicContact CZ-CG2 4.17Å; F270-P279 HydrophobicContact CB-CB 4.15Å; F270-P279 HydrophobicContact CB-CG 3.79Å; F270-P279 HydrophobicContact CD2-CB 4.25Å; F270-P279 HydrophobicContact CG-CB 4.35Å; F270-P279 HydrophobicContact CG-CG 4.28Å; F270-M282 HydrophobicContact CE2-CE 4.45Å; F270-M282 HydrophobicContact CE2-SD 4.22Å; F270-M282 HydrophobicContact CZ-SD 4.31Å
271T96.4Very high96Very high59 Ų5954.8 Ų54.836%0.36228%0.278SS..Hα-helixtrans-72.8-35.6179.163.40000111.8I267 E268 N273 N274 L276I267-T271 HydrophobicContact CG2-CG2 4.26Å; I267-T271 VanDerWaalsContact O-CG2 3.24Å; I267-T271 WeakPolarHBondContact O-CG2 3.06Å; I267-T271 PolarHBondContact O-N 3.49Å; E268-T271 PolarHBondContact O-N 3.4Å; E268-T271 PolarHBondContact O-OG1 3.4Å; T271-N273 PolarHBondContact O-N 3.43Å; T271-N274 PolarHBondContact O-N 3.29Å; T271-N274 VanDerWaalsContact O-N 3.08Å; T271-L276 HydrophobicContact CG2-CD2 3.5Å
272K96.4Very high96Very high118 Ų11854.8 Ų54.851%0.51328%0.278SS..Hα-helixtrans-57.5-33.8170.7-75.6173-175.2164.10112.6E268 N274E268-K272 WeakPolarHBondContact O-CG 3.32Å; E268-K272 PolarHBondContact O-N 3.19Å; E268-K272 WeakPolarHBondContact OE1-CE 3.41Å; E268-K272 IonicContact OE1-NZ 2.74Å; E268-K272 PolarHBondContact OE1-NZ 2.9Å; K272-N274 VanDerWaalsContact C-N 3.34Å
273N94.3Very high96Very high76 Ų7656.2 Ų56.241%0.40629%0.29SS..THydrogen-bonded Turntrans-93.220.2178.1-66.2-57.3000113.8Y196 E269 F270 T271 S275Y196-N273 HydrophobicContact CD1-CB 3.75Å; Y196-N273 VanDerWaalsContact CD1-ND2 3.25Å; Y196-N273 WeakPolarHBondContact CD1-ND2 3.46Å; Y196-N273 HydrophobicContact CE1-CB 3.81Å; E269-N273 PolarHBondContact O-N 3.45Å; E269-N273 PolarHBondContact O-ND2 3Å; F270-N273 CarbonylContact O-C 3.59Å; F270-N273 PolarHBondContact O-N 3.24Å; T271-N273 PolarHBondContact O-N 3.43Å; N273-S275 PolarHBondContact O-N 2.91Å; N273-S275 VanDerWaalsContact O-N 3.07Å
274N94.7Very high96.1Very high149 Ų14959.2 Ų59.280%0.79731%0.31SS*.THydrogen-bonded Turntrans628.4176.2-61.9-31.5000116.6F270 T271 K272 L276F270-N274 PolarHBondContact O-N 3.22Å; T271-N274 PolarHBondContact O-N 3.29Å; T271-N274 VanDerWaalsContact O-N 3.08Å; K272-N274 VanDerWaalsContact C-N 3.34Å; N274-L276 PolarHBondContact O-N 2.61Å
275S91.6Very high96.1Very high22 Ų2254.1 Ų54.115%0.15429%0.292CS..  trans-96.890.4179.554.50000111.8F270 N273 P279F270-S275 WeakPolarHBondContact CD1-OG 3.28Å; F270-S275 PolarHBondContact O-N 3.28Å; F270-S275 VanDerWaalsContact O-N 3.1Å; F270-S275 PolarHBondContact O-OG 3.37Å; N273-S275 PolarHBondContact O-N 2.91Å; N273-S275 VanDerWaalsContact O-N 3.07Å; S275-P279 WeakPolarHBondContact O-CD 3.23Å; S275-P279 VanDerWaalsContact O-CG 3.24Å; S275-P279 WeakPolarHBondContact O-CG 3.16Å
276L95.3Very high96Very high108 Ų10854.5 Ų54.557%0.56530%0.295SS*.  trans-85.2-25.3178.8-64175.8000113.8T271 N274 P279 T280T271-L276 HydrophobicContact CG2-CD2 3.5Å; N274-L276 PolarHBondContact O-N 2.61Å; L276-P279 WeakPolarHBondContact O-CD 3.38Å; L276-P279 WeakPolarHBondContact O-CG 3.31Å; L276-T280 VanDerWaalsContact O-CG2 3.31Å; L276-T280 WeakPolarHBondContact O-CG2 3.39Å; L276-T280 PolarHBondContact O-N 3.31Å; L276-T280 PolarHBondContact O-OG1 2.94Å
277I96.9Very high95.9Very high127 Ų12759.7 Ų59.765%0.65132%0.322SS*.Hα-helixtrans-70.5-44.2-173.3-63.2167.8000111.7T280 I281I277-T280 PolarHBondContact O-N 3.38Å; I277-T280 PolarHBondContact O-OG1 3.16Å; I277-I281 HydrophobicContact CG2-CD1 3.72Å; I277-I281 HydrophobicContact CG2-CG1 4.47Å; I277-I281 VanDerWaalsContact O-CG1 3.28Å; I277-I281 WeakPolarHBondContact O-CG1 3.23Å; I277-I281 PolarHBondContact O-N 3.14Å; I277-I281 VanDerWaalsContact O-N 3.09Å
278I96.3Very high95.7Very high32 Ų3259.5 Ų59.516%0.16432%0.321CS..Hα-helixtrans-64.3-52-178.4-66.8155.5000112.6L155 I159 F270 T280 I281 M282L155-I278 HydrophobicContact CD1-CD1 3.69Å; L155-I278 HydrophobicContact CD2-CG2 4.43Å; I159-I278 HydrophobicContact CD1-CG2 4.29Å; F270-I278 HydrophobicContact CE1-CG2 4.01Å; F270-I278 HydrophobicContact CZ-CG2 4.17Å; I278-T280 VanDerWaalsContact C-N 3.26Å; I278-T280 PolarHBondContact O-N 3.26Å; I278-I281 PolarHBondContact O-N 2.96Å; I278-M282 HydrophobicContact CG2-CG 4.28Å; I278-M282 HydrophobicContact CG2-SD 3.58Å; I278-M282 VanDerWaalsContact CG2-SD 3.58Å; I278-M282 WeakPolarHBondContact O-CG 3.39Å; I278-M282 PolarHBondContact O-N 3.13Å
279P96Very high95.4Very high5 Ų556.4 Ų56.43%0.03231%0.307CS..Hα-helixtrans-63.2-32.1-179.724.1-34.9000112.5I267 F270 S275 L276 M282 A283I267-P279 HydrophobicContact CG1-CB 4.1Å; I267-P279 HydrophobicContact CG2-CB 4.39Å; F270-P279 HydrophobicContact CB-CB 4.15Å; F270-P279 HydrophobicContact CB-CG 3.79Å; F270-P279 HydrophobicContact CD2-CB 4.25Å; F270-P279 HydrophobicContact CG-CB 4.35Å; F270-P279 HydrophobicContact CG-CG 4.28Å; S275-P279 WeakPolarHBondContact O-CD 3.23Å; S275-P279 VanDerWaalsContact O-CG 3.24Å; S275-P279 WeakPolarHBondContact O-CG 3.16Å; L276-P279 WeakPolarHBondContact O-CD 3.38Å; L276-P279 WeakPolarHBondContact O-CG 3.31Å; P279-M282 PolarHBondContact O-N 3.24Å; P279-A283 WeakPolarHBondContact O-CB 3.26Å; P279-A283 PolarHBondContact O-N 3Å
