A0A023ZSE2_HUMAN Loading...

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 A0A023ZSE2, 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
1M80.8Confident94.4Very high99 Ų9981.5 Ų81.549%0.48846%0.459SS..  0145.90-70-177.587.700109.1I9 P42 K46 M48M1-I9 HydrophobicContact CE-CD1 4.38Å; M1-P42 HydrophobicContact CE-CB 3.62Å; M1-P42 WeakPolarHBondContact CE-O 3.09Å; M1-P42 VanDerWaalsContact SD-O 3.42Å; M1-K46 HydrophobicContact SD-CB 4.12Å; M1-K46 HydrophobicContact SD-CG 3.47Å; M1-K46 WeakPolarHBondContact SD-CG 3.33Å; M1-M48 HydrophobicContact CG-CE 4.32Å
2N92.1Very high94.7Very high92 Ų9279.3 Ų79.349%0.49245%0.449SS..  trans-67122.4179.8-174.8-6.6000110.7L4 A5N2-L4 PolarHBondContact O-N 3.05Å; N2-L4 WeakPolarHBondContact OD1-CB 3.47Å; N2-L4 PolarHBondContact OD1-N 3.25Å; N2-A5 HydrophobicContact CB-CB 4.14Å; N2-A5 PolarHBondContact O-N 3.38Å
3P92.3Very high94.9Very high93 Ų9373.8 Ų73.860%0.60442%0.417SS*.G310 helixtrans-61.2-33.117725.8-34.4000112.2A5 Q6 P7P3-A5 VanDerWaalsContact C-N 3.25Å; P3-A5 PolarHBondContact O-N 3.38Å; P3-Q6 WeakPolarHBondContact O-CB 3.42Å; P3-Q6 PolarHBondContact O-N 3.32Å; P3-P7 WeakPolarHBondContact O-CD 3.44Å
4L95.5Very high95.1Very high142 Ų14276.8 Ų76.874%0.74342%0.424SS*.G310 helixtrans-67.1-25.1179.4-61.1173.6000113.1N2 P7N2-L4 PolarHBondContact O-N 3.05Å; N2-L4 WeakPolarHBondContact OD1-CB 3.47Å; N2-L4 PolarHBondContact OD1-N 3.25Å; L4-P7 WeakPolarHBondContact O-CD 3.35Å
5A95.6Very high95.3Very high37 Ų3774 Ų7431%0.30642%0.415SS..G310 helixtrans-82-16.7178.200000112.9N2 P3 V8 I9N2-A5 HydrophobicContact CB-CB 4.14Å; N2-A5 PolarHBondContact O-N 3.38Å; P3-A5 VanDerWaalsContact C-N 3.25Å; P3-A5 PolarHBondContact O-N 3.38Å; A5-V8 PolarHBondContact O-N 2.89Å; A5-I9 WeakPolarHBondContact O-CG1 3.18Å; A5-I9 PolarHBondContact O-N 3.23Å; A5-I9 VanDerWaalsContact O-N 3.17Å
6Q94.8Very high95.4Very high77 Ų7769.4 Ų69.436%0.3639%0.389SS..Hα-helixtrans-63.8-44.4-176.1-63.3-176.89.200113.6P3 V8 I9 Y10P3-Q6 WeakPolarHBondContact O-CB 3.42Å; P3-Q6 PolarHBondContact O-N 3.32Å; Q6-V8 VanDerWaalsContact C-N 3.3Å; Q6-V8 PolarHBondContact O-N 3.34Å; Q6-I9 PolarHBondContact O-N 3.15Å; Q6-Y10 HydrophobicContact CB-CD2 4.21Å; Q6-Y10 HydrophobicContact CB-CE2 3.93Å; Q6-Y10 WeakPolarHBondContact O-CD2 3.46Å; Q6-Y10 PolarHBondContact O-N 3.25Å
7P97.3Very high95.5Very high86 Ų8666.1 Ų66.156%0.55837%0.371SS*.Hα-helixtrans-58.5-42.1177.3-25.235.3000112.5P3 L4 I9 Y10 S11P3-P7 WeakPolarHBondContact O-CD 3.44Å; L4-P7 WeakPolarHBondContact O-CD 3.35Å; P7-I9 PolarHBondContact O-N 3.5Å; P7-Y10 PolarHBondContact O-N 3.48Å; P7-S11 WeakPolarHBondContact O-CB 3.34Å; P7-S11 PolarHBondContact O-N 3.39Å; P7-S11 PolarHBondContact O-OG 3.09Å
8V97.6Very high95.6Very high92 Ų9266.6 Ų66.656%0.55837%0.372SS*.Hα-helixtrans-60.3-48.4178-176.10000110.1A5 Q6 Y10 S11 T12A5-V8 PolarHBondContact O-N 2.89Å; Q6-V8 VanDerWaalsContact C-N 3.3Å; Q6-V8 PolarHBondContact O-N 3.34Å; V8-Y10 PolarHBondContact O-N 3.16Å; V8-S11 PolarHBondContact O-N 3.42Å; V8-S11 PolarHBondContact O-OG 3.3Å; V8-T12 WeakPolarHBondContact O-CG2 3.45Å; V8-T12 PolarHBondContact O-N 3.08Å; V8-T12 VanDerWaalsContact O-N 3.12Å; V8-T12 PolarHBondContact O-OG1 3.09Å
9I97.4Very high95.8Very high32 Ų3265.9 Ų65.916%0.16437%0.367CS..Hα-helixtrans-63.3-43.8179.2-64.9164.8000112.2M1 A5 Q6 P7 T12 I13 A39 P42 V43M1-I9 HydrophobicContact CE-CD1 4.38Å; A5-I9 WeakPolarHBondContact O-CG1 3.18Å; A5-I9 PolarHBondContact O-N 3.23Å; A5-I9 VanDerWaalsContact O-N 3.17Å; Q6-I9 PolarHBondContact O-N 3.15Å; P7-I9 PolarHBondContact O-N 3.5Å; I9-T12 PolarHBondContact O-N 3.21Å; I9-T12 PolarHBondContact O-OG1 2.92Å; I9-I13 HydrophobicContact CG2-CD1 4.1Å; I9-I13 WeakPolarHBondContact O-CG1 3.19Å; I9-I13 PolarHBondContact O-N 3.45Å; I9-I13 VanDerWaalsContact O-N 3.11Å; I9-A39 WeakPolarHBondContact CG2-O 2.99Å; I9-P42 HydrophobicContact CD1-CB 4.15Å; I9-V43 HydrophobicContact CG2-CG2 3.98Å
10Y97.3Very high95.8Very high81 Ų8162.7 Ų62.732%0.31835%0.349SS..Hα-helixtrans-71.5-33.4-179.9-66.4-54.8000112.6Q6 P7 V8 T12 I13 F14 V43 K46 L129Q6-Y10 HydrophobicContact CB-CD2 4.21Å; Q6-Y10 HydrophobicContact CB-CE2 3.93Å; Q6-Y10 WeakPolarHBondContact O-CD2 3.46Å; Q6-Y10 PolarHBondContact O-N 3.25Å; P7-Y10 PolarHBondContact O-N 3.48Å; V8-Y10 PolarHBondContact O-N 3.16Å; Y10-T12 VanDerWaalsContact C-N 3.32Å; Y10-T12 PolarHBondContact O-N 3.21Å; Y10-I13 HydrophobicContact CD1-CD1 4.11Å; Y10-I13 PolarHBondContact O-N 3.2Å; Y10-F14 PolarHBondContact O-N 2.69Å; Y10-V43 HydrophobicContact CE1-CG2 4.14Å; Y10-K46 PolarHBondContact OH-NZ 2.7Å; Y10-L129 HydrophobicContact CE1-CD1 3.98Å
11S97.7Very high95.7Very high65 Ų6562.2 Ų62.246%0.45535%0.353SS..Hα-helixtrans-64-36.917469.70000112.3P7 V8 F14 A15P7-S11 WeakPolarHBondContact O-CB 3.34Å; P7-S11 PolarHBondContact O-N 3.39Å; P7-S11 PolarHBondContact O-OG 3.09Å; V8-S11 PolarHBondContact O-N 3.42Å; V8-S11 PolarHBondContact O-OG 3.3Å; S11-F14 PolarHBondContact O-N 2.94Å; S11-A15 WeakPolarHBondContact O-CB 3.44Å; S11-A15 PolarHBondContact O-N 3.42Å
12T97.6Very high96.5Very high56 Ų5663.8 Ų63.834%0.34436%0.363SS..Hα-helixtrans-73.3-35.2176.552.70000112.3V8 I9 Y10 F14 G16 A39V8-T12 WeakPolarHBondContact O-CG2 3.45Å; V8-T12 PolarHBondContact O-N 3.08Å; V8-T12 VanDerWaalsContact O-N 3.12Å; V8-T12 PolarHBondContact O-OG1 3.09Å; I9-T12 PolarHBondContact O-N 3.21Å; I9-T12 PolarHBondContact O-OG1 2.92Å; Y10-T12 VanDerWaalsContact C-N 3.32Å; Y10-T12 PolarHBondContact O-N 3.21Å; T12-F14 VanDerWaalsContact C-N 3.33Å; T12-G16 PolarHBondContact O-N 3.34Å; T12-A39 VanDerWaalsContact OG1-CB 3.27Å; T12-A39 WeakPolarHBondContact OG1-CB 3.14Å
13I97.9Very high96.6Very high7 Ų760 Ų604%0.03634%0.344CS..Hα-helixtrans-61.7-42.1169.6-67.6165.4000110.9I9 Y10 T17 N36 A39 F40 V43 W133I9-I13 HydrophobicContact CG2-CD1 4.1Å; I9-I13 WeakPolarHBondContact O-CG1 3.19Å; I9-I13 PolarHBondContact O-N 3.45Å; I9-I13 VanDerWaalsContact O-N 3.11Å; Y10-I13 HydrophobicContact CD1-CD1 4.11Å; Y10-I13 PolarHBondContact O-N 3.2Å; I13-T17 PolarHBondContact O-N 3.02Å; I13-T17 PolarHBondContact O-OG1 3.12Å; I13-N36 PolarHBondContact O-OD1 3.03Å; I13-A39 HydrophobicContact CG1-CB 3.61Å; I13-F40 HydrophobicContact CD1-CD2 4.08Å; I13-V43 HydrophobicContact CD1-CG2 3.94Å; I13-W133 VanDerWaalsContact CG2-CD1 3.45Å; I13-W133 HydrophobicContact CG2-CG 4.47Å
14F98Very high96.6Very high116 Ų11659.5 Ų59.551%0.50934%0.343SS..Hα-helixtrans-65.4-51177.4178-98.4000111.5Y10 S11 T12 G16 T17 L18 W133Y10-F14 PolarHBondContact O-N 2.69Å; S11-F14 PolarHBondContact O-N 2.94Å; T12-F14 VanDerWaalsContact C-N 3.33Å; F14-G16 VanDerWaalsContact C-N 3.31Å; F14-G16 PolarHBondContact O-N 3.07Å; F14-T17 PolarHBondContact O-N 3.41Å; F14-T17 PolarHBondContact O-OG1 3.37Å; F14-L18 HydrophobicContact CE1-CD2 4.04Å; F14-L18 WeakPolarHBondContact O-CB 3.25Å; F14-L18 PolarHBondContact O-N 3.26Å; F14-W133 AromaticContact CD2-CH2 3.85Å; F14-W133 HydrophobicContact CD2-CH2 3.85Å; F14-W133 AromaticContact CD2-CZ2 3.77Å; F14-W133 HydrophobicContact CD2-CZ2 3.77Å; F14-W133 HydrophobicContact CE2-CH2 4.27Å
15A97.7Very high96.6Very high35 Ų3555.8 Ų55.829%0.28932%0.321SS..Hα-helixtrans-60.7-39.6178.700000112S11 T17 L18 I19S11-A15 WeakPolarHBondContact O-CB 3.44Å; S11-A15 PolarHBondContact O-N 3.42Å; A15-T17 PolarHBondContact O-N 3.37Å; A15-L18 PolarHBondContact O-N 3.24Å; A15-I19 WeakPolarHBondContact O-CB 3.47Å; A15-I19 WeakPolarHBondContact O-CD1 3.42Å; A15-I19 WeakPolarHBondContact O-CG1 3.39Å; A15-I19 PolarHBondContact O-N 2.67Å
16G97.6Very high96.6Very high0 Ų054.1 Ų54.10%031%0.307CS..Hα-helixtrans-57.9-49.3176.800000112.4T12 F14 T20 G32 N36T12-G16 PolarHBondContact O-N 3.34Å; F14-G16 VanDerWaalsContact C-N 3.31Å; F14-G16 PolarHBondContact O-N 3.07Å; G16-T20 PolarHBondContact O-N 3.24Å; G16-G32 CarbonylContact C-O 3.59Å; G16-G32 CarbonylContact O-C 3.57Å; G16-G32 WeakPolarHBondContact O-CA 3.43Å; G16-N36 VanDerWaalsContact C-ND2 3.31Å; G16-N36 VanDerWaalsContact C-OD1 3.31Å; G16-N36 WeakPolarHBondContact CA-OD1 3.36Å
17T97Very high96.6Very high13 Ų1354.9 Ų54.98%0.0831%0.309CS..Hα-helixtrans-66.6-33.6174.747.20000113.7I13 F14 A15 T20 A21 N36 W133 A137I13-T17 PolarHBondContact O-N 3.02Å; I13-T17 PolarHBondContact O-OG1 3.12Å; F14-T17 PolarHBondContact O-N 3.41Å; F14-T17 PolarHBondContact O-OG1 3.37Å; A15-T17 PolarHBondContact O-N 3.37Å; T17-T20 PolarHBondContact O-OG1 3.44Å; T17-A21 PolarHBondContact O-N 3.34Å; T17-N36 WeakPolarHBondContact CA-ND2 3.39Å; T17-N36 WeakPolarHBondContact CG2-ND2 3.12Å; T17-N36 PolarHBondContact N-ND2 3.1Å; T17-N36 VanDerWaalsContact N-ND2 3.16Å; T17-N36 PolarHBondContact N-OD1 2.95Å; T17-W133 VanDerWaalsContact CG2-NE1 3.28Å; T17-W133 WeakPolarHBondContact OG1-CZ2 3.45Å; T17-W133 PolarHBondContact OG1-NE1 2.87Å; T17-A137 HydrophobicContact CG2-CB 4.12Å
18L97.5Very high96.6Very high75 Ų7556.1 Ų56.139%0.39331%0.306SS..Hα-helixtrans-71-41.3179-17565.2000111.1F14 A15 T20 A21 L22F14-L18 HydrophobicContact CE1-CD2 4.04Å; F14-L18 WeakPolarHBondContact O-CB 3.25Å; F14-L18 PolarHBondContact O-N 3.26Å; A15-L18 PolarHBondContact O-N 3.24Å; L18-T20 VanDerWaalsContact C-N 3.29Å; L18-T20 PolarHBondContact O-N 3.49Å; L18-A21 PolarHBondContact O-N 3.32Å; L18-L22 HydrophobicContact CD1-CD1 4.24Å; L18-L22 HydrophobicContact CD1-CG 4.27Å; L18-L22 HydrophobicContact CD2-CD1 4.22Å; L18-L22 HydrophobicContact CG-CD1 3.76Å; L18-L22 HydrophobicContact CG-CG 4.2Å; L18-L22 WeakPolarHBondContact O-CG 3.33Å; L18-L22 PolarHBondContact O-N 2.71Å
19I97.8Very high96.6Very high55 Ų5551.8 Ų51.828%0.28228%0.28SS..Hα-helixtrans-62.1-37.4178.9-72.3165.3000110.9A15 A21 L22 S23 M35A15-I19 WeakPolarHBondContact O-CB 3.47Å; A15-I19 WeakPolarHBondContact O-CD1 3.42Å; A15-I19 WeakPolarHBondContact O-CG1 3.39Å; A15-I19 PolarHBondContact O-N 2.67Å; I19-A21 VanDerWaalsContact C-N 3.3Å; I19-A21 PolarHBondContact O-N 2.84Å; I19-L22 PolarHBondContact O-N 2.96Å; I19-S23 VanDerWaalsContact O-CB 3.25Å; I19-S23 WeakPolarHBondContact O-CB 3.4Å; I19-S23 PolarHBondContact O-N 3.41Å; I19-S23 PolarHBondContact O-OG 3.17Å; I19-M35 HydrophobicContact CB-CE 4.29Å; I19-M35 HydrophobicContact CD1-CE 3.32Å; I19-M35 HydrophobicContact CD1-SD 4.39Å; I19-M35 HydrophobicContact CG1-CE 4.37Å; I19-M35 HydrophobicContact CG2-CE 4.28Å
20T96.4Very high96.6Very high0 Ų052.5 Ų52.50%028%0.281CS..Hα-helixtrans-63.9-34.7173.354.30000113G16 T17 L18 S23 T29 L33 A137G16-T20 PolarHBondContact O-N 3.24Å; T17-T20 PolarHBondContact O-OG1 3.44Å; L18-T20 VanDerWaalsContact C-N 3.29Å; L18-T20 PolarHBondContact O-N 3.49Å; T20-S23 PolarHBondContact O-OG 3.15Å; T20-T29 WeakPolarHBondContact CG2-O 3.31Å; 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 3.29Å; T20-A137 WeakPolarHBondContact OG1-CB 3.27Å
21A94.3Very high96.6Very high54 Ų5450.4 Ų50.445%0.44628%0.276SS..Hα-helixtrans-77.4-35.7179.500000112.4T17 L18 I19T17-A21 PolarHBondContact O-N 3.34Å; L18-A21 PolarHBondContact O-N 3.32Å; I19-A21 VanDerWaalsContact C-N 3.3Å; I19-A21 PolarHBondContact O-N 2.84Å
22L96.3Very high96.6Very high131 Ų13147.3 Ų47.369%0.68625%0.254SS*.Hα-helixtrans-79.7-21-178.9-69176000113.9L18 I19L18-L22 HydrophobicContact CD1-CD1 4.24Å; L18-L22 HydrophobicContact CD1-CG 4.27Å; L18-L22 HydrophobicContact CD2-CD1 4.22Å; L18-L22 HydrophobicContact CG-CD1 3.76Å; L18-L22 HydrophobicContact CG-CG 4.2Å; L18-L22 WeakPolarHBondContact O-CG 3.33Å; L18-L22 PolarHBondContact O-N 2.71Å; I19-L22 PolarHBondContact O-N 2.96Å
23S94.9Very high96.6Very high13 Ų1345 Ų459%0.09124%0.24CC..  trans-78.2133.1-17140.40000112.7I19 T20 F28 T29I19-S23 VanDerWaalsContact O-CB 3.25Å; I19-S23 WeakPolarHBondContact O-CB 3.4Å; I19-S23 PolarHBondContact O-N 3.41Å; I19-S23 PolarHBondContact O-OG 3.17Å; T20-S23 PolarHBondContact O-OG 3.15Å; S23-F28 VanDerWaalsContact CB-CB 3.47Å; S23-T29 WeakPolarHBondContact OG-CG2 3.31Å; S23-T29 PolarHBondContact OG-N 3.16Å