280T96.3Very high95.3Very high83 Ų8356.7 Ų56.751%0.50931%0.309SS..Hα-helixtrans-68.3-41.7175.250.40000112.3L276 I277 I278 T284L276-T280 VanDerWaalsContact O-CG2 3.31Å; L276-T280 WeakPolarHBondContact O-CG2 3.39Å; L276-T280 PolarHBondContact O-N 3.31Å; L276-T280 PolarHBondContact O-OG1 2.94Å; I277-T280 PolarHBondContact O-N 3.38Å; I277-T280 PolarHBondContact O-OG1 3.16Å; I278-T280 VanDerWaalsContact C-N 3.26Å; I278-T280 PolarHBondContact O-N 3.26Å; T280-T284 WeakPolarHBondContact O-CB 3.36Å; T280-T284 VanDerWaalsContact O-CG2 3.31Å; T280-T284 WeakPolarHBondContact O-CG2 3.45Å; T280-T284 PolarHBondContact O-N 3.13Å; T280-T284 PolarHBondContact O-OG1 3.49Å
281I97.6Very high95.3Very high62 Ų6263.4 Ų63.432%0.31834%0.335SS..Hα-helixtrans-61-48172.4-68.1167.2000110.5I159 I277 I278 A283 T284 I285I159-I281 HydrophobicContact CG2-CG2 4.33Å; I277-I281 HydrophobicContact CG2-CD1 3.72Å; I277-I281 HydrophobicContact CG2-CG1 4.47Å; I277-I281 VanDerWaalsContact O-CG1 3.28Å; I277-I281 WeakPolarHBondContact O-CG1 3.23Å; I277-I281 PolarHBondContact O-N 3.14Å; I277-I281 VanDerWaalsContact O-N 3.09Å; I278-I281 PolarHBondContact O-N 2.96Å; I281-A283 PolarHBondContact O-N 3.2Å; I281-T284 PolarHBondContact O-OG1 3.48Å; I281-I285 HydrophobicContact CG2-CD1 3.6Å; I281-I285 WeakPolarHBondContact O-CD1 3.36Å; I281-I285 VanDerWaalsContact O-CG1 3.26Å; I281-I285 WeakPolarHBondContact O-CG1 3.47Å; I281-I285 PolarHBondContact O-N 2.87Å; I281-I285 VanDerWaalsContact O-N 3.14Å
282M97.3Very high95.1Very high1 Ų161.1 Ų61.11%0.00532%0.32CS..Hα-helixtrans-62.2-47.3-179.5-67.8169.462.900111.6I159 I162 W189 A192 F270 I278 P279 I285 T286I159-M282 HydrophobicContact CG1-CG 4.45Å; I162-M282 HydrophobicContact CD1-CB 4.08Å; I162-M282 HydrophobicContact CD1-CE 3.51Å; I162-M282 HydrophobicContact CD1-CG 3.7Å; I162-M282 HydrophobicContact CD1-SD 4.26Å; W189-M282 HydrophobicContact CB-CE 4.5Å; W189-M282 HydrophobicContact CD2-CE 3.53Å; W189-M282 HydrophobicContact CE3-CE 3.55Å; W189-M282 HydrophobicContact CG-CE 4Å; W189-M282 HydrophobicContact CH2-CB 3.83Å; W189-M282 HydrophobicContact CH2-CE 4.3Å; W189-M282 HydrophobicContact CZ2-CB 3.59Å; W189-M282 HydrophobicContact CZ2-CE 4.31Å; W189-M282 HydrophobicContact CZ3-CE 3.94Å; A192-M282 HydrophobicContact CB-CE 3.49Å; A192-M282 VanDerWaalsContact CB-CE 3.49Å; A192-M282 HydrophobicContact CB-SD 3.96Å; F270-M282 HydrophobicContact CE2-CE 4.45Å; F270-M282 HydrophobicContact CE2-SD 4.22Å; F270-M282 HydrophobicContact CZ-SD 4.31Å; I278-M282 HydrophobicContact CG2-CG 4.28Å; I278-M282 HydrophobicContact CG2-SD 3.58Å; I278-M282 VanDerWaalsContact CG2-SD 3.58Å; I278-M282 WeakPolarHBondContact O-CG 3.39Å; I278-M282 PolarHBondContact O-N 3.13Å; P279-M282 PolarHBondContact O-N 3.24Å; M282-I285 PolarHBondContact O-N 3.34Å; M282-T286 WeakPolarHBondContact O-CG2 3.44Å; M282-T286 PolarHBondContact O-N 3.49Å; M282-T286 VanDerWaalsContact O-N 3.13Å
283A95.8Very high95Very high33 Ų3355.6 Ų55.627%0.27330%0.296SS..Hα-helixtrans-61.3-46.5-179.100000111.8W189 P279 I281 I285 T286W189-A283 HydrophobicContact CH2-CB 4.49Å; P279-A283 WeakPolarHBondContact O-CB 3.26Å; P279-A283 PolarHBondContact O-N 3Å; I281-A283 PolarHBondContact O-N 3.2Å; A283-I285 PolarHBondContact O-N 3.08Å; A283-T286 PolarHBondContact O-N 3.09Å; A283-T286 PolarHBondContact O-OG1 3.04Å
284T96.8Very high95Very high86 Ų8654.5 Ų54.553%0.52829%0.29SS..Hα-helixtrans-63.5-43.2-18050.50000112.4T280 I281 T286 L287T280-T284 WeakPolarHBondContact O-CB 3.36Å; T280-T284 VanDerWaalsContact O-CG2 3.31Å; T280-T284 WeakPolarHBondContact O-CG2 3.45Å; T280-T284 PolarHBondContact O-N 3.13Å; T280-T284 PolarHBondContact O-OG1 3.49Å; I281-T284 PolarHBondContact O-OG1 3.48Å; T284-T286 VanDerWaalsContact C-N 3.3Å; T284-T286 PolarHBondContact O-N 3.37Å; T284-L287 WeakPolarHBondContact O-CB 3.32Å; T284-L287 PolarHBondContact O-N 3.43Å
285I96.6Very high95Very high17 Ų1754.3 Ų54.39%0.08728%0.278CS..Hα-helixtrans-64.1-36.4177.9-63.4163.1000111.1I162 M163 I281 M282 A283 L287 L288I162-I285 HydrophobicContact CG2-CB 4.07Å; I162-I285 HydrophobicContact CG2-CG2 3.77Å; M163-I285 HydrophobicContact CE-CD1 3.63Å; M163-I285 HydrophobicContact CG-CD1 3.72Å; I281-I285 HydrophobicContact CG2-CD1 3.6Å; I281-I285 WeakPolarHBondContact O-CD1 3.36Å; I281-I285 VanDerWaalsContact O-CG1 3.26Å; I281-I285 WeakPolarHBondContact O-CG1 3.47Å; I281-I285 PolarHBondContact O-N 2.87Å; I281-I285 VanDerWaalsContact O-N 3.14Å; M282-I285 PolarHBondContact O-N 3.34Å; A283-I285 PolarHBondContact O-N 3.08Å; I285-L287 PolarHBondContact O-N 3.43Å; I285-L287 VanDerWaalsContact O-N 3.16Å; I285-L288 WeakPolarHBondContact O-CB 3.44Å; I285-L288 PolarHBondContact O-N 3.17Å; I285-L288 VanDerWaalsContact O-N 3.13Å
286T93.3Very high95.1Very high12 Ų1253.6 Ų53.67%0.07427%0.273CS..Hα-helixtrans-66.2-15.7179.558.50000115.2I162 W189 M282 A283 T284 L288 N289 L290I162-T286 HydrophobicContact CG2-CG2 4.07Å; W189-T286 HydrophobicContact CZ2-CG2 3.73Å; M282-T286 WeakPolarHBondContact O-CG2 3.44Å; M282-T286 PolarHBondContact O-N 3.49Å; M282-T286 VanDerWaalsContact O-N 3.13Å; A283-T286 PolarHBondContact O-N 3.09Å; A283-T286 PolarHBondContact O-OG1 3.04Å; T284-T286 VanDerWaalsContact C-N 3.3Å; T284-T286 PolarHBondContact O-N 3.37Å; T286-L288 PolarHBondContact O-N 3.13Å; T286-N289 VanDerWaalsContact O-CB 3.31Å; T286-N289 WeakPolarHBondContact O-CB 3.44Å; T286-N289 PolarHBondContact O-N 3.4Å; T286-L290 PolarHBondContact O-N 3Å