24S93.5Very high96.6Very high83 Ų8346 Ų4658%0.5825%0.245SC*.  trans-96.3-22.8167.957.70000112.6T85 M86S24-T85 CarbonylContact O-C 3.6Å; S24-T85 WeakPolarHBondContact O-CA 3.45Å; S24-M86 WeakPolarHBondContact O-CG 3.42Å; S24-M86 PolarHBondContact O-N 3.38Å
25H95.1Very high96.5Very high63 Ų6343.4 Ų43.429%0.29224%0.235SC..BIsolated β-bridgetrans-94.5129.5-179.4-169.4-75.6000110.8F27 F28 T29 W84H25-F27 VanDerWaalsContact ND1-CB 3.29Å; H25-F27 WeakPolarHBondContact ND1-CB 3.14Å; H25-F27 PolarHBondContact ND1-N 3.04Å; H25-F27 PolarHBondContact O-N 3.34Å; H25-F27 VanDerWaalsContact O-N 3.12Å; H25-F28 HydrophobicContact CB-CD2 4.06Å; H25-F28 PolarHBondContact O-N 3.33Å; H25-T29 PolarHBondContact O-N 2.82Å; H25-W84 WeakPolarHBondContact CA-O 3.35Å; H25-W84 AromaticContact CE1-CD2 3.71Å; H25-W84 AromaticContact CE1-CE3 3.2Å; H25-W84 AromaticContact CE1-CZ3 3.86Å; H25-W84 WeakPolarHBondContact NE2-CB 3.37Å; H25-W84 AromaticContact NE2-CD2 3.58Å; H25-W84 AromaticContact NE2-CE3 3.59Å; H25-W84 AromaticContact NE2-CG 3.53Å
26W94.4Very high96.4Very high2 Ų242 Ų421%0.00822%0.222CC..Hα-helixtrans-53.3-34.9-177.9-85.3105.4000114.4F28 T29 W30 I74 W84 T85 M86 T90 I98 I141 I145W26-F28 PolarHBondContact O-N 3.41Å; W26-T29 PolarHBondContact O-N 2.99Å; W26-T29 PolarHBondContact O-OG1 3.19Å; W26-W30 PolarHBondContact O-N 2.89Å; W26-W30 VanDerWaalsContact O-N 3.17Å; W26-I74 HydrophobicContact CB-CB 4.35Å; W26-I74 HydrophobicContact CB-CD1 3.91Å; W26-I74 HydrophobicContact CB-CG1 3.85Å; W26-I74 HydrophobicContact CB-CG2 3.55Å; W26-I74 HydrophobicContact CD2-CD1 4.43Å; W26-I74 HydrophobicContact CD2-CG1 3.92Å; W26-I74 HydrophobicContact CE3-CD1 3.86Å; W26-I74 HydrophobicContact CE3-CG1 3.6Å; W26-I74 HydrophobicContact CG-CG1 4.07Å; W26-I74 HydrophobicContact CG-CG2 4.2Å; W26-I74 HydrophobicContact CZ3-CG1 4.44Å; W26-I74 WeakPolarHBondContact O-CD1 3.39Å; W26-W84 VanDerWaalsContact CD1-O 3.28Å; W26-W84 PolarHBondContact N-O 2.89Å; W26-T85 PolarHBondContact NE1-O 3.47Å; W26-M86 HydrophobicContact CD2-CE 4.26Å; W26-M86 HydrophobicContact CD2-SD 3.13Å; W26-M86 HydrophobicContact CE3-CE 4.09Å; W26-M86 HydrophobicContact CE3-SD 3.31Å; W26-M86 HydrophobicContact CG-SD 3.71Å; W26-M86 HydrophobicContact CH2-CE 3.45Å; W26-M86 VanDerWaalsContact CH2-CE 3.45Å; W26-M86 HydrophobicContact CH2-SD 3.68Å; W26-M86 HydrophobicContact CZ2-CE 3.62Å; W26-M86 HydrophobicContact CZ2-SD 3.51Å; W26-M86 VanDerWaalsContact CZ2-SD 3.51Å; W26-M86 HydrophobicContact CZ3-CE 3.7Å; W26-M86 HydrophobicContact CZ3-SD 3.59Å; W26-M86 VanDerWaalsContact CZ3-SD 3.59Å; W26-T90 HydrophobicContact CH2-CG2 4.41Å; W26-T90 HydrophobicContact CZ2-CG2 3.67Å; W26-I98 HydrophobicContact CH2-CD1 3.52Å; W26-I98 HydrophobicContact CH2-CG1 4.38Å; W26-I98 HydrophobicContact CZ2-CD1 4.07Å; W26-I98 HydrophobicContact CZ3-CD1 4.02Å; W26-I98 HydrophobicContact CZ3-CG1 4.49Å; W26-I141 HydrophobicContact CH2-CG2 4.48Å; W26-I141 HydrophobicContact CZ3-CG2 4.25Å; W26-I145 HydrophobicContact CH2-CG2 3.66Å; W26-I145 HydrophobicContact CZ2-CG2 3.77Å
27F96.4Very high96.4Very high93 Ų9342.1 Ų42.141%0.40822%0.223SC..Hα-helixtrans-62.5-40175.9-174.7-105.1000112.9H25 W30 V31H25-F27 VanDerWaalsContact ND1-CB 3.29Å; H25-F27 WeakPolarHBondContact ND1-CB 3.14Å; H25-F27 PolarHBondContact ND1-N 3.04Å; H25-F27 PolarHBondContact O-N 3.34Å; H25-F27 VanDerWaalsContact O-N 3.12Å; F27-W30 HydrophobicContact CD2-CE3 4.33Å; F27-W30 AromaticContact CE2-CE3 3.9Å; F27-W30 HydrophobicContact CE2-CE3 3.9Å; F27-W30 HydrophobicContact CE2-CZ3 4.02Å; F27-W30 HydrophobicContact CZ-CE3 4.35Å; F27-W30 HydrophobicContact CZ-CZ3 4.24Å; F27-W30 WeakPolarHBondContact O-CB 3.44Å; F27-W30 PolarHBondContact O-N 3.27Å; F27-V31 HydrophobicContact CD1-CG2 3.93Å; F27-V31 HydrophobicContact CE1-CG2 3.55Å; F27-V31 HydrophobicContact CZ-CG2 3.89Å; F27-V31 WeakPolarHBondContact O-CG2 3.35Å; F27-V31 PolarHBondContact O-N 3.17Å
28F97.1Very high96.4Very high113 Ų11346.5 Ų46.550%0.49625%0.245SC..Hα-helixtrans-73.5-29.3-179.9-70.7-48.3000112.5S23 H25 W26 W30 V31 G32S23-F28 VanDerWaalsContact CB-CB 3.47Å; H25-F28 HydrophobicContact CB-CD2 4.06Å; H25-F28 PolarHBondContact O-N 3.33Å; W26-F28 PolarHBondContact O-N 3.41Å; F28-W30 VanDerWaalsContact C-N 3.31Å; F28-V31 PolarHBondContact O-N 3.48Å; F28-G32 PolarHBondContact O-N 3.3Å
29T96.3Very high96.4Very high0 Ų043.5 Ų43.50%023%0.231CC..Hα-helixtrans-63.4-41.117062.40000110.5T20 S23 H25 W26 G32 L33 M86T20-T29 WeakPolarHBondContact CG2-O 3.31Å; S23-T29 WeakPolarHBondContact OG-CG2 3.31Å; S23-T29 PolarHBondContact OG-N 3.16Å; H25-T29 PolarHBondContact O-N 2.82Å; W26-T29 PolarHBondContact O-N 2.99Å; W26-T29 PolarHBondContact O-OG1 3.19Å; T29-G32 PolarHBondContact O-N 2.6Å; T29-L33 WeakPolarHBondContact O-CG 3.48Å; T29-L33 PolarHBondContact O-N 3.47Å; T29-L33 VanDerWaalsContact O-N 3.17Å; T29-M86 HydrophobicContact CG2-CE 4.47Å; T29-M86 HydrophobicContact CG2-CG 4.11Å; T29-M86 HydrophobicContact CG2-SD 3.82Å
30W97.7Very high96.4Very high48 Ų4840.9 Ų40.918%0.18222%0.218CC..Hα-helixtrans-62.5-46.2172.6178.586.8000112.5W26 F27 F28 G32 L33 E34 S67 L70 L71 I74W26-W30 PolarHBondContact O-N 2.89Å; W26-W30 VanDerWaalsContact O-N 3.17Å; F27-W30 HydrophobicContact CD2-CE3 4.33Å; F27-W30 AromaticContact CE2-CE3 3.9Å; F27-W30 HydrophobicContact CE2-CE3 3.9Å; F27-W30 HydrophobicContact CE2-CZ3 4.02Å; F27-W30 HydrophobicContact CZ-CE3 4.35Å; F27-W30 HydrophobicContact CZ-CZ3 4.24Å; F27-W30 WeakPolarHBondContact O-CB 3.44Å; F27-W30 PolarHBondContact O-N 3.27Å; F28-W30 VanDerWaalsContact C-N 3.31Å; W30-G32 VanDerWaalsContact C-N 3.32Å; W30-G32 PolarHBondContact O-N 3.1Å; W30-L33 WeakPolarHBondContact O-CB 3.3Å; W30-L33 PolarHBondContact O-N 3.09Å; W30-L33 VanDerWaalsContact O-N 3.14Å; W30-E34 HydrophobicContact CD2-CG 4.04Å; W30-E34 HydrophobicContact CE3-CG 4.34Å; W30-E34 HydrophobicContact CH2-CG 3.88Å; W30-E34 HydrophobicContact CZ2-CG 3.54Å; W30-E34 HydrophobicContact CZ3-CG 4.27Å; W30-E34 PolarHBondContact O-N 3.39Å; W30-S67 PolarHBondContact NE1-O 3.42Å; W30-S67 VanDerWaalsContact NE1-O 3.12Å; W30-L70 HydrophobicContact CB-CD2 3.69Å; W30-L70 HydrophobicContact CG-CD2 4.02Å; W30-L71 HydrophobicContact CD2-CD1 3.91Å; W30-L71 HydrophobicContact CE3-CD1 4.36Å; W30-L71 HydrophobicContact CG-CD1 4.27Å; W30-L71 HydrophobicContact CZ2-CD1 4.07Å; W30-I74 HydrophobicContact CB-CD1 4.26Å
31V97.9Very high96.4Very high37 Ų3742.7 Ų42.722%0.22423%0.227CC..Hα-helixtrans-58.1-43177.7170.40000111.5F27 F28 L33 E34 M35F27-V31 HydrophobicContact CD1-CG2 3.93Å; F27-V31 HydrophobicContact CE1-CG2 3.55Å; F27-V31 HydrophobicContact CZ-CG2 3.89Å; F27-V31 WeakPolarHBondContact O-CG2 3.35Å; F27-V31 PolarHBondContact O-N 3.17Å; F28-V31 PolarHBondContact O-N 3.48Å; V31-L33 PolarHBondContact O-N 3.17Å; V31-E34 PolarHBondContact O-N 3.35Å; V31-M35 HydrophobicContact CG1-CE 3.7Å; V31-M35 HydrophobicContact CG1-SD 4.45Å; V31-M35 PolarHBondContact O-N 3.13Å
32G97.6Very high96.5Very high0 Ų042 Ų420%022%0.218CC..Hα-helixtrans-62.5-40.2176.700000113.1G16 F28 T29 W30 N36G16-G32 CarbonylContact C-O 3.59Å; G16-G32 CarbonylContact O-C 3.57Å; G16-G32 WeakPolarHBondContact O-CA 3.43Å; F28-G32 PolarHBondContact O-N 3.3Å; T29-G32 PolarHBondContact O-N 2.6Å; W30-G32 VanDerWaalsContact C-N 3.32Å; W30-G32 PolarHBondContact O-N 3.1Å; G32-N36 PolarHBondContact O-N 3.39Å; G32-N36 VanDerWaalsContact O-N 3.11Å; G32-N36 PolarHBondContact O-ND2 3.37Å
33L96.6Very high96.5Very high6 Ų635.9 Ų35.93%0.03119%0.186CC..Hα-helixtrans-64.9-38.5174.4-71.1172.6000112.6T20 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 3.48Å; T29-L33 PolarHBondContact O-N 3.47Å; T29-L33 VanDerWaalsContact O-N 3.17Å; W30-L33 WeakPolarHBondContact O-CB 3.3Å; W30-L33 PolarHBondContact O-N 3.09Å; W30-L33 VanDerWaalsContact O-N 3.14Å; V31-L33 PolarHBondContact O-N 3.17Å; L33-M37 WeakPolarHBondContact O-CB 3.01Å; L33-M37 PolarHBondContact O-N 3.09Å; L33-L70 HydrophobicContact CD1-CD1 3.92Å; L33-L70 HydrophobicContact CD1-CD2 4.35Å; L33-M102 HydrophobicContact CD1-CE 4.31Å; L33-K105 HydrophobicContact CD1-CD 4.21Å; L33-K105 HydrophobicContact CD2-CD 4.08Å; L33-A137 HydrophobicContact CD2-CB 4.01Å; L33-P138 HydrophobicContact CD2-CG 4.37Å; L33-I141 HydrophobicContact CD1-CD1 3.63Å; L33-I141 HydrophobicContact CD2-CD1 4.23Å; L33-I141 HydrophobicContact CG-CD1 4.01Å
34E97.7Very high96.6Very high30 Ų3035.3 Ų35.314%0.1418%0.182CC..Hα-helixtrans-68.8-44177.4-78.2-62.6168.400112.6W30 V31 N36 M37 L38 S67W30-E34 HydrophobicContact CD2-CG 4.04Å; W30-E34 HydrophobicContact CE3-CG 4.34Å; W30-E34 HydrophobicContact CH2-CG 3.88Å; W30-E34 HydrophobicContact CZ2-CG 3.54Å; W30-E34 HydrophobicContact CZ3-CG 4.27Å; W30-E34 PolarHBondContact O-N 3.39Å; V31-E34 PolarHBondContact O-N 3.35Å; E34-N36 VanDerWaalsContact C-N 3.29Å; E34-N36 PolarHBondContact O-N 3.17Å; E34-M37 PolarHBondContact O-N 3.06Å; E34-M37 VanDerWaalsContact O-N 3.16Å; E34-L38 WeakPolarHBondContact O-CG 3.42Å; E34-L38 PolarHBondContact O-N 2.96Å; E34-S67 WeakPolarHBondContact OE1-CB 3.5Å; E34-S67 PolarHBondContact OE1-OG 3.32Å
35M96.8Very high96.7Very high61 Ų6132.7 Ų32.730%0.316%0.162SC..Hα-helixtrans-59.7-42.2175-75.9-174-65.700111.7I19 V31 M37 A39I19-M35 HydrophobicContact CB-CE 4.29Å; I19-M35 HydrophobicContact CD1-CE 3.32Å; I19-M35 HydrophobicContact CD1-SD 4.39Å; I19-M35 HydrophobicContact CG1-CE 4.37Å; I19-M35 HydrophobicContact CG2-CE 4.28Å; V31-M35 HydrophobicContact CG1-CE 3.7Å; V31-M35 HydrophobicContact CG1-SD 4.45Å; V31-M35 PolarHBondContact O-N 3.13Å; M35-M37 VanDerWaalsContact C-N 3.35Å; M35-M37 PolarHBondContact O-N 3.41Å; M35-A39 WeakPolarHBondContact O-CB 3.04Å; M35-A39 PolarHBondContact O-N 3.39Å
36N96.5Very high96.4Very high4 Ų432.1 Ų32.12%0.02116%0.159CC..Hα-helixtrans-60-45.1174.8-78.9-27000112.2I13 G16 T17 G32 E34 F40I13-N36 PolarHBondContact O-OD1 3.03Å; G16-N36 VanDerWaalsContact C-ND2 3.31Å; G16-N36 VanDerWaalsContact C-OD1 3.31Å; G16-N36 WeakPolarHBondContact CA-OD1 3.36Å; T17-N36 WeakPolarHBondContact CA-ND2 3.39Å; T17-N36 WeakPolarHBondContact CG2-ND2 3.12Å; T17-N36 PolarHBondContact N-ND2 3.1Å; T17-N36 VanDerWaalsContact N-ND2 3.16Å; T17-N36 PolarHBondContact N-OD1 2.95Å; G32-N36 PolarHBondContact O-N 3.39Å; G32-N36 VanDerWaalsContact O-N 3.11Å; G32-N36 PolarHBondContact O-ND2 3.37Å; E34-N36 VanDerWaalsContact C-N 3.29Å; E34-N36 PolarHBondContact O-N 3.17Å; N36-F40 WeakPolarHBondContact O-CB 3.23Å; N36-F40 PolarHBondContact O-N 2.99Å
37M96.8Very high96.1Very high4 Ų438.6 Ų38.62%0.0219%0.187CC..Hα-helixtrans-62.6-52.8-178.9-177.4-86.3-141.500111.1L33 E34 M35 F40 I41 Y59 F60 Q63 A64L33-M37 WeakPolarHBondContact O-CB 3.01Å; L33-M37 PolarHBondContact O-N 3.09Å; E34-M37 PolarHBondContact O-N 3.06Å; E34-M37 VanDerWaalsContact O-N 3.16Å; M35-M37 VanDerWaalsContact C-N 3.35Å; M35-M37 PolarHBondContact O-N 3.41Å; M37-F40 PolarHBondContact O-N 3.29Å; M37-I41 WeakPolarHBondContact O-CG1 3.45Å; M37-I41 PolarHBondContact O-N 3.05Å; M37-I41 HydrophobicContact SD-CD1 3.77Å; M37-Y59 HydrophobicContact CG-CE1 4.39Å; M37-F60 HydrophobicContact CE-CD2 3.22Å; M37-F60 HydrophobicContact CE-CE2 3.42Å; M37-F60 VanDerWaalsContact CE-CE2 3.42Å; M37-F60 HydrophobicContact CE-CG 4.12Å; M37-F60 HydrophobicContact CE-CZ 4.41Å; M37-F60 HydrophobicContact SD-CD2 3.92Å; M37-F60 HydrophobicContact SD-CE2 4.2Å; M37-Q63 HydrophobicContact CE-CB 4.36Å; M37-Q63 HydrophobicContact CG-CB 3.7Å; M37-A64 HydrophobicContact CE-CB 3.67Å
38L97.6Very high95.8Very high105 Ų10540.2 Ų40.255%0.5520%0.198SC..Hα-helixtrans-65.4-43.7-177.9-67.7174.8000112.3E34 F40 P42E34-L38 WeakPolarHBondContact O-CG 3.42Å; E34-L38 PolarHBondContact O-N 2.96Å; L38-F40 VanDerWaalsContact C-N 3.27Å; L38-F40 PolarHBondContact O-N 3.4Å; L38-P42 VanDerWaalsContact O-CD 3.3Å; L38-P42 WeakPolarHBondContact O-CD 3.42Å