287L94.6Very high95.1Very high111 Ų11148.7 Ų48.758%0.58125%0.247SC*.Hα-helixtrans-62-30173.2-65173.5000111.8T284 I285 N289 L290 Y291T284-L287 WeakPolarHBondContact O-CB 3.32Å; T284-L287 PolarHBondContact O-N 3.43Å; I285-L287 PolarHBondContact O-N 3.43Å; I285-L287 VanDerWaalsContact O-N 3.16Å; L287-N289 VanDerWaalsContact C-N 3.29Å; L287-N289 PolarHBondContact O-N 3.4Å; L287-L290 PolarHBondContact O-N 3.3Å; L287-Y291 PolarHBondContact O-N 3.02Å
288L93.9Very high94.9Very high55 Ų5548.6 Ų48.629%0.28824%0.239SC..Hα-helixtrans-63.4-35.9172.4-65.2168.9000111.7W167 L170 I285 T286 Y291 F292W167-L288 HydrophobicContact CZ2-CD1 4.42Å; L170-L288 HydrophobicContact CD1-CD2 4.41Å; I285-L288 WeakPolarHBondContact O-CB 3.44Å; I285-L288 PolarHBondContact O-N 3.17Å; I285-L288 VanDerWaalsContact O-N 3.13Å; T286-L288 PolarHBondContact O-N 3.13Å; L288-Y291 PolarHBondContact O-N 2.95Å; L288-F292 WeakPolarHBondContact O-CD1 3.34Å; L288-F292 PolarHBondContact O-N 2.77Å
289N91.7Very high94.7Very high5 Ų548.3 Ų48.33%0.02724%0.24CC..Hα-helixtrans-63.2-45.9174.3-67.3-48.2000111.6S166 T185 T286 L287 Y291 F292 Y293S166-N289 WeakPolarHBondContact CA-OD1 3.49Å; S166-N289 PolarHBondContact OG-ND2 3.44Å; S166-N289 PolarHBondContact OG-OD1 3.41Å; T185-N289 WeakPolarHBondContact CG2-ND2 3.17Å; T185-N289 PolarHBondContact OG1-ND2 3.43Å; T286-N289 VanDerWaalsContact O-CB 3.31Å; T286-N289 WeakPolarHBondContact O-CB 3.44Å; T286-N289 PolarHBondContact O-N 3.4Å; L287-N289 VanDerWaalsContact C-N 3.29Å; L287-N289 PolarHBondContact O-N 3.4Å; N289-Y291 VanDerWaalsContact C-N 3.27Å; N289-Y291 PolarHBondContact O-N 3.48Å; N289-F292 HydrophobicContact CB-CE1 3.9Å; N289-F292 HydrophobicContact CB-CZ 4.12Å; N289-F292 WeakPolarHBondContact O-CD1 3.33Å; N289-F292 WeakPolarHBondContact O-CG 3.15Å; N289-F292 PolarHBondContact O-N 3Å; N289-F292 VanDerWaalsContact OD1-CE1 3.23Å; N289-F292 WeakPolarHBondContact OD1-CE1 3.4Å; N289-Y293 WeakPolarHBondContact O-CD2 3.37Å; N289-Y293 PolarHBondContact O-N 3.42Å
290L94.1Very high94.4Very high29 Ų2948.2 Ų48.215%0.15224%0.24CC..Hα-helixtrans-61.7-39.6179.2-167.7151000111.1L254 T286 L287 F292 Y293 L294L254-L290 HydrophobicContact CD2-CD1 3.67Å; L254-L290 HydrophobicContact CG-CD1 3.84Å; T286-L290 PolarHBondContact O-N 3Å; L287-L290 PolarHBondContact O-N 3.3Å; L290-F292 PolarHBondContact O-N 3.47Å; L290-Y293 WeakPolarHBondContact O-CB 3.13Å; L290-Y293 PolarHBondContact O-N 3.5Å; L290-Y293 VanDerWaalsContact O-N 3.16Å; L290-L294 HydrophobicContact CD2-CD1 3.67Å; L290-L294 HydrophobicContact CD2-CG 3.92Å; L290-L294 PolarHBondContact O-N 2.88Å
291Y94.9Very high94Very high142 Ų14246.1 Ų46.156%0.55723%0.228SC*.Hα-helixtrans-60.3-44.6178.1175.7-102.6000113.2L170 L287 L288 N289 Y293 L294 R295L170-Y291 HydrophobicContact CD2-CD1 3.62Å; L170-Y291 HydrophobicContact CD2-CE1 4.17Å; L287-Y291 PolarHBondContact O-N 3.02Å; L288-Y291 PolarHBondContact O-N 2.95Å; N289-Y291 VanDerWaalsContact C-N 3.27Å; N289-Y291 PolarHBondContact O-N 3.48Å; Y291-Y293 VanDerWaalsContact C-N 3.27Å; Y291-Y293 PolarHBondContact O-N 3.37Å; Y291-L294 WeakPolarHBondContact O-CB 3.05Å; Y291-L294 PolarHBondContact O-N 3.23Å; Y291-L294 VanDerWaalsContact O-N 3.16Å; Y291-R295 PolarHBondContact O-N 3.28Å
292F93.5Very high93.8Very high10 Ų1048.1 Ų48.14%0.04424%0.238CC..Hα-helixtrans-69.7-26.3177.470.4-115000112.8L170 I178 L288 N289 L290 R295 L296L170-F292 HydrophobicContact CD2-CB 4.09Å; L170-F292 HydrophobicContact CD2-CD1 4.46Å; I178-F292 HydrophobicContact CG2-CD2 3.81Å; I178-F292 HydrophobicContact CG2-CE2 3.46Å; I178-F292 VanDerWaalsContact CG2-CE2 3.46Å; I178-F292 HydrophobicContact CG2-CZ 4.45Å; L288-F292 WeakPolarHBondContact O-CD1 3.34Å; L288-F292 PolarHBondContact O-N 2.77Å; N289-F292 HydrophobicContact CB-CE1 3.9Å; N289-F292 HydrophobicContact CB-CZ 4.12Å; N289-F292 WeakPolarHBondContact O-CD1 3.33Å; N289-F292 WeakPolarHBondContact O-CG 3.15Å; N289-F292 PolarHBondContact O-N 3Å; N289-F292 VanDerWaalsContact OD1-CE1 3.23Å; N289-F292 WeakPolarHBondContact OD1-CE1 3.4Å; L290-F292 PolarHBondContact O-N 3.47Å; F292-R295 PolarHBondContact O-N 3.21Å; F292-L296 PolarHBondContact O-N 3.16Å; F292-L296 VanDerWaalsContact O-N 3.15Å
293Y94.4Very high93.6Very high2 Ų251 Ų511%0.00826%0.256CS..Hα-helixtrans-65.6-43.2168.8-64.1-42.5000111.6I178 S182 L248 L251 N289 L290 Y291 R295 L296 I297I178-Y293 HydrophobicContact CG2-CE1 4.23Å; S182-Y293 WeakPolarHBondContact CB-OH 3.45Å; L248-Y293 HydrophobicContact CB-CD1 4.16Å; L248-Y293 HydrophobicContact CB-CG 4.27Å; L248-Y293 HydrophobicContact CD2-CD1 3.82Å; L248-Y293 HydrophobicContact CD2-CE1 3.83Å; L248-Y293 HydrophobicContact CG-CD1 4.47Å; L248-Y293 WeakPolarHBondContact O-CD2 3.31Å; L251-Y293 HydrophobicContact CB-CE2 4.04Å; N289-Y293 WeakPolarHBondContact O-CD2 3.37Å; N289-Y293 PolarHBondContact O-N 3.42Å; L290-Y293 WeakPolarHBondContact O-CB 3.13Å; L290-Y293 PolarHBondContact O-N 3.5Å; L290-Y293 VanDerWaalsContact O-N 3.16Å; Y291-Y293 VanDerWaalsContact C-N 3.27Å; Y291-Y293 PolarHBondContact O-N 3.37Å; Y293-R295 VanDerWaalsContact C-N 3.31Å; Y293-R295 PolarHBondContact O-N 3.26Å; Y293-L296 WeakPolarHBondContact O-CB 3.16Å; Y293-L296 PolarHBondContact O-N 2.95Å; Y293-L296 VanDerWaalsContact O-N 3.08Å; Y293-I297 WeakPolarHBondContact O-CG1 3.31Å; Y293-I297 PolarHBondContact O-N 3.01Å