39A97.1Very high95.7Very high12 Ų1238.6 Ų38.610%0.09919%0.194CC..Hα-helixtrans-69-26.518000000112.6I9 T12 I13 M35 P42I9-A39 WeakPolarHBondContact CG2-O 2.99Å; T12-A39 VanDerWaalsContact OG1-CB 3.27Å; T12-A39 WeakPolarHBondContact OG1-CB 3.14Å; I13-A39 HydrophobicContact CG1-CB 3.61Å; M35-A39 WeakPolarHBondContact O-CB 3.04Å; M35-A39 PolarHBondContact O-N 3.39Å; A39-P42 WeakPolarHBondContact O-CD 2.98Å
40F97.6Very high95.6Very high0 Ų043.8 Ų43.80%023%0.228CC..Hα-helixtrans-80.5-25.1-179.2-165.9-113.3000114.1I13 N36 M37 L38 V43 L44 Y59 L129 L130 Q134I13-F40 HydrophobicContact CD1-CD2 4.08Å; N36-F40 WeakPolarHBondContact O-CB 3.23Å; N36-F40 PolarHBondContact O-N 2.99Å; M37-F40 PolarHBondContact O-N 3.29Å; L38-F40 VanDerWaalsContact C-N 3.27Å; L38-F40 PolarHBondContact O-N 3.4Å; F40-V43 HydrophobicContact CD2-CB 4.18Å; F40-V43 HydrophobicContact CD2-CG1 4.48Å; F40-V43 HydrophobicContact CD2-CG2 4.44Å; F40-V43 HydrophobicContact CE2-CB 4.25Å; F40-V43 HydrophobicContact CE2-CG1 4.09Å; F40-V43 VanDerWaalsContact O-CB 3.3Å; F40-V43 WeakPolarHBondContact O-CB 3.18Å; F40-V43 PolarHBondContact O-N 3.08Å; F40-L44 HydrophobicContact CD1-CD1 4.23Å; F40-L44 HydrophobicContact CD1-CD2 4.32Å; F40-L44 HydrophobicContact CD1-CG 4.19Å; F40-L44 HydrophobicContact CE1-CD1 4.3Å; F40-L44 HydrophobicContact CE1-CD2 3.65Å; F40-L44 HydrophobicContact CE1-CG 4.02Å; F40-L44 HydrophobicContact CZ-CD2 4.15Å; F40-L44 PolarHBondContact O-N 3.13Å; F40-Y59 AromaticContact CD1-CE1 3.94Å; F40-Y59 HydrophobicContact CD1-CE1 3.94Å; F40-Y59 HydrophobicContact CD1-CE2 4.22Å; F40-Y59 AromaticContact CD1-CZ 3.68Å; F40-L129 HydrophobicContact CE2-CB 3.63Å; F40-L129 HydrophobicContact CE2-CD1 4.43Å; F40-L129 HydrophobicContact CZ-CB 4.08Å; F40-L130 HydrophobicContact CE1-CB 3.98Å; F40-L130 HydrophobicContact CE1-CD1 3.67Å; F40-L130 HydrophobicContact CE1-CG 4.42Å; F40-L130 HydrophobicContact CZ-CB 3.79Å; F40-L130 HydrophobicContact CZ-CD1 4.35Å; F40-Q134 HydrophobicContact CD1-CG 4.17Å; F40-Q134 HydrophobicContact CD2-CG 4.44Å; F40-Q134 VanDerWaalsContact CD2-NE2 3.29Å; F40-Q134 HydrophobicContact CE1-CG 4.03Å; F40-Q134 HydrophobicContact CE2-CG 4.34Å; F40-Q134 HydrophobicContact CG-CG 4.37Å; F40-Q134 VanDerWaalsContact CG-NE2 3.29Å; F40-Q134 HydrophobicContact CZ-CG 4.14Å
41I97.2Very high95.5Very high38 Ų3847.1 Ų47.120%0.19524%0.24CC..Hα-helixtrans-56.5-48.2-178.8-68.2159.5000113M37 V43 L44 T45 A56 Y59 F60M37-I41 WeakPolarHBondContact O-CG1 3.45Å; M37-I41 PolarHBondContact O-N 3.05Å; M37-I41 HydrophobicContact SD-CD1 3.77Å; I41-V43 PolarHBondContact O-N 3.4Å; I41-V43 VanDerWaalsContact O-N 3.16Å; I41-L44 WeakPolarHBondContact O-CB 3.45Å; I41-L44 PolarHBondContact O-N 3.25Å; I41-T45 PolarHBondContact O-N 3.16Å; I41-A56 HydrophobicContact CG2-CB 4.4Å; I41-Y59 HydrophobicContact CG1-CD1 4.26Å; I41-Y59 HydrophobicContact CG1-CE1 4.41Å; I41-F60 HydrophobicContact CD1-CB 4.42Å; I41-F60 HydrophobicContact CD1-CD2 3.61Å; I41-F60 HydrophobicContact CD1-CE2 4.39Å; I41-F60 HydrophobicContact CD1-CG 4.46Å
42P95.8Very high95.4Very high39 Ų3945.4 Ų45.425%0.25323%0.23SC..Hα-helixtrans-58.7-28.4176.4-25.334.5000113.6M1 I9 L38 A39 L44 T45M1-P42 HydrophobicContact CE-CB 3.62Å; M1-P42 WeakPolarHBondContact CE-O 3.09Å; M1-P42 VanDerWaalsContact SD-O 3.42Å; I9-P42 HydrophobicContact CD1-CB 4.15Å; L38-P42 VanDerWaalsContact O-CD 3.3Å; L38-P42 WeakPolarHBondContact O-CD 3.42Å; A39-P42 WeakPolarHBondContact O-CD 2.98Å; P42-L44 VanDerWaalsContact C-N 3.27Å; P42-L44 PolarHBondContact O-N 3.4Å; P42-T45 PolarHBondContact O-N 3.48Å; P42-T45 PolarHBondContact O-OG1 3.17Å
43V96.6Very high95.3Very high3 Ų348.2 Ų48.22%0.01825%0.247CC..Hα-helixtrans-68.1-30.2178.4179.70000111.3I9 Y10 I13 F40 I41 K46 S126 L129I9-V43 HydrophobicContact CG2-CG2 3.98Å; Y10-V43 HydrophobicContact CE1-CG2 4.14Å; I13-V43 HydrophobicContact CD1-CG2 3.94Å; F40-V43 HydrophobicContact CD2-CB 4.18Å; F40-V43 HydrophobicContact CD2-CG1 4.48Å; F40-V43 HydrophobicContact CD2-CG2 4.44Å; F40-V43 HydrophobicContact CE2-CB 4.25Å; F40-V43 HydrophobicContact CE2-CG1 4.09Å; F40-V43 VanDerWaalsContact O-CB 3.3Å; F40-V43 WeakPolarHBondContact O-CB 3.18Å; F40-V43 PolarHBondContact O-N 3.08Å; I41-V43 PolarHBondContact O-N 3.4Å; I41-V43 VanDerWaalsContact O-N 3.16Å; V43-K46 WeakPolarHBondContact O-CD 3.2Å; V43-K46 WeakPolarHBondContact O-CG 3.47Å; V43-S126 WeakPolarHBondContact O-CB 3.35Å; V43-L129 HydrophobicContact CG1-CD1 4.02Å
44L96.2Very high95.3Very high0 Ų052.4 Ų52.40%027%0.266CS..Hα-helixtrans-74.6-26.4176.7-59.3172.9000112.7F40 I41 P42 S52 A56 Y59 V118 T122F40-L44 HydrophobicContact CD1-CD1 4.23Å; F40-L44 HydrophobicContact CD1-CD2 4.32Å; F40-L44 HydrophobicContact CD1-CG 4.19Å; F40-L44 HydrophobicContact CE1-CD1 4.3Å; F40-L44 HydrophobicContact CE1-CD2 3.65Å; F40-L44 HydrophobicContact CE1-CG 4.02Å; F40-L44 HydrophobicContact CZ-CD2 4.15Å; F40-L44 PolarHBondContact O-N 3.13Å; I41-L44 WeakPolarHBondContact O-CB 3.45Å; I41-L44 PolarHBondContact O-N 3.25Å; P42-L44 VanDerWaalsContact C-N 3.27Å; P42-L44 PolarHBondContact O-N 3.4Å; L44-S52 PolarHBondContact O-OG 3Å; L44-A56 HydrophobicContact CB-CB 4.13Å; L44-A56 HydrophobicContact CD1-CB 4.44Å; L44-Y59 HydrophobicContact CD1-CD1 3.68Å; L44-Y59 HydrophobicContact CD1-CD2 4.42Å; L44-Y59 HydrophobicContact CD1-CE1 4.37Å; L44-Y59 HydrophobicContact CD1-CG 3.7Å; L44-V118 HydrophobicContact CD1-CG1 4.4Å; L44-V118 HydrophobicContact CD2-CG1 4.02Å; L44-T122 HydrophobicContact CB-CG2 4.12Å; L44-T122 HydrophobicContact CD2-CG2 3.72Å
45T95.1Very high95.3Very high28 Ų2851.1 Ų51.117%0.17226%0.261CS..THydrogen-bonded Turntrans-95.88.9-174.357.20000114.6I41 P42 K47 M48 T53 A56I41-T45 PolarHBondContact O-N 3.16Å; P42-T45 PolarHBondContact O-N 3.48Å; P42-T45 PolarHBondContact O-OG1 3.17Å; T45-K47 VanDerWaalsContact C-N 3.3Å; T45-K47 PolarHBondContact O-N 2.99Å; T45-M48 PolarHBondContact O-N 3.38Å; T45-M48 VanDerWaalsContact O-SD 3.41Å; T45-T53 HydrophobicContact CG2-CG2 4.36Å; T45-A56 HydrophobicContact CG2-CB 3.64Å
46K89.9Confident95.3Very high51 Ų5148.5 Ų48.522%0.22225%0.249CC..THydrogen-bonded Turntrans-43.3-43.1-174.4-82.3174.2178.2175.20116.9M1 Y10 V43 P123M1-K46 HydrophobicContact SD-CB 4.12Å; M1-K46 HydrophobicContact SD-CG 3.47Å; M1-K46 WeakPolarHBondContact SD-CG 3.33Å; Y10-K46 PolarHBondContact OH-NZ 2.7Å; V43-K46 WeakPolarHBondContact O-CD 3.2Å; V43-K46 WeakPolarHBondContact O-CG 3.47Å; K46-P123 HydrophobicContact CB-CG 4.28Å; K46-P123 HydrophobicContact CD-CG 4.37Å
47K87.4Confident95.4Very high138 Ų13853.1 Ų53.160%0.627%0.273SS*.THydrogen-bonded Turntrans-90.9-4.9-174.8-71.6-167.8173.3-171.30114.5T45 N49T45-K47 VanDerWaalsContact C-N 3.3Å; T45-K47 PolarHBondContact O-N 2.99Å; K47-N49 PolarHBondContact O-N 3.28Å; K47-N49 VanDerWaalsContact O-N 3.08Å; K47-N49 PolarHBondContact O-OD1 3.04Å
48M91.3Very high95.4Very high127 Ų12756.3 Ų56.363%0.62629%0.287SS*.  trans55.120.8-176.4-54.3-57.2-176.600115.2M1 T45M1-M48 HydrophobicContact CG-CE 4.32Å; T45-M48 PolarHBondContact O-N 3.38Å; T45-M48 VanDerWaalsContact O-SD 3.41Å
49N93.4Very high95.5Very high80 Ų8051.4 Ų51.443%0.42826%0.261SS..  trans-73.2147.3174.4-64-17.9000110K47 R51 S52 T53K47-N49 PolarHBondContact O-N 3.28Å; K47-N49 VanDerWaalsContact O-N 3.08Å; K47-N49 PolarHBondContact O-OD1 3.04Å; N49-R51 PolarHBondContact O-N 3.47Å; N49-R51 VanDerWaalsContact O-N 3.16Å; N49-S52 WeakPolarHBondContact O-CA 3.32Å; N49-S52 VanDerWaalsContact O-CB 3.26Å; N49-S52 WeakPolarHBondContact O-CB 3.37Å; N49-S52 PolarHBondContact O-N 3.14Å; N49-T53 PolarHBondContact O-N 3.41Å; N49-T53 PolarHBondContact O-OG1 3.23Å
50P95.4Very high95.5Very high108 Ų10855.2 Ų55.270%0.70128%0.275SS*.Hα-helixtrans-57.8-34.3176.723.4-34000112S52 T53 E54P50-S52 PolarHBondContact O-N 2.69Å; P50-T53 WeakPolarHBondContact CA-OG1 3.29Å; P50-T53 PolarHBondContact O-N 3.3Å; P50-T53 PolarHBondContact O-OG1 3.11Å; P50-E54 WeakPolarHBondContact O-CB 3.37Å; P50-E54 PolarHBondContact O-N 3.07Å
51R95.1Very high95.6Very high119 Ų11960 Ų6045%0.44930%0.301SS..Hα-helixtrans-68.8-32174.7-165.5178.5-172.8165.310.7113.6N49 A55N49-R51 PolarHBondContact O-N 3.47Å; N49-R51 VanDerWaalsContact O-N 3.16Å; R51-A55 WeakPolarHBondContact O-CB 3.29Å; R51-A55 PolarHBondContact O-N 3.08Å; R51-A55 VanDerWaalsContact O-N 3.11Å
52S95.5Very high95.6Very high1 Ų160 Ų601%0.00730%0.302CS..Hα-helixtrans-72.9-38.2178.8-146.70000110.3L44 N49 P50 A56L44-S52 PolarHBondContact O-OG 3Å; N49-S52 WeakPolarHBondContact O-CA 3.32Å; N49-S52 VanDerWaalsContact O-CB 3.26Å; N49-S52 WeakPolarHBondContact O-CB 3.37Å; N49-S52 PolarHBondContact O-N 3.14Å; P50-S52 PolarHBondContact O-N 2.69Å; S52-A56 PolarHBondContact O-N 2.83Å; S52-A56 VanDerWaalsContact O-N 3.16Å
53T95.9Very high95.7Very high58 Ų5858.6 Ų58.636%0.35629%0.292SS..Hα-helixtrans-72.8-4217753.80000111.5T45 N49 P50 A55 A56 I57T45-T53 HydrophobicContact CG2-CG2 4.36Å; N49-T53 PolarHBondContact O-N 3.41Å; N49-T53 PolarHBondContact O-OG1 3.23Å; P50-T53 WeakPolarHBondContact CA-OG1 3.29Å; P50-T53 PolarHBondContact O-N 3.3Å; P50-T53 PolarHBondContact O-OG1 3.11Å; T53-A55 VanDerWaalsContact C-N 3.32Å; T53-A55 PolarHBondContact O-N 3.2Å; T53-A56 WeakPolarHBondContact O-CB 3.36Å; T53-A56 PolarHBondContact O-N 3.39Å; T53-A56 VanDerWaalsContact O-N 3.08Å; T53-I57 WeakPolarHBondContact O-CG1 3.43Å; T53-I57 PolarHBondContact O-N 3.19Å
54E97.4Very high95.7Very high94 Ų9459.6 Ų59.644%0.43930%0.301SS..Hα-helixtrans-58.5-43172.8-169.8-160.3154.200111.8P50 A56 I57 K58P50-E54 WeakPolarHBondContact O-CB 3.37Å; P50-E54 PolarHBondContact O-N 3.07Å; E54-A56 VanDerWaalsContact C-N 3.3Å; E54-A56 PolarHBondContact O-N 2.82Å; E54-I57 PolarHBondContact O-N 2.92Å; E54-K58 PolarHBondContact O-N 3.36Å; E54-K58 WeakPolarHBondContact OE1-CE 3.34Å; E54-K58 IonicContact OE1-NZ 2.7Å; E54-K58 PolarHBondContact OE1-NZ 3.36Å
55A96.9Very high95.8Very high3 Ų363.1 Ų63.13%0.02532%0.322CS..Hα-helixtrans-59.7-39.9174.100000112.3R51 T53 I57 K58 Y59 V118 T122R51-A55 WeakPolarHBondContact O-CB 3.29Å; R51-A55 PolarHBondContact O-N 3.08Å; R51-A55 VanDerWaalsContact O-N 3.11Å; T53-A55 VanDerWaalsContact C-N 3.32Å; T53-A55 PolarHBondContact O-N 3.2Å; A55-I57 VanDerWaalsContact C-N 3.34Å; A55-I57 PolarHBondContact O-N 3.25Å; A55-K58 PolarHBondContact O-N 2.87Å; A55-Y59 PolarHBondContact O-N 3.36Å; A55-V118 HydrophobicContact CB-CG1 4.47Å; A55-V118 HydrophobicContact CB-CG2 4.44Å; A55-V118 WeakPolarHBondContact O-CG2 3.46Å; A55-T122 HydrophobicContact CB-CG2 4.07Å
56A97.1Very high95.9Very high7 Ų761.8 Ų61.86%0.05831%0.314CS..Hα-helixtrans-63.8-39.6176.600000111.8I41 L44 T45 S52 T53 E54 Y59 F60I41-A56 HydrophobicContact CG2-CB 4.4Å; L44-A56 HydrophobicContact CB-CB 4.13Å; L44-A56 HydrophobicContact CD1-CB 4.44Å; T45-A56 HydrophobicContact CG2-CB 3.64Å; S52-A56 PolarHBondContact O-N 2.83Å; S52-A56 VanDerWaalsContact O-N 3.16Å; T53-A56 WeakPolarHBondContact O-CB 3.36Å; T53-A56 PolarHBondContact O-N 3.39Å; T53-A56 VanDerWaalsContact O-N 3.08Å; E54-A56 VanDerWaalsContact C-N 3.3Å; E54-A56 PolarHBondContact O-N 2.82Å; A56-Y59 PolarHBondContact O-N 3.48Å; A56-F60 WeakPolarHBondContact O-CB 3.49Å; A56-F60 PolarHBondContact O-N 2.74Å
57I97.8Very high96.3Very high101 Ų10159.4 Ų59.452%0.51830%0.304SS..Hα-helixtrans-65.6-45.4176.9-63.5165.7000110.8T53 E54 A55 Y59 F60 L61T53-I57 WeakPolarHBondContact O-CG1 3.43Å; T53-I57 PolarHBondContact O-N 3.19Å; E54-I57 PolarHBondContact O-N 2.92Å; A55-I57 VanDerWaalsContact C-N 3.34Å; A55-I57 PolarHBondContact O-N 3.25Å; I57-Y59 VanDerWaalsContact C-N 3.3Å; I57-Y59 PolarHBondContact O-N 2.96Å; I57-F60 PolarHBondContact O-N 3.33Å; I57-L61 HydrophobicContact CG2-CD1 4.04Å; I57-L61 HydrophobicContact CG2-CG 4.4Å; I57-L61 WeakPolarHBondContact O-CG 3.45Å; I57-L61 PolarHBondContact O-N 2.81Å