294L94.7Very high93.4Very high54 Ų5454.8 Ų54.828%0.28327%0.271SS..Hα-helixtrans-58.4-42.8175-68.9175.1000111.9L249 L290 Y291 L296 I297 Y298L249-L294 HydrophobicContact CD2-CD2 4.08Å; L290-L294 HydrophobicContact CD2-CD1 3.67Å; L290-L294 HydrophobicContact CD2-CG 3.92Å; L290-L294 PolarHBondContact O-N 2.88Å; Y291-L294 WeakPolarHBondContact O-CB 3.05Å; Y291-L294 PolarHBondContact O-N 3.23Å; Y291-L294 VanDerWaalsContact O-N 3.16Å; L294-L296 VanDerWaalsContact C-N 3.29Å; L294-L296 PolarHBondContact O-N 3.11Å; L294-I297 PolarHBondContact O-N 3.4Å; L294-Y298 HydrophobicContact CB-CE2 4.43Å; L294-Y298 VanDerWaalsContact O-CD2 3.27Å; L294-Y298 WeakPolarHBondContact O-CD2 3.26Å; L294-Y298 PolarHBondContact O-N 3.06Å
295R94.4Very high93.2Very high145 Ų14553.9 Ų53.955%0.54726%0.263SS..Hα-helixtrans-57.9-41.7174.6-175.2-179.3177-170.32.6112.1L170 Y291 F292 Y293 S299L170-R295 PolarHBondContact O-NH1 3.4Å; Y291-R295 PolarHBondContact O-N 3.28Å; F292-R295 PolarHBondContact O-N 3.21Å; Y293-R295 VanDerWaalsContact C-N 3.31Å; Y293-R295 PolarHBondContact O-N 3.26Å; R295-S299 PolarHBondContact O-N 3.31Å
296L93.3Very high93Very high6 Ų658.9 Ų58.93%0.03130%0.297CS..Hα-helixtrans-67.3-42.1177.1-170.3166.6000111.1L175 I178 T227 L230 L248 F292 Y293 L294 Y298 S299 T300L175-L296 HydrophobicContact CD2-CD1 3.67Å; L175-L296 HydrophobicContact CD2-CG 4.35Å; I178-L296 HydrophobicContact CD1-CD1 4.01Å; T227-L296 HydrophobicContact CG2-CG 4.42Å; L230-L296 HydrophobicContact CD2-CD2 3.51Å; L230-L296 HydrophobicContact CD2-CG 4.3Å; L248-L296 HydrophobicContact CD1-CD1 3.89Å; L248-L296 HydrophobicContact CD1-CD2 3.34Å; L248-L296 HydrophobicContact CD1-CG 4.13Å; F292-L296 PolarHBondContact O-N 3.16Å; F292-L296 VanDerWaalsContact O-N 3.15Å; Y293-L296 WeakPolarHBondContact O-CB 3.16Å; Y293-L296 PolarHBondContact O-N 2.95Å; Y293-L296 VanDerWaalsContact O-N 3.08Å; L294-L296 VanDerWaalsContact C-N 3.29Å; L294-L296 PolarHBondContact O-N 3.11Å; L296-Y298 PolarHBondContact O-N 2.91Å; L296-S299 PolarHBondContact O-N 3.4Å; L296-S299 VanDerWaalsContact O-N 3.13Å; L296-S299 PolarHBondContact O-OG 3.47Å; L296-T300 HydrophobicContact CD2-CG2 4.04Å; L296-T300 WeakPolarHBondContact O-CG2 3.35Å; L296-T300 PolarHBondContact O-N 3.06Å; L296-T300 PolarHBondContact O-OG1 3.07Å; L296-T300 VanDerWaalsContact O-OG1 3.05Å
297I94.4Very high92.9Very high5 Ų561.1 Ų61.13%0.02631%0.307CS..Hα-helixtrans-62.7-42.9178.6-66.9165000111.1P245 L249 Y293 L294 S299 T300 S301 I302P245-I297 HydrophobicContact CB-CB 4.49Å; P245-I297 HydrophobicContact CB-CD1 4.17Å; P245-I297 HydrophobicContact CB-CG1 3.85Å; P245-I297 HydrophobicContact CB-CG2 3.92Å; P245-I297 HydrophobicContact CG-CG1 4.43Å; P245-I297 HydrophobicContact CG-CG2 4.2Å; L249-I297 HydrophobicContact CD1-CD1 4.06Å; L249-I297 HydrophobicContact CD2-CD1 3.46Å; L249-I297 VanDerWaalsContact CD2-CD1 3.46Å; L249-I297 HydrophobicContact CG-CD1 3.52Å; Y293-I297 WeakPolarHBondContact O-CG1 3.31Å; Y293-I297 PolarHBondContact O-N 3.01Å; L294-I297 PolarHBondContact O-N 3.4Å; I297-S299 VanDerWaalsContact C-N 3.26Å; I297-S299 PolarHBondContact O-N 2.98Å; I297-T300 WeakPolarHBondContact CA-OG1 3.49Å; I297-T300 PolarHBondContact O-N 3.04Å; I297-T300 PolarHBondContact O-OG1 3.4Å; I297-T300 VanDerWaalsContact O-OG1 3.08Å; I297-S301 PolarHBondContact O-N 3.08Å; I297-S301 VanDerWaalsContact O-N 3.15Å; I297-I302 HydrophobicContact CG2-CD1 3.54Å; I297-I302 HydrophobicContact CG2-CG1 3.83Å
298Y94Very high92.8Very high125 Ų12558.9 Ų58.949%0.4930%0.3SS..Iπ-helixtrans-58-41173.9-69.1-41.6000111.8L294 L296 T300 I302 T303L294-Y298 HydrophobicContact CB-CE2 4.43Å; L294-Y298 VanDerWaalsContact O-CD2 3.27Å; L294-Y298 WeakPolarHBondContact O-CD2 3.26Å; L294-Y298 PolarHBondContact O-N 3.06Å; L296-Y298 PolarHBondContact O-N 2.91Å; Y298-T300 PolarHBondContact O-N 3.24Å; Y298-T300 VanDerWaalsContact O-N 3.17Å; Y298-I302 HydrophobicContact CD1-CB 4.11Å; Y298-I302 HydrophobicContact CD1-CD1 3.76Å; Y298-I302 HydrophobicContact CD1-CG1 4.5Å; Y298-I302 HydrophobicContact CD1-CG2 4.03Å; Y298-I302 HydrophobicContact CE1-CD1 3.74Å; Y298-I302 HydrophobicContact CE1-CG2 4.34Å; Y298-T303 WeakPolarHBondContact O-CB 3.39Å; Y298-T303 PolarHBondContact O-N 3.23Å; Y298-T303 PolarHBondContact O-OG1 3.1Å
299S91.7Very high92.8Very high27 Ų2762 Ų6219%0.18932%0.317CS..Iπ-helixtrans-70.7-5.4177.973.10000115.2S231 R295 L296 I297 L305S231-S299 WeakPolarHBondContact CB-O 3.3Å; R295-S299 PolarHBondContact O-N 3.31Å; L296-S299 PolarHBondContact O-N 3.4Å; L296-S299 VanDerWaalsContact O-N 3.13Å; L296-S299 PolarHBondContact O-OG 3.47Å; I297-S299 VanDerWaalsContact C-N 3.26Å; I297-S299 PolarHBondContact O-N 2.98Å; S299-L305 WeakPolarHBondContact O-CD1 3.16Å
300T89.1Confident92.9Very high3 Ų367.9 Ų67.92%0.01835%0.349CS..Iπ-helixtrans-123.8-70.6-170.251.10000114.5L230 L296 I297 Y298L230-T300 HydrophobicContact CB-CG2 3.88Å; L230-T300 HydrophobicContact CD2-CG2 3.57Å; L230-T300 HydrophobicContact CG-CG2 3.53Å; L296-T300 HydrophobicContact CD2-CG2 4.04Å; L296-T300 WeakPolarHBondContact O-CG2 3.35Å; L296-T300 PolarHBondContact O-N 3.06Å; L296-T300 PolarHBondContact O-OG1 3.07Å; L296-T300 VanDerWaalsContact O-OG1 3.05Å; I297-T300 WeakPolarHBondContact CA-OG1 3.49Å; I297-T300 PolarHBondContact O-N 3.04Å; I297-T300 PolarHBondContact O-OG1 3.4Å; I297-T300 VanDerWaalsContact O-OG1 3.08Å; Y298-T300 PolarHBondContact O-N 3.24Å; Y298-T300 VanDerWaalsContact O-N 3.17Å
301S88.7Confident92.7Very high39 Ų3967 Ų6727%0.27334%0.344SS..Iπ-helixtrans-99.3-35.5-169.365.10000113.3P245 I297P245-S301 WeakPolarHBondContact CG-OG 3.47Å; I297-S301 PolarHBondContact O-N 3.08Å; I297-S301 VanDerWaalsContact O-N 3.15Å
302I92.4Very high92.6Very high103 Ų10365.5 Ų65.553%0.52834%0.341SS..Iπ-helixtrans-78.8-37.8-173.8-63.7178.8000110.9I297 Y298I297-I302 HydrophobicContact CG2-CD1 3.54Å; I297-I302 HydrophobicContact CG2-CG1 3.83Å; Y298-I302 HydrophobicContact CD1-CB 4.11Å; Y298-I302 HydrophobicContact CD1-CD1 3.76Å; Y298-I302 HydrophobicContact CD1-CG1 4.5Å; Y298-I302 HydrophobicContact CD1-CG2 4.03Å; Y298-I302 HydrophobicContact CE1-CD1 3.74Å; Y298-I302 HydrophobicContact CE1-CG2 4.34Å
303T92.8Very high92.6Very high61 Ų6170.1 Ų70.137%0.37436%0.364SS..SBendtrans-115.9147.6179.176.60000111.4Y298Y298-T303 WeakPolarHBondContact O-CB 3.39Å; Y298-T303 PolarHBondContact O-N 3.23Å; Y298-T303 PolarHBondContact O-OG1 3.1Å
304L92.8Very high92.4Very high114 Ų11474.7 Ų74.760%0.59738%0.384SS*.  trans-91.1128.6174.1-61.5175.6000109.2W234W234-L304 HydrophobicContact CB-CD2 4.24Å; W234-L304 HydrophobicContact CD2-CD2 3.38Å; W234-L304 HydrophobicContact CE3-CD2 3.8Å; W234-L304 HydrophobicContact CG-CD2 3.56Å; W234-L304 HydrophobicContact CZ2-CD1 4.46Å; W234-L304 HydrophobicContact CZ2-CD2 4.23Å; W234-L304 HydrophobicContact CZ3-CD2 4.36Å
305L92.9Very high92.2Very high67 Ų6778.8 Ų78.835%0.35140%0.396SS..  trans-105.5148.6177.2-73.4178.8000111.9S299S299-L305 WeakPolarHBondContact O-CD1 3.16Å
306P91.3Very high92Very high122 Ų12278.6 Ų78.679%0.79240%0.401SS*.  trans-63.6141177.226.6-34000111.3
307M91.3Very high91.9Very high58 Ų5884.4 Ų84.429%0.28643%0.426SS..  trans-136.6156.8-174.2-76.4-68-177.900112.3S231 R232 V311S231-M307 VanDerWaalsContact C-CE 3.48Å; S231-M307 WeakPolarHBondContact OG-CE 3.47Å; R232-M307 HydrophobicContact CB-CE 4.1Å; R232-M307 HydrophobicContact CG-CE 3.25Å; R232-M307 HydrophobicContact CG-SD 3.72Å; M307-V311 HydrophobicContact CB-CG2 4.4Å; M307-V311 HydrophobicContact SD-CG2 4.49Å
308S93.2Very high91.7Very high64 Ų6492.9 Ų92.945%0.44847%0.466SS..  trans-80.5152.6176.963.90000112.7N310 V311S308-N310 PolarHBondContact O-N 3.38Å; S308-N310 VanDerWaalsContact O-N 3.1Å; S308-V311 WeakPolarHBondContact O-CG2 3.41Å; S308-V311 PolarHBondContact O-N 3.02Å; S308-V311 VanDerWaalsContact O-N 3.11Å
309N93.8Very high91.4Very high120 Ų12089.3 Ų89.364%0.64245%0.454SS*.THydrogen-bonded Turntrans-57.2-27.2179.6-79.9-25.7000113.7V311 K312N309-V311 PolarHBondContact O-N 3.26Å; N309-K312 WeakPolarHBondContact O-CB 3.27Å; N309-K312 WeakPolarHBondContact O-CG 3.49Å; N309-K312 PolarHBondContact O-N 3.18Å
310N93.2Very high91.3Very high130 Ų13094.6 Ų94.670%0.69549%0.485SS*.Hα-helixtrans-60.5-18.4178.9-63-4.2000113.3S308 K312S308-N310 PolarHBondContact O-N 3.38Å; S308-N310 VanDerWaalsContact O-N 3.1Å; N310-K312 VanDerWaalsContact C-N 3.27Å; N310-K312 PolarHBondContact O-N 3.08Å
311V91Very high91.2Very high9 Ų997.9 Ų97.96%0.05550%0.499CS..Hα-helixtrans-66-32174.2-179.50000111.3N235 M307 S308 N309 M313 K314N235-V311 HydrophobicContact CB-CG1 3.66Å; M307-V311 HydrophobicContact CB-CG2 4.4Å; M307-V311 HydrophobicContact SD-CG2 4.49Å; S308-V311 WeakPolarHBondContact O-CG2 3.41Å; S308-V311 PolarHBondContact O-N 3.02Å; S308-V311 VanDerWaalsContact O-N 3.11Å; N309-V311 PolarHBondContact O-N 3.26Å; V311-M313 PolarHBondContact O-N 3.14Å; V311-K314 WeakPolarHBondContact O-CB 2.85Å; V311-K314 PolarHBondContact O-N 2.97Å
312K92Very high90.8Very high112 Ų112101.7 Ų101.749%0.48752%0.522SS..Hα-helixtrans-60.9-33.2-179.7-61.4-177.7175.9172.50112.7N309 N310 K314 W315N309-K312 WeakPolarHBondContact O-CB 3.27Å; N309-K312 WeakPolarHBondContact O-CG 3.49Å; N309-K312 PolarHBondContact O-N 3.18Å; N310-K312 VanDerWaalsContact C-N 3.27Å; N310-K312 PolarHBondContact O-N 3.08Å; K312-K314 PolarHBondContact O-N 3.24Å; K312-W315 HydrophobicContact CB-CD2 4.28Å; K312-W315 HydrophobicContact CB-CE3 4.03Å; K312-W315 HydrophobicContact CB-CZ3 4.17Å; K312-W315 HydrophobicContact CD-CH2 4.35Å; K312-W315 HydrophobicContact CD-CZ3 4.25Å; K312-W315 HydrophobicContact CG-CD2 4.46Å; K312-W315 HydrophobicContact CG-CE3 4.12Å; K312-W315 HydrophobicContact CG-CH2 3.75Å; K312-W315 HydrophobicContact CG-CZ2 4.08Å; K312-W315 HydrophobicContact CG-CZ3 3.77Å; K312-W315 VanDerWaalsContact O-CB 3.31Å; K312-W315 WeakPolarHBondContact O-CB 3.05Å; K312-W315 PolarHBondContact O-N 3.03Å; K312-W315 VanDerWaalsContact O-N 3.11Å
313M93.9Very high90.5Very high107 Ų10798.4 Ų98.453%0.52751%0.507SS..Hα-helixtrans-60-33175.1-169.667.4-165.100112V311 W315 Q316 F317V311-M313 PolarHBondContact O-N 3.14Å; M313-W315 PolarHBondContact O-N 3.37Å; M313-Q316 PolarHBondContact O-N 3.15Å; M313-F317 HydrophobicContact CE-CE2 3.78Å; M313-F317 HydrophobicContact CE-CZ 4.12Å; M313-F317 HydrophobicContact CG-CE2 4.45Å; M313-F317 WeakPolarHBondContact O-CD2 3.47Å
314K89.1Confident90.1Very high98 Ų9899.7 Ų99.743%0.42652%0.516SS..THydrogen-bonded Turntrans-76.5-10.1-179.4-66.3-177.1177.7178.70113.5V311 K312 Q316V311-K314 WeakPolarHBondContact O-CB 2.85Å; V311-K314 PolarHBondContact O-N 2.97Å; K312-K314 PolarHBondContact O-N 3.24Å; K314-Q316 VanDerWaalsContact C-N 3.27Å