58K97.9Very high96.8Very high71 Ų7158.3 Ų58.331%0.30930%0.302SS..Hα-helixtrans-58.9-42.5176.2-71.7-179.1-175.21700111.9E54 A55 T62 E117 V118E54-K58 PolarHBondContact O-N 3.36Å; E54-K58 WeakPolarHBondContact OE1-CE 3.34Å; E54-K58 IonicContact OE1-NZ 2.7Å; E54-K58 PolarHBondContact OE1-NZ 3.36Å; A55-K58 PolarHBondContact O-N 2.87Å; K58-T62 WeakPolarHBondContact O-CG2 3.33Å; K58-T62 PolarHBondContact O-N 3.35Å; K58-T62 PolarHBondContact O-OG1 3.41Å; K58-E117 HydrophobicContact CD-CB 4.21Å; K58-E117 HydrophobicContact CD-CG 4.5Å; K58-V118 HydrophobicContact CB-CG2 4.28Å
59Y98Very high97.1Very high2 Ų254.8 Ų54.81%0.00829%0.286CS..Hα-helixtrans-64.7-45.8175.2177.2-96.1000112M37 F40 I41 L44 A55 A56 I57 L61 T62 Q63 W114 L130 Q134M37-Y59 HydrophobicContact CG-CE1 4.39Å; F40-Y59 AromaticContact CD1-CE1 3.94Å; F40-Y59 HydrophobicContact CD1-CE1 3.94Å; F40-Y59 HydrophobicContact CD1-CE2 4.22Å; F40-Y59 AromaticContact CD1-CZ 3.68Å; I41-Y59 HydrophobicContact CG1-CD1 4.26Å; I41-Y59 HydrophobicContact CG1-CE1 4.41Å; L44-Y59 HydrophobicContact CD1-CD1 3.68Å; L44-Y59 HydrophobicContact CD1-CD2 4.42Å; L44-Y59 HydrophobicContact CD1-CE1 4.37Å; L44-Y59 HydrophobicContact CD1-CG 3.7Å; A55-Y59 PolarHBondContact O-N 3.36Å; A56-Y59 PolarHBondContact O-N 3.48Å; I57-Y59 VanDerWaalsContact C-N 3.3Å; I57-Y59 PolarHBondContact O-N 2.96Å; Y59-L61 PolarHBondContact O-N 3.3Å; Y59-T62 PolarHBondContact O-OG1 3.34Å; Y59-Q63 HydrophobicContact CD1-CG 4.26Å; Y59-Q63 HydrophobicContact CD2-CG 3.87Å; Y59-Q63 HydrophobicContact CE1-CG 4.01Å; Y59-Q63 HydrophobicContact CE2-CG 3.6Å; Y59-Q63 HydrophobicContact CG-CG 4.21Å; 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 3.14Å; Y59-W114 HydrophobicContact CD2-CE3 4.4Å; Y59-W114 HydrophobicContact CD2-CH2 4.21Å; Y59-W114 AromaticContact CD2-CZ3 3.8Å; Y59-W114 HydrophobicContact CD2-CZ3 3.8Å; Y59-W114 HydrophobicContact CE2-CH2 4.32Å; Y59-W114 HydrophobicContact CE2-CZ3 4.31Å; Y59-L130 HydrophobicContact CD2-CD1 4.04Å; Y59-L130 HydrophobicContact CE2-CD1 3.76Å; Y59-Q134 PolarHBondContact OH-OE1 3.32Å
60F98.4Very high97.3Very high91 Ų9151 Ų5140%0.39927%0.265SS..Hα-helixtrans-58.7-49.5-180175.2-101.6000111.6M37 I41 A56 I57 T62 Q63 A64M37-F60 HydrophobicContact CE-CD2 3.22Å; M37-F60 HydrophobicContact CE-CE2 3.42Å; M37-F60 VanDerWaalsContact CE-CE2 3.42Å; M37-F60 HydrophobicContact CE-CG 4.12Å; M37-F60 HydrophobicContact CE-CZ 4.41Å; M37-F60 HydrophobicContact SD-CD2 3.92Å; M37-F60 HydrophobicContact SD-CE2 4.2Å; I41-F60 HydrophobicContact CD1-CB 4.42Å; I41-F60 HydrophobicContact CD1-CD2 3.61Å; I41-F60 HydrophobicContact CD1-CE2 4.39Å; I41-F60 HydrophobicContact CD1-CG 4.46Å; A56-F60 WeakPolarHBondContact O-CB 3.49Å; A56-F60 PolarHBondContact O-N 2.74Å; I57-F60 PolarHBondContact O-N 3.33Å; F60-T62 PolarHBondContact O-N 3.03Å; F60-Q63 PolarHBondContact O-N 3.16Å; F60-A64 WeakPolarHBondContact O-CB 3.48Å; F60-A64 PolarHBondContact O-N 3.39Å
61L98.4Very high97.3Very high102 Ų10248 Ų4853%0.53424%0.243SC..Hα-helixtrans-61-47.2-177.5-70.6173.1000112.1I57 Y59 Q63 T65I57-L61 HydrophobicContact CG2-CD1 4.04Å; I57-L61 HydrophobicContact CG2-CG 4.4Å; I57-L61 WeakPolarHBondContact O-CG 3.45Å; I57-L61 PolarHBondContact O-N 2.81Å; Y59-L61 PolarHBondContact O-N 3.3Å; L61-Q63 PolarHBondContact O-N 2.74Å; L61-T65 WeakPolarHBondContact O-CG2 3.11Å; L61-T65 PolarHBondContact O-N 3.45Å; L61-T65 VanDerWaalsContact O-N 3.13Å; L61-T65 PolarHBondContact O-OG1 2.96Å; L61-T65 VanDerWaalsContact O-OG1 3.12Å
62T97.6Very high97.4Very high37 Ų3747.4 Ų47.423%0.22725%0.247CC..Hα-helixtrans-69.1-35-178.857.30000112.6K58 Y59 F60 T65 A66 W114K58-T62 WeakPolarHBondContact O-CG2 3.33Å; K58-T62 PolarHBondContact O-N 3.35Å; K58-T62 PolarHBondContact O-OG1 3.41Å; Y59-T62 PolarHBondContact O-OG1 3.34Å; F60-T62 PolarHBondContact O-N 3.03Å; T62-T65 PolarHBondContact O-OG1 3.17Å; T62-T65 VanDerWaalsContact O-OG1 3.04Å; T62-A66 WeakPolarHBondContact O-CB 3.37Å; T62-A66 PolarHBondContact O-N 3.17Å; T62-W114 HydrophobicContact CG2-CB 4.22Å; T62-W114 HydrophobicContact CG2-CG 4.12Å
63Q97.7Very high97.4Very high9 Ų947.3 Ų47.34%0.04225%0.246CC..Hα-helixtrans-80-31.5-177.9-65-68.6-1600113M37 Y59 F60 L61 S67 K105M37-Q63 HydrophobicContact CE-CB 4.36Å; M37-Q63 HydrophobicContact CG-CB 3.7Å; Y59-Q63 HydrophobicContact CD1-CG 4.26Å; Y59-Q63 HydrophobicContact CD2-CG 3.87Å; Y59-Q63 HydrophobicContact CE1-CG 4.01Å; Y59-Q63 HydrophobicContact CE2-CG 3.6Å; Y59-Q63 HydrophobicContact CG-CG 4.21Å; 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 3.14Å; F60-Q63 PolarHBondContact O-N 3.16Å; L61-Q63 PolarHBondContact O-N 2.74Å; Q63-S67 PolarHBondContact O-N 3.46Å; Q63-S67 VanDerWaalsContact O-N 3.09Å; Q63-S67 PolarHBondContact O-OG 2.97Å; Q63-K105 PolarHBondContact NE2-O 2.84Å; Q63-K105 PolarHBondContact O-NZ 3.39Å; Q63-K105 VanDerWaalsContact OE1-CG 3.22Å
64A97.1Very high97.3Very high24 Ų2445 Ų4520%0.19823%0.232CC..Hα-helixtrans-70.8-43.4174.300000111.6M37 F60 A66 S67 M68M37-A64 HydrophobicContact CE-CB 3.67Å; F60-A64 WeakPolarHBondContact O-CB 3.48Å; F60-A64 PolarHBondContact O-N 3.39Å; A64-A66 VanDerWaalsContact C-N 3.31Å; A64-A66 PolarHBondContact O-N 3.47Å; A64-S67 PolarHBondContact O-N 3.27Å; A64-S67 PolarHBondContact O-OG 3.24Å; A64-M68 WeakPolarHBondContact O-CG 3.38Å; A64-M68 PolarHBondContact O-N 3.31Å
65T98.1Very high97.2Very high74 Ų7444.6 Ų44.645%0.45423%0.232SC..Hα-helixtrans-62.9-42.8175.454.70000110.9L61 T62 S67 M68 I69L61-T65 WeakPolarHBondContact O-CG2 3.11Å; L61-T65 PolarHBondContact O-N 3.45Å; L61-T65 VanDerWaalsContact O-N 3.13Å; L61-T65 PolarHBondContact O-OG1 2.96Å; L61-T65 VanDerWaalsContact O-OG1 3.12Å; T62-T65 PolarHBondContact O-OG1 3.17Å; T62-T65 VanDerWaalsContact O-OG1 3.04Å; T65-S67 VanDerWaalsContact C-N 3.34Å; T65-S67 PolarHBondContact O-N 2.92Å; T65-M68 PolarHBondContact O-N 2.87Å; T65-I69 VanDerWaalsContact O-CG1 3.28Å; T65-I69 WeakPolarHBondContact O-CG1 3.28Å; T65-I69 PolarHBondContact O-N 3.24Å
66A97.9Very high97.1Very high0 Ų047 Ų470%024%0.242CC..Hα-helixtrans-61.1-39.7176.900000112.9T62 A64 L70 A101 M104 K105T62-A66 WeakPolarHBondContact O-CB 3.37Å; T62-A66 PolarHBondContact O-N 3.17Å; A64-A66 VanDerWaalsContact C-N 3.31Å; A64-A66 PolarHBondContact O-N 3.47Å; A66-L70 PolarHBondContact O-N 3.49Å; A66-A101 WeakPolarHBondContact O-CB 3.28Å; A66-M104 HydrophobicContact CB-CB 3.81Å; A66-M104 HydrophobicContact CB-SD 4.31Å; A66-K105 HydrophobicContact CB-CD 4.49Å; A66-K105 HydrophobicContact CB-CG 3.65Å
67S97.3Very high96.9Very high1 Ų146.9 Ų46.91%0.00724%0.24CC..Hα-helixtrans-72.1-34.8178.961.70000112.9W30 E34 Q63 A64 T65 L70 L71W30-S67 PolarHBondContact NE1-O 3.42Å; W30-S67 VanDerWaalsContact NE1-O 3.12Å; E34-S67 WeakPolarHBondContact OE1-CB 3.5Å; E34-S67 PolarHBondContact OE1-OG 3.32Å; Q63-S67 PolarHBondContact O-N 3.46Å; Q63-S67 VanDerWaalsContact O-N 3.09Å; Q63-S67 PolarHBondContact O-OG 2.97Å; A64-S67 PolarHBondContact O-N 3.27Å; A64-S67 PolarHBondContact O-OG 3.24Å; T65-S67 VanDerWaalsContact C-N 3.34Å; T65-S67 PolarHBondContact O-N 2.92Å; S67-L70 WeakPolarHBondContact O-CB 3.49Å; S67-L70 PolarHBondContact O-N 3.32Å; S67-L71 PolarHBondContact O-N 3.45Å
68M97.9Very high96.7Very high115 Ų11544 Ų4457%0.56723%0.226SC*.Hα-helixtrans-67.2-39173.3-66.2-55.1-65.300112.2A64 T65 L70 L71 M72A64-M68 WeakPolarHBondContact O-CG 3.38Å; A64-M68 PolarHBondContact O-N 3.31Å; T65-M68 PolarHBondContact O-N 2.87Å; M68-L70 VanDerWaalsContact C-N 3.32Å; M68-L70 PolarHBondContact O-N 3.32Å; M68-L71 PolarHBondContact O-N 3.34Å; M68-M72 PolarHBondContact O-N 3.28Å
69I97.9Very high96.4Very high53 Ų5347.2 Ų47.227%0.27224%0.244SC..Hα-helixtrans-63-40.7173.3-66.2164.6000110.6T65 M72 A73 M97 A101 M104T65-I69 VanDerWaalsContact O-CG1 3.28Å; T65-I69 WeakPolarHBondContact O-CG1 3.28Å; T65-I69 PolarHBondContact O-N 3.24Å; I69-M72 WeakPolarHBondContact O-CB 3.4Å; I69-M72 PolarHBondContact O-N 3.46Å; I69-A73 PolarHBondContact O-N 3.39Å; I69-M97 HydrophobicContact CG2-CB 4.31Å; I69-A101 HydrophobicContact CB-CB 4.3Å; I69-A101 HydrophobicContact CG2-CB 4.07Å; I69-M104 HydrophobicContact CD1-CE 3.56Å; I69-M104 HydrophobicContact CD1-SD 4.04Å
70L97.1Very high96.1Very high0 Ų051.3 Ų51.30%027%0.266CS..Hα-helixtrans-61.7-44.1176-173.4130.5000111.6W30 L33 A66 S67 M68 M72 A73 I74 A101 M102W30-L70 HydrophobicContact CB-CD2 3.69Å; W30-L70 HydrophobicContact CG-CD2 4.02Å; L33-L70 HydrophobicContact CD1-CD1 3.92Å; L33-L70 HydrophobicContact CD1-CD2 4.35Å; A66-L70 PolarHBondContact O-N 3.49Å; S67-L70 WeakPolarHBondContact O-CB 3.49Å; S67-L70 PolarHBondContact O-N 3.32Å; M68-L70 VanDerWaalsContact C-N 3.32Å; M68-L70 PolarHBondContact O-N 3.32Å; L70-M72 VanDerWaalsContact C-N 3.35Å; L70-M72 PolarHBondContact O-N 3.13Å; L70-A73 WeakPolarHBondContact O-CB 3.3Å; L70-A73 PolarHBondContact O-N 3.46Å; L70-I74 HydrophobicContact CD2-CD1 3.47Å; L70-I74 VanDerWaalsContact CD2-CD1 3.47Å; L70-I74 HydrophobicContact CD2-CG1 4.45Å; L70-I74 HydrophobicContact CG-CD1 4.17Å; L70-I74 VanDerWaalsContact O-CG1 3.28Å; L70-I74 WeakPolarHBondContact O-CG1 3.42Å; L70-I74 PolarHBondContact O-N 3.08Å; L70-A101 HydrophobicContact CB-CB 4.1Å; L70-M102 HydrophobicContact CD1-CE 3.33Å; L70-M102 HydrophobicContact CD1-SD 4.27Å
71L96.6Very high95.6Very high45 Ų4549.4 Ų49.424%0.23626%0.264CS..Hα-helixtrans-61.6-42.7175.8-167.5115.7000111.8W30 S67 M68 A73 I74 L75W30-L71 HydrophobicContact CD2-CD1 3.91Å; W30-L71 HydrophobicContact CE3-CD1 4.36Å; W30-L71 HydrophobicContact CG-CD1 4.27Å; W30-L71 HydrophobicContact CZ2-CD1 4.07Å; S67-L71 PolarHBondContact O-N 3.45Å; M68-L71 PolarHBondContact O-N 3.34Å; L71-A73 VanDerWaalsContact C-N 3.31Å; L71-A73 PolarHBondContact O-N 2.93Å; L71-I74 PolarHBondContact O-N 3.29Å; L71-L75 HydrophobicContact CD2-CD1 3.78Å; L71-L75 HydrophobicContact CG-CD1 4.32Å; L71-L75 WeakPolarHBondContact O-CG 3.48Å; L71-L75 PolarHBondContact O-N 2.81Å
72M97.3Very high95.2Very high107 Ų10747 Ų4753%0.52726%0.264SS..Hα-helixtrans-59.1-43.5174.3-177.461-174.800111.5M68 I69 L70 I74 L75 F76 M97M68-M72 PolarHBondContact O-N 3.28Å; I69-M72 WeakPolarHBondContact O-CB 3.4Å; I69-M72 PolarHBondContact O-N 3.46Å; L70-M72 VanDerWaalsContact C-N 3.35Å; L70-M72 PolarHBondContact O-N 3.13Å; M72-I74 PolarHBondContact O-N 3.32Å; M72-L75 PolarHBondContact O-N 3.11Å; M72-F76 VanDerWaalsContact O-CB 3.23Å; M72-F76 WeakPolarHBondContact O-CB 3.33Å; M72-F76 PolarHBondContact O-N 3.26Å; M72-M97 HydrophobicContact CG-SD 4.31Å
73A95.3Very high94.7Very high0 Ų048.5 Ų48.50%027%0.268CS..Hα-helixtrans-63.4-41.1178.300000112.6I69 L70 L71 N77 M97 I98I69-A73 PolarHBondContact O-N 3.39Å; L70-A73 WeakPolarHBondContact O-CB 3.3Å; L70-A73 PolarHBondContact O-N 3.46Å; L71-A73 VanDerWaalsContact C-N 3.31Å; L71-A73 PolarHBondContact O-N 2.93Å; A73-N77 WeakPolarHBondContact O-CB 3.38Å; A73-N77 PolarHBondContact O-N 3.23Å; A73-M97 HydrophobicContact CB-CB 3.64Å; A73-M97 HydrophobicContact CB-CE 4.31Å; A73-I98 HydrophobicContact CB-CD1 4.4Å; A73-I98 HydrophobicContact CB-CG1 3.69Å
74I94.3Very high94.3Very high9 Ų952.4 Ų52.45%0.04628%0.282CS..Hα-helixtrans-64-50.1177.4-66.7164.4000110.8W26 W30 L70 L71 M72 F76 N77 N78 W84W26-I74 HydrophobicContact CB-CB 4.35Å; W26-I74 HydrophobicContact CB-CD1 3.91Å; W26-I74 HydrophobicContact CB-CG1 3.85Å; W26-I74 HydrophobicContact CB-CG2 3.55Å; W26-I74 HydrophobicContact CD2-CD1 4.43Å; W26-I74 HydrophobicContact CD2-CG1 3.92Å; W26-I74 HydrophobicContact CE3-CD1 3.86Å; W26-I74 HydrophobicContact CE3-CG1 3.6Å; W26-I74 HydrophobicContact CG-CG1 4.07Å; W26-I74 HydrophobicContact CG-CG2 4.2Å; W26-I74 HydrophobicContact CZ3-CG1 4.44Å; W26-I74 WeakPolarHBondContact O-CD1 3.39Å; W30-I74 HydrophobicContact CB-CD1 4.26Å; L70-I74 HydrophobicContact CD2-CD1 3.47Å; L70-I74 VanDerWaalsContact CD2-CD1 3.47Å; L70-I74 HydrophobicContact CD2-CG1 4.45Å; L70-I74 HydrophobicContact CG-CD1 4.17Å; L70-I74 VanDerWaalsContact O-CG1 3.28Å; L70-I74 WeakPolarHBondContact O-CG1 3.42Å; L70-I74 PolarHBondContact O-N 3.08Å; L71-I74 PolarHBondContact O-N 3.29Å; M72-I74 PolarHBondContact O-N 3.32Å; I74-F76 VanDerWaalsContact C-N 3.32Å; I74-F76 PolarHBondContact O-N 3Å; I74-N77 PolarHBondContact O-N 3.35Å; I74-N78 PolarHBondContact O-N 3.15Å; I74-W84 HydrophobicContact CG2-CE3 4.3Å; I74-W84 HydrophobicContact CG2-CZ3 3.98Å