315W90.3Very high90.2Very high139 Ų139101.7 Ų101.753%0.52752%0.521SS..THydrogen-bonded Turntrans-70.4-27.7175.5-60.5-20.6000112.3N235 K312 M313 F317N235-W315 VanDerWaalsContact O-CD1 3.29Å; N235-W315 PolarHBondContact O-NE1 3.02Å; K312-W315 HydrophobicContact CB-CD2 4.28Å; K312-W315 HydrophobicContact CB-CE3 4.03Å; K312-W315 HydrophobicContact CB-CZ3 4.17Å; K312-W315 HydrophobicContact CD-CH2 4.35Å; K312-W315 HydrophobicContact CD-CZ3 4.25Å; K312-W315 HydrophobicContact CG-CD2 4.46Å; K312-W315 HydrophobicContact CG-CE3 4.12Å; K312-W315 HydrophobicContact CG-CH2 3.75Å; K312-W315 HydrophobicContact CG-CZ2 4.08Å; K312-W315 HydrophobicContact CG-CZ3 3.77Å; K312-W315 VanDerWaalsContact O-CB 3.31Å; K312-W315 WeakPolarHBondContact O-CB 3.05Å; K312-W315 PolarHBondContact O-N 3.03Å; K312-W315 VanDerWaalsContact O-N 3.11Å; M313-W315 PolarHBondContact O-N 3.37Å; W315-F317 VanDerWaalsContact C-N 3.28Å; W315-F317 PolarHBondContact O-N 3.08Å
316Q91.1Very high90.3Very high141 Ų14199 Ų9966%0.65951%0.507SS*.SBendtrans-74.8-20-179.6-62.6176.1-14.300112.8M313 K314M313-Q316 PolarHBondContact O-N 3.15Å; K314-Q316 VanDerWaalsContact C-N 3.27Å
317F91.6Very high90.4Very high129 Ų12997.6 Ų97.657%0.56650%0.498SS*.SBendtrans-112.1126.8-174.6-59.8-71000111.6M313 W315M313-F317 HydrophobicContact CE-CE2 3.78Å; M313-F317 HydrophobicContact CE-CZ 4.12Å; M313-F317 HydrophobicContact CG-CE2 4.45Å; M313-F317 WeakPolarHBondContact O-CD2 3.47Å; W315-F317 VanDerWaalsContact C-N 3.28Å; W315-F317 PolarHBondContact O-N 3.08Å
318E90.2Very high90.6Very high182 Ų18298.6 Ų98.685%0.8551%0.507SS*.  trans-77166.1172.6-64.1-170.916900112.7
319H87.3Confident90.8Very high51 Ų5197 Ų9724%0.23649%0.494CS..  trans-85.2123.8179.8-80.1-111000111.7L221 K236 L237L221-H319 PolarHBondContact O-CE1 3.03Å; L221-H319 PolarHBondContact O-ND1 3.05Å; K236-H319 WeakPolarHBondContact CD-NE2 3.31Å; K236-H319 WeakPolarHBondContact CE-NE2 3.39Å; K236-H319 PolarHBondContact NZ-CE1 3.35Å; K236-H319 PolarHBondContact NZ-NE2 3.5Å; L237-H319 WeakPolarHBondContact CD1-CE1 3.46Å; L237-H319 WeakPolarHBondContact CD1-NE2 3.49Å; L237-H319 WeakPolarHBondContact CG-NE2 3.46Å
320T90Very high90.9Very high137 Ų13792.4 Ų92.484%0.8447%0.468SS*.  trans-108.113.6176.955.30000113.5
321K86.3Confident91Very high73 Ų7388.2 Ų88.232%0.31745%0.452SS..  trans-73.4137.1-175.6-71.6-177.5-176.9163.50111.1N220 L221 S223 T323N220-K321 WeakPolarHBondContact O-CD 3.46Å; N220-K321 WeakPolarHBondContact O-CE 3.42Å; N220-K321 PolarHBondContact O-NZ 3.17Å; L221-K321 HydrophobicContact CD2-CB 4.36Å; L221-K321 PolarHBondContact O-NZ 3.47Å; S223-K321 PolarHBondContact OG-NZ 2.9Å; K321-T323 PolarHBondContact O-N 3.33Å
322P80.3Confident91.2Very high118 Ų11891.2 Ų91.277%0.76647%0.467SS*.  trans-72.2115.5177.829.1-33.1000110
323T85.5Confident91.4Very high35 Ų3585.9 Ų85.922%0.21544%0.444CS..  trans-134.568171.5540000110.7L217 L221 K321 L326L217-T323 HydrophobicContact CD2-CG2 4.47Å; L221-T323 HydrophobicContact CD1-CG2 4.48Å; L221-T323 HydrophobicContact CD2-CG2 3.44Å; L221-T323 VanDerWaalsContact CD2-CG2 3.44Å; L221-T323 HydrophobicContact CG-CG2 3.77Å; K321-T323 PolarHBondContact O-N 3.33Å; T323-L326 HydrophobicContact CG2-CD1 4.38Å
324P85.4Confident91.4Very high87 Ų8782.5 Ų82.557%0.56543%0.429SS*.THydrogen-bonded Turntrans-60.2146.5172.729.4-34.7000109.5L326P324-L326 PolarHBondContact O-N 3.17Å
325F94.5Very high91.6Very high156 Ų15683.8 Ų83.868%0.68444%0.44SS*.THydrogen-bonded Turntrans631.9177.6-51.7-73.4000117.5T328 L329F325-T328 PolarHBondContact O-N 3.08Å; F325-T328 PolarHBondContact O-OG1 3.49Å; F325-L329 VanDerWaalsContact O-CG 3.28Å; F325-L329 WeakPolarHBondContact O-CG 3.46Å; F325-L329 PolarHBondContact O-N 3.04Å
326L94.7Very high91.8Very high12 Ų1277.8 Ų77.86%0.06342%0.419CS..Hα-helixtrans-59.4-45.4178.4174.8145000113.1L217 L218 L221 T323 P324 T328 L329 I330L217-L326 HydrophobicContact CB-CD1 3.64Å; L217-L326 HydrophobicContact CD1-CB 4.39Å; L218-L326 HydrophobicContact CD2-CD1 4.21Å; L218-L326 HydrophobicContact CG-CD1 4.37Å; L221-L326 HydrophobicContact CD1-CD1 3.59Å; L221-L326 HydrophobicContact CD1-CD2 4.29Å; L221-L326 HydrophobicContact CG-CD1 4.29Å; T323-L326 HydrophobicContact CG2-CD1 4.38Å; P324-L326 PolarHBondContact O-N 3.17Å; L326-T328 PolarHBondContact O-N 3.15Å; L326-L329 PolarHBondContact O-N 2.98Å; L326-I330 HydrophobicContact CD2-CD1 3.44Å; L326-I330 VanDerWaalsContact CD2-CD1 3.44Å; L326-I330 HydrophobicContact CD2-CG1 4.44Å; L326-I330 HydrophobicContact CG-CD1 3.91Å; L326-I330 HydrophobicContact CG-CG1 4.49Å; L326-I330 VanDerWaalsContact O-CG1 3.3Å; L326-I330 WeakPolarHBondContact O-CG1 3.27Å; L326-I330 PolarHBondContact O-N 2.87Å
327P94.3Very high91.9Very high92 Ų9273 Ų7360%0.59740%0.398SS*.Hα-helixtrans-62.5-41.6179.8-24.335.1000113.1I330 A331P327-I330 PolarHBondContact O-N 3.13Å; P327-A331 PolarHBondContact O-N 3.35Å; P327-A331 VanDerWaalsContact O-N 3.07Å
328T95.9Very high92.1Very high78 Ų7872.1 Ų72.148%0.47941%0.405SS..Hα-helixtrans-66-42.5178.750.50000111.2F325 L326 I330 A331 L332F325-T328 PolarHBondContact O-N 3.08Å; F325-T328 PolarHBondContact O-OG1 3.49Å; L326-T328 PolarHBondContact O-N 3.15Å; T328-I330 VanDerWaalsContact C-N 3.31Å; T328-I330 PolarHBondContact O-N 3.38Å; T328-A331 WeakPolarHBondContact O-CB 3.39Å; T328-A331 PolarHBondContact O-N 3.16Å; T328-L332 WeakPolarHBondContact O-CG 3.16Å; T328-L332 PolarHBondContact O-N 3.16Å; T328-L332 VanDerWaalsContact O-N 3.12Å