75L95.4Very high94.1Very high86 Ų8654.1 Ų54.145%0.4529%0.29SS..Hα-helixtrans-64-39.7-179.2-68.5176.6000111.4L71 M72 N78 M79 W84L71-L75 HydrophobicContact CD2-CD1 3.78Å; L71-L75 HydrophobicContact CG-CD1 4.32Å; L71-L75 WeakPolarHBondContact O-CG 3.48Å; L71-L75 PolarHBondContact O-N 2.81Å; M72-L75 PolarHBondContact O-N 3.11Å; L75-N78 PolarHBondContact O-N 3.43Å; L75-M79 PolarHBondContact O-N 2.65Å; L75-W84 HydrophobicContact CD2-CH2 4.15Å
76F94.4Very high93.4Very high53 Ų5351 Ų5123%0.23227%0.271CS..Hα-helixtrans-65.5-39.7175.5-172.1-104.6000112.2M72 I74 N78 M79 L80 M97M72-F76 VanDerWaalsContact O-CB 3.23Å; M72-F76 WeakPolarHBondContact O-CB 3.33Å; M72-F76 PolarHBondContact O-N 3.26Å; I74-F76 VanDerWaalsContact C-N 3.32Å; I74-F76 PolarHBondContact O-N 3Å; F76-N78 VanDerWaalsContact C-N 3.34Å; F76-N78 PolarHBondContact O-N 2.89Å; F76-M79 HydrophobicContact CD2-CE 4.31Å; F76-M79 HydrophobicContact CE2-CE 4Å; F76-M79 WeakPolarHBondContact O-CB 3.4Å; F76-M79 PolarHBondContact O-N 3.05Å; F76-L80 HydrophobicContact CD1-CD1 3.99Å; F76-L80 HydrophobicContact CE1-CD1 3.37Å; F76-L80 HydrophobicContact CE1-CG 4.41Å; F76-L80 HydrophobicContact CE2-CD1 4.25Å; F76-L80 HydrophobicContact CZ-CD1 3.55Å; F76-L80 HydrophobicContact CZ-CG 4.36Å; F76-L80 PolarHBondContact O-N 3.34Å; F76-M97 HydrophobicContact CB-CE 4.08Å; F76-M97 HydrophobicContact CD1-CE 3.79Å; F76-M97 HydrophobicContact CG-CE 4.09Å
77N93.3Very high92Very high4 Ų456.7 Ų56.72%0.02131%0.306CS..Hα-helixtrans-61.6-43.5174-170.148.9000111.4A73 I74 L80 S81 N91A73-N77 WeakPolarHBondContact O-CB 3.38Å; A73-N77 PolarHBondContact O-N 3.23Å; I74-N77 PolarHBondContact O-N 3.35Å; N77-L80 PolarHBondContact O-N 3.04Å; N77-S81 PolarHBondContact O-N 2.91Å; N77-S81 PolarHBondContact O-OG 3.2Å; N77-N91 PolarHBondContact OD1-N 3.37Å
78N92.5Very high90.2Very high42 Ų4259.5 Ų59.523%0.22532%0.321CS..Hα-helixtrans-65.7-38.3176.2-177.843.1000112.3I74 L75 F76 L80 G82 W84I74-N78 PolarHBondContact O-N 3.15Å; L75-N78 PolarHBondContact O-N 3.43Å; F76-N78 VanDerWaalsContact C-N 3.34Å; F76-N78 PolarHBondContact O-N 2.89Å; N78-L80 PolarHBondContact O-N 3.45Å; N78-G82 VanDerWaalsContact O-CA 3.27Å; N78-G82 WeakPolarHBondContact O-CA 3.47Å; N78-G82 PolarHBondContact O-N 3.28Å; N78-G82 VanDerWaalsContact OD1-C 3.23Å; N78-G82 VanDerWaalsContact OD1-CA 3.31Å; N78-G82 WeakPolarHBondContact OD1-CA 3.44Å; N78-W84 HydrophobicContact CB-CZ2 4.32Å; N78-W84 WeakPolarHBondContact ND2-CZ2 3.41Å; N78-W84 PolarHBondContact ND2-NE1 3.46Å; N78-W84 PolarHBondContact OD1-NE1 3.4Å
79M92.7Very high88.9Confident137 Ų13759.5 Ų59.568%0.67533%0.328SS*.Hα-helixtrans-57.7-35.9176.9-168-17189.300112.3L75 F76L75-M79 PolarHBondContact O-N 2.65Å; F76-M79 HydrophobicContact CD2-CE 4.31Å; F76-M79 HydrophobicContact CE2-CE 4Å; F76-M79 WeakPolarHBondContact O-CB 3.4Å; F76-M79 PolarHBondContact O-N 3.05Å
80L91.1Very high87.7Confident89 Ų8957.5 Ų57.547%0.46632%0.317SS..Hα-helixtrans-93.9-33.7-174.9-64.5177.3000114.1F76 N77 N78 N91F76-L80 HydrophobicContact CD1-CD1 3.99Å; F76-L80 HydrophobicContact CE1-CD1 3.37Å; F76-L80 HydrophobicContact CE1-CG 4.41Å; F76-L80 HydrophobicContact CE2-CD1 4.25Å; F76-L80 HydrophobicContact CZ-CD1 3.55Å; F76-L80 HydrophobicContact CZ-CG 4.36Å; F76-L80 PolarHBondContact O-N 3.34Å; N77-L80 PolarHBondContact O-N 3.04Å; N78-L80 PolarHBondContact O-N 3.45Å; L80-N91 HydrophobicContact CD1-CB 4.41Å; L80-N91 WeakPolarHBondContact CD1-ND2 3.36Å
81S88.2Confident87.2Confident51 Ų5160.2 Ų60.236%0.35733%0.332SS..Hα-helixtrans-114-17.8-173.3670000114.3N77 Q83N77-S81 PolarHBondContact O-N 2.91Å; N77-S81 PolarHBondContact O-OG 3.2Å; S81-Q83 PolarHBondContact O-N 3.22Å; S81-Q83 PolarHBondContact OG-N 2.99Å
82G88.8Confident86.8Confident52 Ų5263.9 Ų63.954%0.53635%0.348SS..  trans69.39-172.100000114.7N78N78-G82 VanDerWaalsContact O-CA 3.27Å; N78-G82 WeakPolarHBondContact O-CA 3.47Å; N78-G82 PolarHBondContact O-N 3.28Å; N78-G82 VanDerWaalsContact OD1-C 3.23Å; N78-G82 VanDerWaalsContact OD1-CA 3.31Å; N78-G82 WeakPolarHBondContact OD1-CA 3.44Å
83Q87.8Confident86.6Confident68 Ų6866 Ų6632%0.31835%0.351SS..  trans-101.3134.9-172.4-62.5179-3.300112.4S81 N88S81-Q83 PolarHBondContact O-N 3.22Å; S81-Q83 PolarHBondContact OG-N 2.99Å; Q83-N88 PolarHBondContact NE2-ND2 3.29Å; Q83-N88 PolarHBondContact OE1-ND2 3.01Å
84W89.8Confident86.5Confident90 Ų9066 Ų6634%0.34135%0.351SS..  trans-110.2-8.4177.3-71.295.2000114.2H25 W26 I74 L75 N78H25-W84 WeakPolarHBondContact CA-O 3.35Å; H25-W84 AromaticContact CE1-CD2 3.71Å; H25-W84 AromaticContact CE1-CE3 3.2Å; H25-W84 AromaticContact CE1-CZ3 3.86Å; H25-W84 WeakPolarHBondContact NE2-CB 3.37Å; H25-W84 AromaticContact NE2-CD2 3.58Å; H25-W84 AromaticContact NE2-CE3 3.59Å; H25-W84 AromaticContact NE2-CG 3.53Å; W26-W84 VanDerWaalsContact CD1-O 3.28Å; W26-W84 PolarHBondContact N-O 2.89Å; I74-W84 HydrophobicContact CG2-CE3 4.3Å; I74-W84 HydrophobicContact CG2-CZ3 3.98Å; L75-W84 HydrophobicContact CD2-CH2 4.15Å; N78-W84 HydrophobicContact CB-CZ2 4.32Å; N78-W84 WeakPolarHBondContact ND2-CZ2 3.41Å; N78-W84 PolarHBondContact ND2-NE1 3.46Å; N78-W84 PolarHBondContact OD1-NE1 3.4Å
85T92.1Very high86.4Confident60 Ų6065.7 Ų65.737%0.36835%0.35SS..BIsolated β-bridgetrans-83139.7-17849.20000111.7S24 W26 T87S24-T85 CarbonylContact O-C 3.6Å; S24-T85 WeakPolarHBondContact O-CA 3.45Å; W26-T85 PolarHBondContact NE1-O 3.47Å; T85-T87 VanDerWaalsContact C-N 3.29Å; T85-T87 PolarHBondContact O-N 2.97Å
86M83.5Confident86.4Confident8 Ų863.9 Ų63.94%0.03934%0.341CS..THydrogen-bonded Turntrans-63.7-29.9178.7-73.8-62.5-60.600113.9S24 W26 T29 N88 I141 Q144 I145S24-M86 WeakPolarHBondContact O-CG 3.42Å; S24-M86 PolarHBondContact O-N 3.38Å; W26-M86 HydrophobicContact CD2-CE 4.26Å; W26-M86 HydrophobicContact CD2-SD 3.13Å; W26-M86 HydrophobicContact CE3-CE 4.09Å; W26-M86 HydrophobicContact CE3-SD 3.31Å; W26-M86 HydrophobicContact CG-SD 3.71Å; W26-M86 HydrophobicContact CH2-CE 3.45Å; W26-M86 VanDerWaalsContact CH2-CE 3.45Å; W26-M86 HydrophobicContact CH2-SD 3.68Å; W26-M86 HydrophobicContact CZ2-CE 3.62Å; W26-M86 HydrophobicContact CZ2-SD 3.51Å; W26-M86 VanDerWaalsContact CZ2-SD 3.51Å; W26-M86 HydrophobicContact CZ3-CE 3.7Å; W26-M86 HydrophobicContact CZ3-SD 3.59Å; W26-M86 VanDerWaalsContact CZ3-SD 3.59Å; T29-M86 HydrophobicContact CG2-CE 4.47Å; T29-M86 HydrophobicContact CG2-CG 4.11Å; T29-M86 HydrophobicContact CG2-SD 3.82Å; M86-N88 PolarHBondContact O-N 2.7Å; M86-I141 HydrophobicContact CE-CG2 3.88Å; M86-Q144 HydrophobicContact CE-CB 4.2Å; M86-I145 HydrophobicContact CE-CG2 3.76Å
87T68.2Low86.5Confident121 Ų12163.7 Ų63.774%0.74234%0.341SS*.THydrogen-bonded Turntrans-73.2-12.9-166.9540000114.6T85T85-T87 VanDerWaalsContact C-N 3.29Å; T85-T87 PolarHBondContact O-N 2.97Å
88N61.1Low86.7Confident60 Ų6063.6 Ų63.632%0.32134%0.34SS..SBendtrans-99.2152.4-173.4-64.7-4.8000111.3Q83 M86 T90Q83-N88 PolarHBondContact NE2-ND2 3.29Å; Q83-N88 PolarHBondContact OE1-ND2 3.01Å; M86-N88 PolarHBondContact O-N 2.7Å; N88-T90 PolarHBondContact O-N 3.14Å
89T69.3Low86.8Confident115 Ų11561.7 Ų61.771%0.70633%0.33SS*.  trans-51.4113177.451.90000110.5
90T73.9Confident87.1Confident10 Ų1058.2 Ų58.26%0.06131%0.313CS..  trans-66.3140.5168.353.10000109W26 N88 S94 S95 I98 S148W26-T90 HydrophobicContact CH2-CG2 4.41Å; W26-T90 HydrophobicContact CZ2-CG2 3.67Å; N88-T90 PolarHBondContact O-N 3.14Å; T90-S94 WeakPolarHBondContact CB-OG 3.49Å; T90-S95 WeakPolarHBondContact OG1-CB 2.97Å; T90-I98 HydrophobicContact CG2-CD1 3.99Å; T90-S148 PolarHBondContact OG1-OG 2.92Å
91N86.4Confident87.4Confident58 Ų5854 Ų5431%0.3129%0.291SS..  trans-55.9148.9170.7-174.920.9000110.9N77 L80 Y93 S94 S95N77-N91 PolarHBondContact OD1-N 3.37Å; L80-N91 HydrophobicContact CD1-CB 4.41Å; L80-N91 WeakPolarHBondContact CD1-ND2 3.36Å; N91-Y93 VanDerWaalsContact C-N 3.3Å; N91-Y93 PolarHBondContact O-N 3.48Å; N91-S94 PolarHBondContact N-OG 2.92Å; N91-S94 CarbonylContact O-C 3.6Å; N91-S94 WeakPolarHBondContact O-CA 3.46Å; N91-S94 PolarHBondContact O-N 3.35Å; N91-S94 PolarHBondContact O-OG 2.96Å; N91-S95 PolarHBondContact O-N 3.45Å
92Q87.8Confident87.8Confident122 Ų12251.6 Ų51.657%0.5727%0.274SS*.Hα-helixtrans-52.7-42.8-176.2-172.1175.32.100113.1S95 L96Q92-S95 PolarHBondContact O-N 2.92Å; Q92-S95 PolarHBondContact O-OG 2.91Å; Q92-L96 VanDerWaalsContact O-CG 3.31Å; Q92-L96 WeakPolarHBondContact O-CG 3.48Å; Q92-L96 PolarHBondContact O-N 2.86Å; Q92-L96 VanDerWaalsContact O-N 3.13Å
93Y92.8Very high88.2Confident151 Ų15149.2 Ų49.259%0.59225%0.249SC*.Hα-helixtrans-69.5-34.8176.8-62-64.7000113N91 L96 M97N91-Y93 VanDerWaalsContact C-N 3.3Å; N91-Y93 PolarHBondContact O-N 3.48Å; Y93-L96 HydrophobicContact CD1-CD1 4.44Å; Y93-L96 PolarHBondContact O-N 3.27Å; Y93-M97 WeakPolarHBondContact O-CG 3.28Å; Y93-M97 PolarHBondContact O-N 2.87Å; Y93-M97 VanDerWaalsContact O-N 3.1Å
94S93Very high88.7Confident0 Ų047.2 Ų47.20%024%0.24CC..Hα-helixtrans-69.7-38175.661.70000112T90 N91 L96 M97 I98T90-S94 WeakPolarHBondContact CB-OG 3.49Å; N91-S94 PolarHBondContact N-OG 2.92Å; N91-S94 CarbonylContact O-C 3.6Å; N91-S94 WeakPolarHBondContact O-CA 3.46Å; N91-S94 PolarHBondContact O-N 3.35Å; N91-S94 PolarHBondContact O-OG 2.96Å; S94-L96 VanDerWaalsContact C-N 3.33Å; S94-L96 PolarHBondContact O-N 3.49Å; S94-M97 PolarHBondContact O-N 3.4Å; S94-I98 WeakPolarHBondContact O-CD1 3.28Å; S94-I98 WeakPolarHBondContact O-CG1 3.4Å; S94-I98 PolarHBondContact O-N 3.31Å
95S93.1Very high89.1Confident3 Ų343.4 Ų43.42%0.02123%0.226CC..Hα-helixtrans-64-39.3175.272.50000111.5T90 N91 Q92 I98 M99 S148T90-S95 WeakPolarHBondContact OG1-CB 2.97Å; N91-S95 PolarHBondContact O-N 3.45Å; Q92-S95 PolarHBondContact O-N 2.92Å; Q92-S95 PolarHBondContact O-OG 2.91Å; S95-I98 PolarHBondContact O-N 3.16Å; S95-M99 WeakPolarHBondContact O-CB 3.49Å; S95-M99 WeakPolarHBondContact O-CG 3.21Å; S95-M99 PolarHBondContact O-N 3.44Å; S95-S148 WeakPolarHBondContact CB-O 3.38Å
96L95.7Very high89.3Confident48 Ų4840.6 Ų40.625%0.25121%0.209SC..Hα-helixtrans-59.2-49172.3-69.5168.1000112.2Q92 Y93 S94 I98 M99 M100 D150 L153Q92-L96 VanDerWaalsContact O-CG 3.31Å; Q92-L96 WeakPolarHBondContact O-CG 3.48Å; Q92-L96 PolarHBondContact O-N 2.86Å; Q92-L96 VanDerWaalsContact O-N 3.13Å; Y93-L96 HydrophobicContact CD1-CD1 4.44Å; Y93-L96 PolarHBondContact O-N 3.27Å; S94-L96 VanDerWaalsContact C-N 3.33Å; S94-L96 PolarHBondContact O-N 3.49Å; L96-I98 PolarHBondContact O-N 3.05Å; L96-M99 HydrophobicContact CD2-CE 3.75Å; L96-M99 HydrophobicContact CG-CE 4.39Å; L96-M99 PolarHBondContact O-N 3.24Å; L96-M100 WeakPolarHBondContact O-CG 3.29Å; L96-M100 PolarHBondContact O-N 3.13Å; L96-D150 HydrophobicContact CD2-CB 4.45Å; L96-L153 HydrophobicContact CD2-CB 4.43Å; L96-L153 HydrophobicContact CD2-CD2 3.5Å; L96-L153 VanDerWaalsContact CD2-CD2 3.5Å
97M96.4Very high90Very high49 Ų4940.2 Ų40.224%0.24121%0.207CC..Hα-helixtrans-63.7-40.2178.1-71-175-76.700112.3I69 M72 A73 F76 Y93 S94 M100 A101I69-M97 HydrophobicContact CG2-CB 4.31Å; M72-M97 HydrophobicContact CG-SD 4.31Å; A73-M97 HydrophobicContact CB-CB 3.64Å; A73-M97 HydrophobicContact CB-CE 4.31Å; F76-M97 HydrophobicContact CB-CE 4.08Å; F76-M97 HydrophobicContact CD1-CE 3.79Å; F76-M97 HydrophobicContact CG-CE 4.09Å; Y93-M97 WeakPolarHBondContact O-CG 3.28Å; Y93-M97 PolarHBondContact O-N 2.87Å; Y93-M97 VanDerWaalsContact O-N 3.1Å; S94-M97 PolarHBondContact O-N 3.4Å; M97-M100 PolarHBondContact O-N 3.13Å; M97-A101 WeakPolarHBondContact O-CB 3.13Å; M97-A101 PolarHBondContact O-N 3.16Å
98I95.8Very high91.4Very high1 Ų134.6 Ų34.61%0.00517%0.173CC..Hα-helixtrans-64.1-44.2176.2-66158.1000110.4W26 A73 T90 S94 S95 L96 M100 A101 M102 I145W26-I98 HydrophobicContact CH2-CD1 3.52Å; W26-I98 HydrophobicContact CH2-CG1 4.38Å; W26-I98 HydrophobicContact CZ2-CD1 4.07Å; W26-I98 HydrophobicContact CZ3-CD1 4.02Å; W26-I98 HydrophobicContact CZ3-CG1 4.49Å; A73-I98 HydrophobicContact CB-CD1 4.4Å; A73-I98 HydrophobicContact CB-CG1 3.69Å; T90-I98 HydrophobicContact CG2-CD1 3.99Å; S94-I98 WeakPolarHBondContact O-CD1 3.28Å; S94-I98 WeakPolarHBondContact O-CG1 3.4Å; S94-I98 PolarHBondContact O-N 3.31Å; S95-I98 PolarHBondContact O-N 3.16Å; L96-I98 PolarHBondContact O-N 3.05Å; I98-M100 VanDerWaalsContact C-N 3.31Å; I98-M100 PolarHBondContact O-N 3.12Å; I98-A101 PolarHBondContact O-N 3.19Å; I98-M102 HydrophobicContact CG2-CE 4.33Å; I98-M102 HydrophobicContact CG2-CG 4.18Å; I98-M102 WeakPolarHBondContact O-CG 3.31Å; I98-M102 PolarHBondContact O-N 2.71Å; I98-I145 HydrophobicContact CB-CD1 4.33Å; I98-I145 HydrophobicContact CG2-CD1 3.38Å
99M96.1Very high93.1Very high3 Ų332 Ų322%0.01516%0.159CC..Hα-helixtrans-58.3-43.6175.4-77.7-169.1-70.300111.9S95 L96 M102 A103 M142 L149 D150 L153 L154S95-M99 WeakPolarHBondContact O-CB 3.49Å; S95-M99 WeakPolarHBondContact O-CG 3.21Å; S95-M99 PolarHBondContact O-N 3.44Å; L96-M99 HydrophobicContact CD2-CE 3.75Å; L96-M99 HydrophobicContact CG-CE 4.39Å; L96-M99 PolarHBondContact O-N 3.24Å; M99-M102 PolarHBondContact O-N 3.07Å; M99-A103 WeakPolarHBondContact O-CB 3.44Å; M99-A103 PolarHBondContact O-N 3.29Å; M99-M142 HydrophobicContact CG-CE 4.33Å; M99-L149 HydrophobicContact CG-CD2 3.31Å; M99-L149 HydrophobicContact SD-CB 4.29Å; M99-L149 HydrophobicContact SD-CD2 3.6Å; M99-L149 VanDerWaalsContact SD-CD2 3.6Å; M99-D150 HydrophobicContact CE-CB 3.88Å; M99-L153 HydrophobicContact CE-CB 4.29Å; M99-L153 HydrophobicContact CE-CD2 3.84Å; M99-L154 HydrophobicContact SD-CB 4.19Å
100M97.4Very high94.4Very high63 Ų6329.8 Ų29.831%0.3115%0.147SC..Hα-helixtrans-65.3-42.7177.5-66.6-59.4-7900112L96 M97 I98 A103 M104 F111L96-M100 WeakPolarHBondContact O-CG 3.29Å; L96-M100 PolarHBondContact O-N 3.13Å; M97-M100 PolarHBondContact O-N 3.13Å; I98-M100 VanDerWaalsContact C-N 3.31Å; I98-M100 PolarHBondContact O-N 3.12Å; M100-A103 PolarHBondContact O-N 2.95Å; M100-M104 WeakPolarHBondContact O-CG 3.49Å; M100-M104 PolarHBondContact O-N 3.24Å; M100-F111 HydrophobicContact CE-CE2 3.49Å; M100-F111 VanDerWaalsContact CE-CE2 3.49Å; M100-F111 HydrophobicContact CE-CZ 3.41Å; M100-F111 VanDerWaalsContact CE-CZ 3.41Å; M100-F111 HydrophobicContact SD-CE2 4.17Å
101A97.8Very high95.5Very high0 Ų031.9 Ų31.90%016%0.155CC..Hα-helixtrans-60.2-48.1174.800000111.6A66 I69 L70 M97 I98 M104 K105A66-A101 WeakPolarHBondContact O-CB 3.28Å; I69-A101 HydrophobicContact CB-CB 4.3Å; I69-A101 HydrophobicContact CG2-CB 4.07Å; L70-A101 HydrophobicContact CB-CB 4.1Å; M97-A101 WeakPolarHBondContact O-CB 3.13Å; M97-A101 PolarHBondContact O-N 3.16Å; I98-A101 PolarHBondContact O-N 3.19Å; A101-M104 PolarHBondContact O-N 2.95Å; A101-K105 WeakPolarHBondContact O-CG 3.45Å; A101-K105 PolarHBondContact O-N 3.23Å
102M97.7Very high96Very high1 Ų130.1 Ų30.11%0.00515%0.145CC..Hα-helixtrans-68.1-37.8179.4-65-49.7-177.100112.6L33 L70 I98 M99 M104 K105 L106 P138 I141 M142L33-M102 HydrophobicContact CD1-CE 4.31Å; L70-M102 HydrophobicContact CD1-CE 3.33Å; L70-M102 HydrophobicContact CD1-SD 4.27Å; I98-M102 HydrophobicContact CG2-CE 4.33Å; I98-M102 HydrophobicContact CG2-CG 4.18Å; I98-M102 WeakPolarHBondContact O-CG 3.31Å; I98-M102 PolarHBondContact O-N 2.71Å; M99-M102 PolarHBondContact O-N 3.07Å; M102-M104 VanDerWaalsContact C-N 3.29Å; M102-M104 PolarHBondContact O-N 3.15Å; M102-K105 PolarHBondContact O-N 2.73Å; M102-L106 VanDerWaalsContact O-CB 3.27Å; M102-L106 WeakPolarHBondContact O-CB 3.33Å; M102-L106 WeakPolarHBondContact O-CG 3.28Å; M102-L106 PolarHBondContact O-N 3.41Å; M102-P138 HydrophobicContact SD-CB 3.94Å; M102-I141 HydrophobicContact CE-CB 3.53Å; M102-I141 HydrophobicContact CE-CD1 3.49Å; M102-I141 VanDerWaalsContact CE-CD1 3.49Å; M102-I141 HydrophobicContact CE-CG1 4.1Å; M102-I141 HydrophobicContact CE-CG2 3.27Å; M102-M142 HydrophobicContact CB-CG 3.93Å; M102-M142 HydrophobicContact CB-SD 3.63Å; M102-M142 HydrophobicContact CG-CG 3.97Å; M102-M142 HydrophobicContact CG-SD 3.68Å
103A97.6Very high96.5Very high2 Ų231 Ų312%0.01715%0.148CC..Hα-helixtrans-59.4-40.6174.400000111.5M99 M100 G107 M108 F111 L157M99-A103 WeakPolarHBondContact O-CB 3.44Å; M99-A103 PolarHBondContact O-N 3.29Å; M100-A103 PolarHBondContact O-N 2.95Å; A103-G107 PolarHBondContact O-N 2.88Å; A103-M108 HydrophobicContact CB-CB 4.21Å; A103-M108 HydrophobicContact CB-SD 4.28Å; A103-M108 PolarHBondContact O-N 3.27Å; A103-F111 HydrophobicContact CB-CD2 4.1Å; A103-F111 HydrophobicContact CB-CE2 4.47Å; A103-L157 HydrophobicContact CB-CD1 4.21Å
104M97.9Very high96.8Very high27 Ų2724.7 Ų24.713%0.13312%0.122CC..Hα-helixtrans-64-49.3172.8-70-178.6-149.100111.9A66 I69 M100 A101 M102 L106 G107 F111 W114A66-M104 HydrophobicContact CB-CB 3.81Å; A66-M104 HydrophobicContact CB-SD 4.31Å; I69-M104 HydrophobicContact CD1-CE 3.56Å; I69-M104 HydrophobicContact CD1-SD 4.04Å; M100-M104 WeakPolarHBondContact O-CG 3.49Å; M100-M104 PolarHBondContact O-N 3.24Å; A101-M104 PolarHBondContact O-N 2.95Å; M102-M104 VanDerWaalsContact C-N 3.29Å; M102-M104 PolarHBondContact O-N 3.15Å; M104-L106 VanDerWaalsContact C-N 3.31Å; M104-L106 PolarHBondContact O-N 3.48Å; M104-G107 PolarHBondContact O-N 3.37Å; M104-G107 VanDerWaalsContact O-N 3.16Å; M104-F111 HydrophobicContact CB-CB 4.44Å; M104-F111 HydrophobicContact CB-CD2 4.47Å; M104-F111 HydrophobicContact CB-CG 4.37Å; M104-F111 HydrophobicContact CE-CD1 4.4Å; M104-F111 HydrophobicContact CE-CE1 3.83Å; M104-F111 HydrophobicContact CE-CE2 4.1Å; M104-F111 HydrophobicContact CE-CZ 3.66Å; M104-F111 HydrophobicContact CG-CB 4.02Å; M104-F111 HydrophobicContact CG-CD1 3.75Å; M104-F111 HydrophobicContact CG-CD2 3.56Å; M104-F111 HydrophobicContact CG-CE1 4.1Å; M104-F111 HydrophobicContact CG-CE2 3.91Å; M104-F111 HydrophobicContact CG-CG 3.48Å; M104-F111 VanDerWaalsContact CG-CG 3.48Å; M104-F111 HydrophobicContact CG-CZ 4.17Å; M104-F111 HydrophobicContact SD-CE1 4.5Å; M104-W114 PolarHBondContact O-NE1 2.92Å
105K97.4Very high97Very high9 Ų924.7 Ų24.74%0.03912%0.123CC..Hα-helixtrans-61.4-40.5-179-67.1-157.2164.2-78.50112.3L33 Q63 A66 A101 M102 P138L33-K105 HydrophobicContact CD1-CD 4.21Å; L33-K105 HydrophobicContact CD2-CD 4.08Å; Q63-K105 PolarHBondContact NE2-O 2.84Å; Q63-K105 PolarHBondContact O-NZ 3.39Å; Q63-K105 VanDerWaalsContact OE1-CG 3.22Å; A66-K105 HydrophobicContact CB-CD 4.49Å; A66-K105 HydrophobicContact CB-CG 3.65Å; A101-K105 WeakPolarHBondContact O-CG 3.45Å; A101-K105 PolarHBondContact O-N 3.23Å; M102-K105 PolarHBondContact O-N 2.73Å; K105-P138 HydrophobicContact CB-CB 4.44Å; K105-P138 HydrophobicContact CB-CG 4.09Å
106L97.2Very high97.2Very high1 Ų124.7 Ų24.71%0.00512%0.122CC..Hα-helixtrans-82.1-11.1179.2-69.6172.6000113.7M102 M104 M108 K135 P138 I139 M187 M191M102-L106 VanDerWaalsContact O-CB 3.27Å; M102-L106 WeakPolarHBondContact O-CB 3.33Å; M102-L106 WeakPolarHBondContact O-CG 3.28Å; M102-L106 PolarHBondContact O-N 3.41Å; M104-L106 VanDerWaalsContact C-N 3.31Å; M104-L106 PolarHBondContact O-N 3.48Å; L106-M108 HydrophobicContact CB-CE 3.57Å; L106-M108 HydrophobicContact CD1-CE 3.38Å; L106-M108 HydrophobicContact CG-CE 4.09Å; L106-K135 HydrophobicContact CD2-CB 4.3Å; L106-K135 HydrophobicContact CD2-CD 3.76Å; L106-K135 PolarHBondContact O-NZ 2.98Å; L106-P138 HydrophobicContact CD1-CB 4Å; L106-P138 HydrophobicContact CD2-CB 3.6Å; L106-P138 HydrophobicContact CD2-CG 3.93Å; L106-P138 HydrophobicContact CG-CB 3.6Å; L106-P138 HydrophobicContact CG-CG 4.25Å; L106-I139 HydrophobicContact CD1-CG1 4.22Å; L106-I139 HydrophobicContact CD2-CG1 4.22Å; L106-M187 HydrophobicContact CB-CE 3.95Å; L106-M187 HydrophobicContact CD1-CE 3.8Å; L106-M187 HydrophobicContact CD2-CE 3.65Å; L106-M187 HydrophobicContact CD2-SD 4.45Å; L106-M187 HydrophobicContact CG-CE 4.01Å; L106-M191 HydrophobicContact CD1-CE 3.54Å; L106-M191 HydrophobicContact CD1-SD 4.25Å
107G96.4Very high97.2Very high1 Ų125.3 Ų25.31%0.0112%0.124CC..THydrogen-bonded Turntrans70.437.3178.500000113.7A103 M104 H112A103-G107 PolarHBondContact O-N 2.88Å; M104-G107 PolarHBondContact O-N 3.37Å; M104-G107 VanDerWaalsContact O-N 3.16Å; G107-H112 WeakPolarHBondContact O-CA 3.04Å; G107-H112 WeakPolarHBondContact O-CB 3.48Å
108M97.7Very high97.3Very high3 Ų323 Ų232%0.01511%0.113CC..  trans-75.4159.2170.7-72.5161.5-156.100111.2A103 L106 F111 H112 M187 M191A103-M108 HydrophobicContact CB-CB 4.21Å; A103-M108 HydrophobicContact CB-SD 4.28Å; A103-M108 PolarHBondContact O-N 3.27Å; L106-M108 HydrophobicContact CB-CE 3.57Å; L106-M108 HydrophobicContact CD1-CE 3.38Å; L106-M108 HydrophobicContact CG-CE 4.09Å; M108-F111 CarbonylContact O-C 3.19Å; M108-F111 WeakPolarHBondContact O-CA 3.49Å; M108-F111 WeakPolarHBondContact O-CB 3.33Å; M108-F111 PolarHBondContact O-N 3.12Å; M108-H112 PolarHBondContact O-N 3.49Å; M108-M187 HydrophobicContact CE-CB 4.32Å; M108-M187 HydrophobicContact CE-CE 3.6Å; M108-M187 HydrophobicContact CG-CB 4.47Å; M108-M191 HydrophobicContact CE-CB 4.3Å; M108-M191 HydrophobicContact CE-CE 3.65Å; M108-M191 HydrophobicContact CE-CG 2.97Å; M108-M191 HydrophobicContact CE-SD 3.46Å; M108-M191 WeakPolarHBondContact CE-SD 3.14Å; M108-M191 HydrophobicContact SD-CB 4.47Å; M108-M191 HydrophobicContact SD-CG 3.55Å; M108-M191 VanDerWaalsContact SD-CG 3.55Å; M108-M191 HydrophobicContact SD-SD 4.28Å
109A96.8Very high97.4Very high4 Ų423 Ų233%0.03311%0.113CC..THydrogen-bonded Turntrans-67.1142.4174.300000111.6L157 L160 A164A109-L157 VanDerWaalsContact O-CD2 3.27Å; A109-L157 WeakPolarHBondContact O-CD2 3.46Å; A109-L160 HydrophobicContact CB-CB 3.9Å; A109-A164 HydrophobicContact CB-CB 4.08Å
110P96.9Very high97.3Very high69 Ų6923.7 Ų23.745%0.44812%0.116SC..THydrogen-bonded Turncis-83.4-0.71.533.8-36000114.8H112 F113P110-H112 PolarHBondContact O-N 2.95Å; P110-H112 VanDerWaalsContact O-N 3.17Å; P110-F113 WeakPolarHBondContact O-CD2 3.38Å; P110-F113 WeakPolarHBondContact O-CE2 3.49Å
111F98Very high97Very high54 Ų5421.1 Ų21.124%0.23711%0.106CC..G310 helixtrans-77.58.5-179.7-52-60.5000114.8M100 A103 M104 M108 F113 W114M100-F111 HydrophobicContact CE-CE2 3.49Å; M100-F111 VanDerWaalsContact CE-CE2 3.49Å; M100-F111 HydrophobicContact CE-CZ 3.41Å; M100-F111 VanDerWaalsContact CE-CZ 3.41Å; M100-F111 HydrophobicContact SD-CE2 4.17Å; A103-F111 HydrophobicContact CB-CD2 4.1Å; A103-F111 HydrophobicContact CB-CE2 4.47Å; M104-F111 HydrophobicContact CB-CB 4.44Å; M104-F111 HydrophobicContact CB-CD2 4.47Å; M104-F111 HydrophobicContact CB-CG 4.37Å; M104-F111 HydrophobicContact CE-CD1 4.4Å; M104-F111 HydrophobicContact CE-CE1 3.83Å; M104-F111 HydrophobicContact CE-CE2 4.1Å; M104-F111 HydrophobicContact CE-CZ 3.66Å; M104-F111 HydrophobicContact CG-CB 4.02Å; M104-F111 HydrophobicContact CG-CD1 3.75Å; M104-F111 HydrophobicContact CG-CD2 3.56Å; M104-F111 HydrophobicContact CG-CE1 4.1Å; M104-F111 HydrophobicContact CG-CE2 3.91Å; M104-F111 HydrophobicContact CG-CG 3.48Å; M104-F111 VanDerWaalsContact CG-CG 3.48Å; M104-F111 HydrophobicContact CG-CZ 4.17Å; M104-F111 HydrophobicContact SD-CE1 4.5Å; M108-F111 CarbonylContact O-C 3.19Å; M108-F111 WeakPolarHBondContact O-CA 3.49Å; M108-F111 WeakPolarHBondContact O-CB 3.33Å; M108-F111 PolarHBondContact O-N 3.12Å; F111-F113 PolarHBondContact O-N 3.38Å; F111-W114 PolarHBondContact O-NE1 3.49Å