329L96.8Very high92.3Very high32 Ų3267.8 Ų67.817%0.16839%0.386CS..Hα-helixtrans-64.5-37.5176.5-66.7167.2000111.8I210 T214 L217 F325 L326 L332 T333I210-L329 HydrophobicContact CG2-CD2 4.17Å; T214-L329 HydrophobicContact CG2-CB 3.27Å; T214-L329 HydrophobicContact CG2-CD1 4.36Å; T214-L329 HydrophobicContact CG2-CG 4.37Å; L217-L329 HydrophobicContact CD1-CD1 4.09Å; F325-L329 VanDerWaalsContact O-CG 3.28Å; F325-L329 WeakPolarHBondContact O-CG 3.46Å; F325-L329 PolarHBondContact O-N 3.04Å; L326-L329 PolarHBondContact O-N 2.98Å; L329-L332 CarbonylContact O-C 3.52Å; L329-L332 WeakPolarHBondContact O-CB 3.4Å; L329-L332 PolarHBondContact O-N 3.47Å; L329-L332 VanDerWaalsContact O-N 3.15Å; L329-T333 VanDerWaalsContact O-CG2 3.26Å; L329-T333 WeakPolarHBondContact O-CG2 3.41Å; L329-T333 PolarHBondContact O-N 2.82Å
330I95.4Very high92.5Very high22 Ų2266.6 Ų66.611%0.11338%0.384CS..Hα-helixtrans-61.8-44.9175.6-72.6172.5000111T214 L218 L243 L326 P327 T328 L332 T333T214-I330 HydrophobicContact CG2-CG1 4.43Å; L218-I330 HydrophobicContact CD2-CD1 4.34Å; L243-I330 HydrophobicContact CD1-CD1 3.9Å; L243-I330 HydrophobicContact CD2-CD1 4.18Å; L243-I330 HydrophobicContact CD2-CG2 3.7Å; L243-I330 HydrophobicContact CG-CD1 4.43Å; L326-I330 HydrophobicContact CD2-CD1 3.44Å; L326-I330 VanDerWaalsContact CD2-CD1 3.44Å; L326-I330 HydrophobicContact CD2-CG1 4.44Å; L326-I330 HydrophobicContact CG-CD1 3.91Å; L326-I330 HydrophobicContact CG-CG1 4.49Å; L326-I330 VanDerWaalsContact O-CG1 3.3Å; L326-I330 WeakPolarHBondContact O-CG1 3.27Å; L326-I330 PolarHBondContact O-N 2.87Å; P327-I330 PolarHBondContact O-N 3.13Å; T328-I330 VanDerWaalsContact C-N 3.31Å; T328-I330 PolarHBondContact O-N 3.38Å; I330-L332 PolarHBondContact O-N 3.31Å; I330-T333 PolarHBondContact O-N 3.37Å; I330-T333 PolarHBondContact O-OG1 2.96Å
331A95.5Very high92.6Very high43 Ų4364.3 Ų64.336%0.35537%0.371SS..Hα-helixtrans-56.1-41.6174.600000111.2P327 T328 T333 T334 L335P327-A331 PolarHBondContact O-N 3.35Å; P327-A331 VanDerWaalsContact O-N 3.07Å; T328-A331 WeakPolarHBondContact O-CB 3.39Å; T328-A331 PolarHBondContact O-N 3.16Å; A331-T333 VanDerWaalsContact C-N 3.32Å; A331-T333 PolarHBondContact O-N 3.16Å; A331-T334 PolarHBondContact O-N 3.38Å; A331-L335 WeakPolarHBondContact O-CB 3.47Å; A331-L335 PolarHBondContact O-N 3.25Å
332L96Very high93Very high71 Ų7167.2 Ų67.237%0.37238%0.384SS..Hα-helixtrans-70.4-19.6176.4-62.7169.3000114.2I210 T258 T328 L329 I330 L336I210-L332 HydrophobicContact CG2-CB 4.02Å; T258-L332 WeakPolarHBondContact CG2-O 3.41Å; T258-L332 PolarHBondContact OG1-O 3.38Å; T328-L332 WeakPolarHBondContact O-CG 3.16Å; T328-L332 PolarHBondContact O-N 3.16Å; T328-L332 VanDerWaalsContact O-N 3.12Å; L329-L332 CarbonylContact O-C 3.52Å; L329-L332 WeakPolarHBondContact O-CB 3.4Å; L329-L332 PolarHBondContact O-N 3.47Å; L329-L332 VanDerWaalsContact O-N 3.15Å; I330-L332 PolarHBondContact O-N 3.31Å; L332-L336 HydrophobicContact CB-CD1 4.29Å; L332-L336 HydrophobicContact CD2-CD1 3.81Å
333T95.1Very high93.7Very high0 Ų062.6 Ų62.60%035%0.353CS..Hα-helixtrans-79.3-16.9176.562.90000114.2I210 L211 T214 T247 T258 L329 I330 A331I210-T333 HydrophobicContact CG2-CG2 4.11Å; L211-T333 HydrophobicContact CD2-CG2 3.73Å; T214-T333 HydrophobicContact CG2-CG2 3.59Å; T247-T333 HydrophobicContact CG2-CG2 4.21Å; T258-T333 VanDerWaalsContact CG2-O 3.28Å; T258-T333 WeakPolarHBondContact CG2-O 3.38Å; T258-T333 VanDerWaalsContact OG1-C 3.29Å; T258-T333 PolarHBondContact OG1-O 2.93Å; L329-T333 VanDerWaalsContact O-CG2 3.26Å; L329-T333 WeakPolarHBondContact O-CG2 3.41Å; L329-T333 PolarHBondContact O-N 2.82Å; I330-T333 PolarHBondContact O-N 3.37Å; I330-T333 PolarHBondContact O-OG1 2.96Å; A331-T333 VanDerWaalsContact C-N 3.32Å; A331-T333 PolarHBondContact O-N 3.16Å
334T93.4Very high94Very high36 Ų3663.6 Ų63.622%0.22136%0.356CS..Hα-helixtrans-125.5-47.8-174.258.40000112.8L257 T258 A331 L336L257-T334 HydrophobicContact CD2-CG2 3.9Å; T258-T334 WeakPolarHBondContact CG2-O 3.33Å; A331-T334 PolarHBondContact O-N 3.38Å; T334-L336 PolarHBondContact O-N 3.26Å
335L94.7Very high94.3Very high125 Ų12567 Ų6765%0.65437%0.366SS*.THydrogen-bonded Turntrans-88.40.3-168.1-60.2174.5000114.4A331 P338A331-L335 WeakPolarHBondContact O-CB 3.47Å; A331-L335 PolarHBondContact O-N 3.25Å; L335-P338 WeakPolarHBondContact O-CD 3.44Å
336L94.3Very high94.1Very high13 Ų1364.3 Ų64.37%0.06836%0.358CS..THydrogen-bonded Turntrans-82.9-16.7-173.5-178.5157.8000113.4T258 L261 L332 T334 I339 M343T258-L336 HydrophobicContact CG2-CB 3.56Å; T258-L336 HydrophobicContact CG2-CD2 4.49Å; L261-L336 HydrophobicContact CD1-CD2 4.36Å; L332-L336 HydrophobicContact CB-CD1 4.29Å; L332-L336 HydrophobicContact CD2-CD1 3.81Å; T334-L336 PolarHBondContact O-N 3.26Å; L336-I339 PolarHBondContact O-N 3.48Å; L336-I339 VanDerWaalsContact O-N 3.08Å; L336-M343 HydrophobicContact CD1-CE 4.1Å; L336-M343 HydrophobicContact CD1-SD 3.83Å; L336-M343 HydrophobicContact CD2-CE 4.04Å; L336-M343 HydrophobicContact CD2-CG 3.51Å; L336-M343 HydrophobicContact CD2-SD 3.78Å; L336-M343 HydrophobicContact CG-CG 4.12Å; L336-M343 HydrophobicContact CG-SD 3.93Å
337L93.4Very high92.9Very high42 Ų4268.7 Ų68.722%0.2238%0.381CS..G310 helixtrans-57.1-43.2-176.1-17675.7000114.6P255 F260 L261 I339 S340P255-L337 WeakPolarHBondContact O-CD2 3.48Å; F260-L337 HydrophobicContact CD1-CD1 4.37Å; L261-L337 HydrophobicContact CB-CD1 4.16Å; L337-I339 PolarHBondContact O-N 2.95Å; L337-I339 VanDerWaalsContact O-N 3.11Å; L337-S340 WeakPolarHBondContact O-CB 3.29Å; L337-S340 PolarHBondContact O-N 3.11Å