112H97.5Very high96.8Very high21 Ų2121.3 Ų21.310%0.09711%0.107CC..G310 helixtrans-70.5-12.7-177.872.468.6000113.3G107 M108 P110 W114 V115 P116 I184G107-H112 WeakPolarHBondContact O-CA 3.04Å; G107-H112 WeakPolarHBondContact O-CB 3.48Å; M108-H112 PolarHBondContact O-N 3.49Å; P110-H112 PolarHBondContact O-N 2.95Å; P110-H112 VanDerWaalsContact O-N 3.17Å; H112-W114 PolarHBondContact O-N 3.38Å; H112-W114 VanDerWaalsContact O-N 3.12Å; H112-V115 PolarHBondContact O-N 3.11Å; H112-P116 WeakPolarHBondContact O-CD 3.47Å; H112-I184 HydrophobicContact CB-CD1 3.8Å; H112-I184 HydrophobicContact CB-CG1 4.15Å; H112-I184 HydrophobicContact CB-CG2 4.07Å
113F97.6Very high96.7Very high142 Ų14222.2 Ų22.262%0.62311%0.113SC*.G310 helixtrans-56.5-34.5-167.4-75.9-64.9000113.5P110 F111 P116 E117P110-F113 WeakPolarHBondContact O-CD2 3.38Å; P110-F113 WeakPolarHBondContact O-CE2 3.49Å; F111-F113 PolarHBondContact O-N 3.38Å; F113-P116 WeakPolarHBondContact O-CD 3.37Å; F113-E117 VanDerWaalsContact O-CD 3.29Å
114W97.8Very high96.6Very high17 Ų1722.9 Ų22.96%0.06412%0.116CC..Hα-helixtrans-75.7-20.8-178.166.1-92.6000114.4Y59 T62 M104 F111 H112 E117 V118 L130Y59-W114 HydrophobicContact CD2-CE3 4.4Å; Y59-W114 HydrophobicContact CD2-CH2 4.21Å; Y59-W114 AromaticContact CD2-CZ3 3.8Å; Y59-W114 HydrophobicContact CD2-CZ3 3.8Å; Y59-W114 HydrophobicContact CE2-CH2 4.32Å; Y59-W114 HydrophobicContact CE2-CZ3 4.31Å; T62-W114 HydrophobicContact CG2-CB 4.22Å; T62-W114 HydrophobicContact CG2-CG 4.12Å; M104-W114 PolarHBondContact O-NE1 2.92Å; F111-W114 PolarHBondContact O-NE1 3.49Å; H112-W114 PolarHBondContact O-N 3.38Å; H112-W114 VanDerWaalsContact O-N 3.12Å; W114-E117 WeakPolarHBondContact CA-OE2 3.43Å; W114-E117 PolarHBondContact O-N 2.86Å; W114-V118 HydrophobicContact CE3-CB 4.13Å; W114-V118 HydrophobicContact CE3-CG2 3.82Å; W114-V118 HydrophobicContact CZ3-CB 4.45Å; W114-V118 HydrophobicContact CZ3-CG2 4.49Å; W114-V118 VanDerWaalsContact O-CG2 3.26Å; W114-V118 WeakPolarHBondContact O-CG2 3.07Å; W114-V118 PolarHBondContact O-N 3.42Å; W114-V118 VanDerWaalsContact O-N 3.09Å; W114-L130 HydrophobicContact CH2-CD1 4.12Å; W114-L130 HydrophobicContact CZ3-CD1 3.87Å; W114-L130 HydrophobicContact CZ3-CD2 4.3Å
115V97.9Very high96.4Very high1 Ų124.8 Ų24.81%0.00613%0.129CC..Hα-helixtrans-64.6-46.2-171.1-175.20000111.5H112 T119 L131 A180 I184H112-V115 PolarHBondContact O-N 3.11Å; V115-T119 HydrophobicContact CG1-CG2 4.33Å; V115-T119 WeakPolarHBondContact O-CB 3.31Å; V115-T119 VanDerWaalsContact O-CG2 3.22Å; V115-T119 WeakPolarHBondContact O-CG2 3.5Å; V115-T119 PolarHBondContact O-N 2.96Å; V115-T119 VanDerWaalsContact O-N 3.11Å; V115-T119 PolarHBondContact O-OG1 3.28Å; V115-L131 HydrophobicContact CG1-CD2 4.02Å; V115-A180 HydrophobicContact CG1-CB 4.1Å; V115-I184 HydrophobicContact CB-CD1 4.25Å; V115-I184 HydrophobicContact CB-CG1 4.46Å; V115-I184 HydrophobicContact CG1-CG1 4.44Å
116P97.4Very high96.4Very high2 Ų224.3 Ų24.31%0.01313%0.127CC..Hα-helixtrans-64.4-36.2177.2-23.836.6000114.8H112 F113 T119 Q120 K177 Y181H112-P116 WeakPolarHBondContact O-CD 3.47Å; F113-P116 WeakPolarHBondContact O-CD 3.37Å; P116-T119 PolarHBondContact O-OG1 3.48Å; P116-T119 VanDerWaalsContact O-OG1 3.12Å; P116-Q120 WeakPolarHBondContact O-CB 3.34Å; P116-Q120 PolarHBondContact O-N 2.87Å; P116-Q120 VanDerWaalsContact O-N 3.08Å; P116-K177 HydrophobicContact CB-CD 4.42Å; P116-K177 HydrophobicContact CB-CG 4.22Å; P116-Y181 HydrophobicContact CB-CE2 4.34Å; P116-Y181 HydrophobicContact CG-CE1 3.89Å; P116-Y181 HydrophobicContact CG-CE2 4.05Å
117E96.7Very high96.3Very high62 Ų6224.3 Ų24.329%0.2913%0.127SC..Hα-helixtrans-74.3-44179.7-59.172.5-154.300111.3K58 F113 W114 Q120 G121K58-E117 HydrophobicContact CD-CB 4.21Å; K58-E117 HydrophobicContact CD-CG 4.5Å; F113-E117 VanDerWaalsContact O-CD 3.29Å; W114-E117 WeakPolarHBondContact CA-OE2 3.43Å; W114-E117 PolarHBondContact O-N 2.86Å; E117-Q120 PolarHBondContact O-N 3.26Å; E117-G121 PolarHBondContact O-N 3.11Å
118V97.9Very high96.4Very high0 Ų025.7 Ų25.70%013%0.134CC..Hα-helixtrans-66.3-42.5-177.7-178.90000110.6L44 A55 K58 W114 T122 L130L44-V118 HydrophobicContact CD1-CG1 4.4Å; L44-V118 HydrophobicContact CD2-CG1 4.02Å; A55-V118 HydrophobicContact CB-CG1 4.47Å; A55-V118 HydrophobicContact CB-CG2 4.44Å; A55-V118 WeakPolarHBondContact O-CG2 3.46Å; K58-V118 HydrophobicContact CB-CG2 4.28Å; W114-V118 HydrophobicContact CE3-CB 4.13Å; W114-V118 HydrophobicContact CE3-CG2 3.82Å; W114-V118 HydrophobicContact CZ3-CB 4.45Å; W114-V118 HydrophobicContact CZ3-CG2 4.49Å; W114-V118 VanDerWaalsContact O-CG2 3.26Å; W114-V118 WeakPolarHBondContact O-CG2 3.07Å; W114-V118 PolarHBondContact O-N 3.42Å; W114-V118 VanDerWaalsContact O-N 3.09Å; V118-T122 HydrophobicContact CG1-CG2 4.45Å; V118-T122 WeakPolarHBondContact O-CB 3.39Å; V118-T122 WeakPolarHBondContact O-CG2 3.22Å; V118-T122 PolarHBondContact O-N 3.06Å; V118-T122 PolarHBondContact O-OG1 2.97Å; V118-L130 HydrophobicContact CB-CD2 4.17Å; V118-L130 HydrophobicContact CG1-CD2 3.63Å
119T96.8Very high96.4Very high1 Ų127.7 Ų27.71%0.00615%0.145CC..Hα-helixtrans-65.8-37.7173.954.70000112.2V115 P116 L130 L131 R176 A180V115-T119 HydrophobicContact CG1-CG2 4.33Å; V115-T119 WeakPolarHBondContact O-CB 3.31Å; V115-T119 VanDerWaalsContact O-CG2 3.22Å; V115-T119 WeakPolarHBondContact O-CG2 3.5Å; V115-T119 PolarHBondContact O-N 2.96Å; V115-T119 VanDerWaalsContact O-N 3.11Å; V115-T119 PolarHBondContact O-OG1 3.28Å; P116-T119 PolarHBondContact O-OG1 3.48Å; P116-T119 VanDerWaalsContact O-OG1 3.12Å; T119-L130 HydrophobicContact CG2-CD2 3.79Å; T119-L131 HydrophobicContact CG2-CD1 3.98Å; T119-L131 HydrophobicContact CG2-CD2 3.79Å; T119-L131 HydrophobicContact CG2-CG 3.93Å; T119-R176 WeakPolarHBondContact O-CD 3.37Å; T119-R176 PolarHBondContact O-NE 2.94Å; T119-A180 HydrophobicContact CG2-CB 4.02Å; T119-A180 WeakPolarHBondContact OG1-CB 3.26Å
120Q95.9Very high96.4Very high17 Ų1727.6 Ų27.68%0.07914%0.144CC..Hα-helixtrans-72.2-38.4-179.2-168.4177.611.700112.8P116 E117 T122 R176 K177P116-Q120 WeakPolarHBondContact O-CB 3.34Å; P116-Q120 PolarHBondContact O-N 2.87Å; P116-Q120 VanDerWaalsContact O-N 3.08Å; E117-Q120 PolarHBondContact O-N 3.26Å; Q120-T122 VanDerWaalsContact C-N 3.34Å; Q120-R176 PolarHBondContact O-NE 2.76Å; Q120-R176 VanDerWaalsContact O-NE 3.1Å; Q120-R176 PolarHBondContact O-NH2 3.48Å; Q120-K177 HydrophobicContact CB-CG 4.07Å; Q120-K177 HydrophobicContact CG-CG 4.39Å
121G89.7Confident96.5Very high10 Ų1024.3 Ų24.310%0.10312%0.123CC..Hα-helixtrans-75.1-19.9-175.200000114.8E117E117-G121 PolarHBondContact O-N 3.11Å
122T94.8Very high96.5Very high4 Ų422.2 Ų22.23%0.02511%0.114CC..SBendtrans-104.6159-169.462.40000112.4L44 A55 V118 Q120 S126L44-T122 HydrophobicContact CB-CG2 4.12Å; L44-T122 HydrophobicContact CD2-CG2 3.72Å; A55-T122 HydrophobicContact CB-CG2 4.07Å; V118-T122 HydrophobicContact CG1-CG2 4.45Å; V118-T122 WeakPolarHBondContact O-CB 3.39Å; V118-T122 WeakPolarHBondContact O-CG2 3.22Å; V118-T122 PolarHBondContact O-N 3.06Å; V118-T122 PolarHBondContact O-OG1 2.97Å; Q120-T122 VanDerWaalsContact C-N 3.34Å; T122-S126 VanDerWaalsContact CB-OG 3.27Å; T122-S126 WeakPolarHBondContact CB-OG 3.22Å
123P94.8Very high96.5Very high19 Ų1924.7 Ų24.712%0.12312%0.123CC..  trans-62.4157.717523.4-31.2000112.1K46 T125 S126 G127K46-P123 HydrophobicContact CB-CG 4.28Å; K46-P123 HydrophobicContact CD-CG 4.37Å; P123-T125 PolarHBondContact O-N 2.98Å; P123-T125 VanDerWaalsContact O-N 3.16Å; P123-S126 WeakPolarHBondContact CD-OG 3.31Å; P123-S126 VanDerWaalsContact CG-OG 3.26Å; P123-S126 WeakPolarHBondContact CG-OG 3.45Å; P123-S126 PolarHBondContact O-N 3.04Å; P123-S126 PolarHBondContact O-OG 3.01Å; P123-G127 PolarHBondContact O-N 3.14Å
124L94.8Very high96.5Very high17 Ų1719 Ų199%0.08910%0.098CC..Hα-helixtrans-57.2-34.3-176.9-71169.8000113G127 L128 R176 F216 L219 N220 T225L124-G127 PolarHBondContact O-N 3.12Å; L124-L128 WeakPolarHBondContact O-CB 3.5Å; L124-L128 PolarHBondContact O-N 3.11Å; L124-R176 HydrophobicContact CD2-CG 3.76Å; L124-F216 HydrophobicContact CB-CD1 4.36Å; L124-F216 HydrophobicContact CD2-CD1 3.94Å; L124-F216 HydrophobicContact CD2-CE1 4.06Å; L124-L219 HydrophobicContact CD1-CB 4.17Å; L124-L219 HydrophobicContact CD2-CB 4.43Å; L124-L219 HydrophobicContact CD2-CD1 4.3Å; L124-N220 WeakPolarHBondContact CB-OD1 3.31Å; L124-N220 WeakPolarHBondContact CD1-OD1 3.18Å; L124-T225 HydrophobicContact CD1-CG2 4.42Å
125T95Very high96.5Very high66 Ų6618.6 Ų18.641%0.40510%0.097SC..Hα-helixtrans-71.9-38.4179.750.20000113.5P123 L128 L129P123-T125 PolarHBondContact O-N 2.98Å; P123-T125 VanDerWaalsContact O-N 3.16Å; T125-L128 PolarHBondContact O-N 3.29Å; T125-L129 PolarHBondContact O-N 3.43Å
126S95.9Very high96.5Very high0 Ų021 Ų210%011%0.109CC..Hα-helixtrans-72.1-35.9172.3550000111.2V43 T122 P123 L128 L129 L130V43-S126 WeakPolarHBondContact O-CB 3.35Å; T122-S126 VanDerWaalsContact CB-OG 3.27Å; T122-S126 WeakPolarHBondContact CB-OG 3.22Å; P123-S126 WeakPolarHBondContact CD-OG 3.31Å; P123-S126 VanDerWaalsContact CG-OG 3.26Å; P123-S126 WeakPolarHBondContact CG-OG 3.45Å; P123-S126 PolarHBondContact O-N 3.04Å; P123-S126 PolarHBondContact O-OG 3.01Å; S126-L128 VanDerWaalsContact C-N 3.3Å; S126-L128 PolarHBondContact O-N 3.07Å; S126-L129 PolarHBondContact O-N 3.18Å; S126-L130 WeakPolarHBondContact O-CB 2.98Å; S126-L130 PolarHBondContact O-N 3.32Å
127G96.6Very high96.5Very high1 Ų121 Ų211%0.0111%0.11CC..Hα-helixtrans-60.7-38.9172.700000112.4P123 L124 L130 L131P123-G127 PolarHBondContact O-N 3.14Å; L124-G127 PolarHBondContact O-N 3.12Å; G127-L130 PolarHBondContact O-N 3.46Å; G127-L131 WeakPolarHBondContact O-CG 3.33Å; G127-L131 PolarHBondContact O-N 2.9Å
128L97.2Very high96.5Very high29 Ų2918.3 Ų18.315%0.15210%0.097CC..Hα-helixtrans-59.9-55.6172.7174.160.6000111.2L124 T125 S126 L130 L131 T132 T213 F216L124-L128 WeakPolarHBondContact O-CB 3.5Å; L124-L128 PolarHBondContact O-N 3.11Å; T125-L128 PolarHBondContact O-N 3.29Å; S126-L128 VanDerWaalsContact C-N 3.3Å; S126-L128 PolarHBondContact O-N 3.07Å; L128-L130 PolarHBondContact O-N 2.99Å; L128-L131 PolarHBondContact O-N 3.12Å; L128-L131 VanDerWaalsContact O-N 3.13Å; L128-T132 HydrophobicContact CD1-CG2 3.89Å; L128-T132 PolarHBondContact O-N 3.38Å; L128-T132 PolarHBondContact O-OG1 3.2Å; L128-T213 HydrophobicContact CD1-CG2 3.79Å; L128-F216 HydrophobicContact CB-CB 4.14Å; L128-F216 HydrophobicContact CB-CD1 4.47Å; L128-F216 HydrophobicContact CB-CD2 4.06Å; L128-F216 HydrophobicContact CB-CG 3.98Å; L128-F216 HydrophobicContact CD1-CB 4.03Å; L128-F216 HydrophobicContact CD1-CD2 3.68Å; L128-F216 HydrophobicContact CD1-CG 4.13Å; L128-F216 HydrophobicContact CD2-CB 4.44Å; L128-F216 HydrophobicContact CG-CB 4.43Å; L128-F216 HydrophobicContact CG-CD2 4.49Å
129L98.1Very high96.4Very high45 Ų4518.7 Ų18.724%0.23610%0.099CC..Hα-helixtrans-58.5-36.2179.3-70.1166000112.4Y10 F40 V43 T125 S126 W133 Q134Y10-L129 HydrophobicContact CE1-CD1 3.98Å; F40-L129 HydrophobicContact CE2-CB 3.63Å; F40-L129 HydrophobicContact CE2-CD1 4.43Å; F40-L129 HydrophobicContact CZ-CB 4.08Å; V43-L129 HydrophobicContact CG1-CD1 4.02Å; T125-L129 PolarHBondContact O-N 3.43Å; S126-L129 PolarHBondContact O-N 3.18Å; L129-W133 HydrophobicContact CD2-CB 4.29Å; L129-W133 WeakPolarHBondContact O-CB 3.25Å; L129-W133 PolarHBondContact O-N 2.93Å; L129-Q134 PolarHBondContact O-N 3.47Å
130L98.1Very high96.4Very high2 Ų219.9 Ų19.91%0.0111%0.108CC..Hα-helixtrans-65.3-42.8176.9178.571.1000112.1F40 Y59 W114 V118 T119 S126 G127 L128 Q134F40-L130 HydrophobicContact CE1-CB 3.98Å; F40-L130 HydrophobicContact CE1-CD1 3.67Å; F40-L130 HydrophobicContact CE1-CG 4.42Å; F40-L130 HydrophobicContact CZ-CB 3.79Å; F40-L130 HydrophobicContact CZ-CD1 4.35Å; Y59-L130 HydrophobicContact CD2-CD1 4.04Å; Y59-L130 HydrophobicContact CE2-CD1 3.76Å; W114-L130 HydrophobicContact CH2-CD1 4.12Å; W114-L130 HydrophobicContact CZ3-CD1 3.87Å; W114-L130 HydrophobicContact CZ3-CD2 4.3Å; V118-L130 HydrophobicContact CB-CD2 4.17Å; V118-L130 HydrophobicContact CG1-CD2 3.63Å; T119-L130 HydrophobicContact CG2-CD2 3.79Å; S126-L130 WeakPolarHBondContact O-CB 2.98Å; S126-L130 PolarHBondContact O-N 3.32Å; G127-L130 PolarHBondContact O-N 3.46Å; L128-L130 PolarHBondContact O-N 2.99Å; L130-Q134 HydrophobicContact CD1-CG 4.4Å; L130-Q134 WeakPolarHBondContact O-CB 3.48Å