338P94.3Very high92.8Very high110 Ų11067.5 Ų67.571%0.71437%0.37SS*.G310 helixtrans-63.6-16.6179.1-22.235.3000114L335 S340L335-P338 WeakPolarHBondContact O-CD 3.44Å; P338-S340 VanDerWaalsContact C-N 3.27Å; P338-S340 PolarHBondContact O-N 2.89Å
339I94.4Very high92.6Very high90 Ų9066.9 Ų66.946%0.46237%0.365SS..G310 helixtrans-97.124.8-177.4-52.3168.5000109.8L336 L337 P341 F342 M343L336-I339 PolarHBondContact O-N 3.48Å; L336-I339 VanDerWaalsContact O-N 3.08Å; L337-I339 PolarHBondContact O-N 2.95Å; L337-I339 VanDerWaalsContact O-N 3.11Å; I339-P341 VanDerWaalsContact C-CD 3.49Å; I339-F342 HydrophobicContact CG2-CB 3.57Å; I339-F342 HydrophobicContact CG2-CD1 3.75Å; I339-F342 HydrophobicContact CG2-CG 3.97Å; I339-F342 PolarHBondContact O-N 3.36Å; I339-M343 PolarHBondContact O-N 3.04Å; I339-M343 VanDerWaalsContact O-N 3.15Å
340S92.3Very high92.4Very high27 Ų2768.9 Ų68.919%0.18938%0.376CS..Hα-helixtrans-58.4-39.9-17464.90000115.4L337 P338 F342 M343 L344L337-S340 WeakPolarHBondContact O-CB 3.29Å; L337-S340 PolarHBondContact O-N 3.11Å; P338-S340 VanDerWaalsContact C-N 3.27Å; P338-S340 PolarHBondContact O-N 2.89Å; S340-F342 VanDerWaalsContact C-N 3.31Å; S340-F342 PolarHBondContact O-N 3.17Å; S340-M343 PolarHBondContact O-N 3.43Å; S340-L344 WeakPolarHBondContact O-CG 3.01Å; S340-L344 PolarHBondContact O-N 2.6Å
341P92.3Very high92.2Very high88 Ų8871.6 Ų71.657%0.57139%0.391SS*.Hα-helixtrans-66.7-36.1180-2034.9000112.1I339 L344 M345I339-P341 VanDerWaalsContact C-CD 3.49Å; P341-L344 PolarHBondContact O-N 3.35Å; P341-M345 WeakPolarHBondContact O-CG 3.38Å; P341-M345 PolarHBondContact O-N 3.08Å
342F95.1Very high92Very high134 Ų13473.4 Ų73.459%0.58839%0.393SS*.Hα-helixtrans-65.5-43.6176.1174.5-99.2000110.9I339 S340 L344 M345 I346I339-F342 HydrophobicContact CG2-CB 3.57Å; I339-F342 HydrophobicContact CG2-CD1 3.75Å; I339-F342 HydrophobicContact CG2-CG 3.97Å; I339-F342 PolarHBondContact O-N 3.36Å; S340-F342 VanDerWaalsContact C-N 3.31Å; S340-F342 PolarHBondContact O-N 3.17Å; F342-L344 VanDerWaalsContact C-N 3.25Å; F342-L344 PolarHBondContact O-N 3.37Å; F342-M345 PolarHBondContact O-N 2.68Å; F342-I346 HydrophobicContact CD1-CD1 3.95Å; F342-I346 HydrophobicContact CD1-CG1 4.25Å; F342-I346 HydrophobicContact CE1-CD1 3.63Å; F342-I346 HydrophobicContact CE1-CG1 3.94Å; F342-I346 HydrophobicContact CZ-CD1 4.34Å; F342-I346 HydrophobicContact CZ-CG1 4.22Å; F342-I346 WeakPolarHBondContact O-CG1 3.1Å; F342-I346 PolarHBondContact O-N 3.1Å
343M93.8Very high91.8Very high22 Ų2273.6 Ų73.611%0.10840%0.395CS..Hα-helixtrans-59.8-35178.8-70.2-63.6-55.600113.6L203 L261 L336 I339 S340 M345 I346L203-M343 HydrophobicContact CD1-CB 4.31Å; L261-M343 HydrophobicContact CD1-CB 4.37Å; L336-M343 HydrophobicContact CD1-CE 4.1Å; L336-M343 HydrophobicContact CD1-SD 3.83Å; L336-M343 HydrophobicContact CD2-CE 4.04Å; L336-M343 HydrophobicContact CD2-CG 3.51Å; L336-M343 HydrophobicContact CD2-SD 3.78Å; L336-M343 HydrophobicContact CG-CG 4.12Å; L336-M343 HydrophobicContact CG-SD 3.93Å; I339-M343 PolarHBondContact O-N 3.04Å; I339-M343 VanDerWaalsContact O-N 3.15Å; S340-M343 PolarHBondContact O-N 3.43Å; M343-M345 VanDerWaalsContact C-N 3.28Å; M343-M345 PolarHBondContact O-N 3.28Å; M343-I346 HydrophobicContact CE-CD1 4.2Å; M343-I346 HydrophobicContact SD-CD1 3.67Å
344L92Very high91.5Very high56 Ų5678.9 Ų78.929%0.29342%0.423SS..Hα-helixtrans-68.9-27.7177.5-70.4167.9000112.9M200 L203 V265 S340 P341 F342M200-L344 HydrophobicContact CE-CD2 4Å; M200-L344 HydrophobicContact SD-CD2 3.87Å; L203-L344 HydrophobicContact CD2-CD2 3.61Å; V265-L344 HydrophobicContact CB-CD2 4.48Å; V265-L344 HydrophobicContact CG1-CD2 3.85Å; V265-L344 HydrophobicContact CG2-CD1 4.44Å; V265-L344 HydrophobicContact CG2-CD2 3.98Å; S340-L344 WeakPolarHBondContact O-CG 3.01Å; S340-L344 PolarHBondContact O-N 2.6Å; P341-L344 PolarHBondContact O-N 3.35Å; F342-L344 VanDerWaalsContact C-N 3.25Å; F342-L344 PolarHBondContact O-N 3.37Å
345M92.3Very high91.4Very high157 Ų15782.2 Ų82.277%0.77344%0.438SS*.Hα-helixtrans-96.1-2.3-176.5-65.3-66.3-164.400114.1P341 F342 M343 L347P341-M345 WeakPolarHBondContact O-CG 3.38Å; P341-M345 PolarHBondContact O-N 3.08Å; F342-M345 PolarHBondContact O-N 2.68Å; M343-M345 VanDerWaalsContact C-N 3.28Å; M343-M345 PolarHBondContact O-N 3.28Å; M345-L347 PolarHBondContact O-N 3.43Å
346I89.6Confident91.1Very high100 Ų10078.6 Ų78.651%0.51342%0.42SS..  trans-66.4-23.7175.6-70.9170000111.3F342 M343F342-I346 HydrophobicContact CD1-CD1 3.95Å; F342-I346 HydrophobicContact CD1-CG1 4.25Å; F342-I346 HydrophobicContact CE1-CD1 3.63Å; F342-I346 HydrophobicContact CE1-CG1 3.94Å; F342-I346 HydrophobicContact CZ-CD1 4.34Å; F342-I346 HydrophobicContact CZ-CG1 4.22Å; F342-I346 WeakPolarHBondContact O-CG1 3.1Å; F342-I346 PolarHBondContact O-N 3.1Å; M343-I346 HydrophobicContact CE-CD1 4.2Å; M343-I346 HydrophobicContact SD-CD1 3.67Å
347L69.6Low90.8Very high104 Ų10484.5 Ų84.555%0.54545%0.452SS..  trans-101.40172.5-62.2167.6000108.9N199 I202 M345N199-L347 WeakPolarHBondContact O-CD1 3.45Å; I202-L347 HydrophobicContact CB-CD1 3.64Å; I202-L347 HydrophobicContact CB-CD2 4.31Å; I202-L347 HydrophobicContact CD1-CD2 4.45Å; I202-L347 HydrophobicContact CG2-CD1 3.64Å; I202-L347 HydrophobicContact CG2-CD2 3.57Å; I202-L347 HydrophobicContact CG2-CG 4.23Å; M345-L347 PolarHBondContact O-N 3.43Å

Retrieved 347 of 347 residues in 206.1 ms (Link to these results)

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