131L97.6Very high96.4Very high1 Ų119.1 Ų19.11%0.00510%0.104CC..Hα-helixtrans-84.6-15.5-175.1-67.5-171.2000113.5V115 T119 G127 L128 K135 S183 Y208 F216V115-L131 HydrophobicContact CG1-CD2 4.02Å; T119-L131 HydrophobicContact CG2-CD1 3.98Å; T119-L131 HydrophobicContact CG2-CD2 3.79Å; T119-L131 HydrophobicContact CG2-CG 3.93Å; G127-L131 WeakPolarHBondContact O-CG 3.33Å; G127-L131 PolarHBondContact O-N 2.9Å; L128-L131 PolarHBondContact O-N 3.12Å; L128-L131 VanDerWaalsContact O-N 3.13Å; L131-K135 WeakPolarHBondContact O-CG 3.32Å; L131-S183 WeakPolarHBondContact CD2-OG 3.37Å; L131-Y208 VanDerWaalsContact O-CE1 3.26Å; L131-Y208 WeakPolarHBondContact O-CE1 3.27Å; L131-Y208 PolarHBondContact O-OH 3.48Å; L131-F216 HydrophobicContact CB-CE2 4.43Å; L131-F216 HydrophobicContact CD1-CE2 3.85Å; L131-F216 HydrophobicContact CD1-CZ 3.8Å
132T98.1Very high96.7Very high10 Ų1018.8 Ų18.86%0.06110%0.1CC..THydrogen-bonded Turntrans-113-69.2178.859.80000112.6L128 Q134 K135 I209 T212 T213L128-T132 HydrophobicContact CD1-CG2 3.89Å; L128-T132 PolarHBondContact O-N 3.38Å; L128-T132 PolarHBondContact O-OG1 3.2Å; T132-Q134 PolarHBondContact O-N 3.3Å; T132-K135 WeakPolarHBondContact O-CB 3.36Å; T132-K135 PolarHBondContact O-N 2.98Å; T132-K135 VanDerWaalsContact O-N 3.12Å; T132-I209 HydrophobicContact CG2-CG1 4.32Å; T132-I209 HydrophobicContact CG2-CG2 4.28Å; T132-T212 WeakPolarHBondContact CG2-OG1 3.01Å; T132-T213 HydrophobicContact CG2-CG2 4.32Å
133W98.1Very high96.7Very high73 Ų7322.8 Ų22.828%0.27712%0.115SC..Hα-helixtrans-62.6-42.8-170.5-165.9-92.5000112.6I13 F14 T17 L129 K135 L136I13-W133 VanDerWaalsContact CG2-CD1 3.45Å; I13-W133 HydrophobicContact CG2-CG 4.47Å; F14-W133 AromaticContact CD2-CH2 3.85Å; F14-W133 HydrophobicContact CD2-CH2 3.85Å; F14-W133 AromaticContact CD2-CZ2 3.77Å; F14-W133 HydrophobicContact CD2-CZ2 3.77Å; F14-W133 HydrophobicContact CE2-CH2 4.27Å; T17-W133 VanDerWaalsContact CG2-NE1 3.28Å; T17-W133 WeakPolarHBondContact OG1-CZ2 3.45Å; T17-W133 PolarHBondContact OG1-NE1 2.87Å; L129-W133 HydrophobicContact CD2-CB 4.29Å; L129-W133 WeakPolarHBondContact O-CB 3.25Å; L129-W133 PolarHBondContact O-N 2.93Å; W133-K135 PolarHBondContact O-N 2.93Å; W133-L136 HydrophobicContact CD2-CD1 3.94Å; W133-L136 HydrophobicContact CE3-CD1 3.74Å; W133-L136 HydrophobicContact CG-CD1 4.5Å; W133-L136 HydrophobicContact CH2-CD1 4.35Å; W133-L136 HydrophobicContact CZ3-CD1 3.97Å; W133-L136 WeakPolarHBondContact O-CB 3.48Å; W133-L136 PolarHBondContact O-N 3.49Å; W133-L136 VanDerWaalsContact O-N 3.11Å
134Q97.8Very high96.7Very high23 Ų2325 Ų2511%0.10712%0.124CC..Hα-helixtrans-66.8-9.7-179.5-63.3-64-35.700113.7F40 Y59 L129 L130 T132 P138F40-Q134 HydrophobicContact CD1-CG 4.17Å; F40-Q134 HydrophobicContact CD2-CG 4.44Å; F40-Q134 VanDerWaalsContact CD2-NE2 3.29Å; F40-Q134 HydrophobicContact CE1-CG 4.03Å; F40-Q134 HydrophobicContact CE2-CG 4.34Å; F40-Q134 HydrophobicContact CG-CG 4.37Å; F40-Q134 VanDerWaalsContact CG-NE2 3.29Å; F40-Q134 HydrophobicContact CZ-CG 4.14Å; Y59-Q134 PolarHBondContact OH-OE1 3.32Å; L129-Q134 PolarHBondContact O-N 3.47Å; L130-Q134 HydrophobicContact CD1-CG 4.4Å; L130-Q134 WeakPolarHBondContact O-CB 3.48Å; T132-Q134 PolarHBondContact O-N 3.3Å; Q134-P138 VanDerWaalsContact O-CD 3.32Å; Q134-P138 WeakPolarHBondContact O-CD 3.39Å
135K97.4Very high96.6Very high7 Ų724.4 Ų24.43%0.0312%0.121CC..Hα-helixtrans-85.2-21.1175.5-54.3-57.1-174.7-174.40113.1L106 L131 T132 W133 I139 M187L106-K135 HydrophobicContact CD2-CB 4.3Å; L106-K135 HydrophobicContact CD2-CD 3.76Å; L106-K135 PolarHBondContact O-NZ 2.98Å; L131-K135 WeakPolarHBondContact O-CG 3.32Å; T132-K135 WeakPolarHBondContact O-CB 3.36Å; T132-K135 PolarHBondContact O-N 2.98Å; T132-K135 VanDerWaalsContact O-N 3.12Å; W133-K135 PolarHBondContact O-N 2.93Å; K135-I139 HydrophobicContact CB-CD1 4.35Å; K135-I139 WeakPolarHBondContact O-CB 3.48Å; K135-I139 WeakPolarHBondContact O-CG1 3.39Å; K135-I139 PolarHBondContact O-N 2.79Å; K135-M187 HydrophobicContact CB-SD 4.45Å; K135-M187 HydrophobicContact CD-SD 3.75Å; K135-M187 HydrophobicContact CG-SD 4.09Å
136L98.1Very high96.5Very high51 Ų5121.8 Ų21.827%0.26711%0.105SC..Hα-helixtrans-63.5-55.4-173.4-65.7174.9000112.4W133 I139 S140 L205 I209W133-L136 HydrophobicContact CD2-CD1 3.94Å; W133-L136 HydrophobicContact CE3-CD1 3.74Å; W133-L136 HydrophobicContact CG-CD1 4.5Å; W133-L136 HydrophobicContact CH2-CD1 4.35Å; W133-L136 HydrophobicContact CZ3-CD1 3.97Å; W133-L136 WeakPolarHBondContact O-CB 3.48Å; W133-L136 PolarHBondContact O-N 3.49Å; W133-L136 VanDerWaalsContact O-N 3.11Å; L136-I139 PolarHBondContact O-N 3.19Å; L136-S140 PolarHBondContact O-N 2.98Å; L136-L205 HydrophobicContact CD2-CD1 4.23Å; L136-L205 HydrophobicContact CD2-CD2 3.87Å; L136-I209 HydrophobicContact CD2-CD1 3.83Å
137A96.6Very high96.2Very high4 Ų427.4 Ų27.43%0.03314%0.142CC..Hα-helixtrans-64.7-44.1-175.200000114T17 T20 L33 I139 S140 I141T17-A137 HydrophobicContact CG2-CB 4.12Å; T20-A137 HydrophobicContact CG2-CB 4.11Å; T20-A137 VanDerWaalsContact OG1-CB 3.29Å; T20-A137 WeakPolarHBondContact OG1-CB 3.27Å; L33-A137 HydrophobicContact CD2-CB 4.01Å; A137-I139 VanDerWaalsContact C-N 3.34Å; A137-I139 PolarHBondContact O-N 3.47Å; A137-S140 PolarHBondContact O-N 2.92Å; A137-S140 PolarHBondContact O-OG 3.42Å; A137-I141 WeakPolarHBondContact O-CG1 3.23Å; A137-I141 PolarHBondContact O-N 2.77Å
138P97.1Very high95.8Very high4 Ų428.8 Ų28.83%0.02615%0.152CC..Hα-helixtrans-67.9-33.9176.5-19.632.1000112.7L33 M102 K105 L106 Q134 I141 M142L33-P138 HydrophobicContact CD2-CG 4.37Å; M102-P138 HydrophobicContact SD-CB 3.94Å; K105-P138 HydrophobicContact CB-CB 4.44Å; K105-P138 HydrophobicContact CB-CG 4.09Å; L106-P138 HydrophobicContact CD1-CB 4Å; L106-P138 HydrophobicContact CD2-CB 3.6Å; L106-P138 HydrophobicContact CD2-CG 3.93Å; L106-P138 HydrophobicContact CG-CB 3.6Å; L106-P138 HydrophobicContact CG-CG 4.25Å; Q134-P138 VanDerWaalsContact O-CD 3.32Å; Q134-P138 WeakPolarHBondContact O-CD 3.39Å; P138-I141 PolarHBondContact O-N 2.97Å; P138-M142 WeakPolarHBondContact O-CG 3.32Å; P138-M142 PolarHBondContact O-N 3.28Å
139I97.1Very high95.4Very high8 Ų828 Ų284%0.04115%0.147CC..Hα-helixtrans-68.2-38.5175.1-75.1169.5000111.4L106 K135 L136 A137 I141 M142 Y143 M187 M190 M191 L205L106-I139 HydrophobicContact CD1-CG1 4.22Å; L106-I139 HydrophobicContact CD2-CG1 4.22Å; K135-I139 HydrophobicContact CB-CD1 4.35Å; K135-I139 WeakPolarHBondContact O-CB 3.48Å; K135-I139 WeakPolarHBondContact O-CG1 3.39Å; K135-I139 PolarHBondContact O-N 2.79Å; L136-I139 PolarHBondContact O-N 3.19Å; A137-I139 VanDerWaalsContact C-N 3.34Å; A137-I139 PolarHBondContact O-N 3.47Å; I139-I141 VanDerWaalsContact C-N 3.26Å; I139-I141 PolarHBondContact O-N 3.18Å; I139-M142 PolarHBondContact O-N 3.5Å; I139-Y143 VanDerWaalsContact O-CB 3.31Å; I139-Y143 WeakPolarHBondContact O-CB 3.33Å; I139-Y143 PolarHBondContact O-N 2.85Å; I139-M187 HydrophobicContact CD1-CE 3.77Å; I139-M187 HydrophobicContact CD1-SD 4.33Å; I139-M187 HydrophobicContact CG1-CE 4.28Å; I139-M190 HydrophobicContact CD1-SD 4.08Å; I139-M191 HydrophobicContact CD1-CE 4.2Å; I139-M191 HydrophobicContact CG1-CE 3.64Å; I139-L205 HydrophobicContact CB-CD1 4.07Å; I139-L205 HydrophobicContact CD1-CD1 3.32Å; I139-L205 HydrophobicContact CD1-CG 4.48Å; I139-L205 HydrophobicContact CG1-CD1 4.25Å; I139-L205 HydrophobicContact CG2-CD1 3.96Å
140S96.3Very high95.1Very high27 Ų2728.1 Ų28.119%0.18915%0.148CC..Hα-helixtrans-61.5-36.8176.767.60000112.1L136 A137 Q144L136-S140 PolarHBondContact O-N 2.98Å; A137-S140 PolarHBondContact O-N 2.92Å; A137-S140 PolarHBondContact O-OG 3.42Å; S140-Q144 WeakPolarHBondContact O-CG 3.47Å; S140-Q144 PolarHBondContact O-N 3.47Å; S140-Q144 VanDerWaalsContact O-N 3.15Å
141I96Very high94.9Very high0 Ų030.6 Ų30.60%016%0.163CC..Hα-helixtrans-71.1-45176.4-61.5165.6000110.8W26 L33 M86 M102 A137 P138 I139 Y143 Q144 I145W26-I141 HydrophobicContact CH2-CG2 4.48Å; W26-I141 HydrophobicContact CZ3-CG2 4.25Å; L33-I141 HydrophobicContact CD1-CD1 3.63Å; L33-I141 HydrophobicContact CD2-CD1 4.23Å; L33-I141 HydrophobicContact CG-CD1 4.01Å; M86-I141 HydrophobicContact CE-CG2 3.88Å; M102-I141 HydrophobicContact CE-CB 3.53Å; M102-I141 HydrophobicContact CE-CD1 3.49Å; M102-I141 VanDerWaalsContact CE-CD1 3.49Å; M102-I141 HydrophobicContact CE-CG1 4.1Å; M102-I141 HydrophobicContact CE-CG2 3.27Å; A137-I141 WeakPolarHBondContact O-CG1 3.23Å; A137-I141 PolarHBondContact O-N 2.77Å; P138-I141 PolarHBondContact O-N 2.97Å; I139-I141 VanDerWaalsContact C-N 3.26Å; I139-I141 PolarHBondContact O-N 3.18Å; I141-Y143 PolarHBondContact O-N 3.32Å; I141-Q144 PolarHBondContact O-N 3.37Å; I141-Q144 VanDerWaalsContact O-N 3.16Å; I141-I145 HydrophobicContact CG2-CD1 4.5Å; I141-I145 WeakPolarHBondContact O-CG1 3.14Å; I141-I145 PolarHBondContact O-N 2.89Å
142M95.7Very high94.8Very high3 Ų333.7 Ų33.72%0.01519%0.185CC..Hα-helixtrans-60.5-34.1175.7-71.2-63.9-67.400112.6M99 M102 P138 I139 I145 S146 L149 L154 M191 L194M99-M142 HydrophobicContact CG-CE 4.33Å; M102-M142 HydrophobicContact CB-CG 3.93Å; M102-M142 HydrophobicContact CB-SD 3.63Å; M102-M142 HydrophobicContact CG-CG 3.97Å; M102-M142 HydrophobicContact CG-SD 3.68Å; P138-M142 WeakPolarHBondContact O-CG 3.32Å; P138-M142 PolarHBondContact O-N 3.28Å; I139-M142 PolarHBondContact O-N 3.5Å; M142-I145 HydrophobicContact SD-CD1 4.26Å; M142-S146 WeakPolarHBondContact O-CA 3.42Å; M142-S146 PolarHBondContact O-N 3.33Å; M142-L149 HydrophobicContact CE-CD1 3.76Å; M142-L149 HydrophobicContact CE-CD2 3.69Å; M142-L149 HydrophobicContact CE-CG 4.45Å; M142-L149 HydrophobicContact SD-CD2 4.33Å; M142-L154 HydrophobicContact CE-CD1 3.97Å; M142-M191 HydrophobicContact CE-SD 4.11Å; M142-M191 HydrophobicContact CG-SD 4.42Å; M142-L194 HydrophobicContact CB-CD1 3.82Å; M142-L194 HydrophobicContact CE-CD1 3.96Å
143Y95Very high94.7Very high88 Ų8835.1 Ų35.135%0.34519%0.192SC..Hα-helixtrans-63.6-46.9173.5179.6-85.6000111.4I139 I141 I145 S146 P198 N199 I202I139-Y143 VanDerWaalsContact O-CB 3.31Å; I139-Y143 WeakPolarHBondContact O-CB 3.33Å; I139-Y143 PolarHBondContact O-N 2.85Å; I141-Y143 PolarHBondContact O-N 3.32Å; Y143-I145 VanDerWaalsContact C-N 3.34Å; Y143-I145 PolarHBondContact O-N 2.93Å; Y143-S146 WeakPolarHBondContact O-CB 3.11Å; Y143-S146 PolarHBondContact O-N 2.86Å; Y143-S146 PolarHBondContact O-OG 3.24Å; Y143-P198 HydrophobicContact CD2-CB 3.28Å; Y143-P198 HydrophobicContact CD2-CG 4.48Å; Y143-P198 HydrophobicContact CE2-CB 3.23Å; Y143-P198 HydrophobicContact CE2-CG 4.41Å; Y143-P198 HydrophobicContact CG-CB 4.23Å; Y143-N199 PolarHBondContact OH-OD1 3.39Å; Y143-I202 HydrophobicContact CD2-CD1 3.59Å; Y143-I202 HydrophobicContact CD2-CG1 4.05Å; Y143-I202 HydrophobicContact CE2-CD1 3.32Å; Y143-I202 HydrophobicContact CE2-CG1 4.16Å; Y143-I202 HydrophobicContact CG-CD1 4.49Å
144Q93.8Very high94.6Very high66 Ų6631.8 Ų31.831%0.30818%0.18SC..Hα-helixtrans-65.4-34-178.2-72.7171.8-4.400113.4M86 S140 I141M86-Q144 HydrophobicContact CE-CB 4.2Å; S140-Q144 WeakPolarHBondContact O-CG 3.47Å; S140-Q144 PolarHBondContact O-N 3.47Å; S140-Q144 VanDerWaalsContact O-N 3.15Å; I141-Q144 PolarHBondContact O-N 3.37Å; I141-Q144 VanDerWaalsContact O-N 3.16Å
145I93.3Very high94.6Very high4 Ų431.6 Ų31.62%0.02118%0.179CC..THydrogen-bonded Turntrans-989.1-179.668.9-174.4000113.7W26 M86 I98 I141 M142 Y143 P147 S148 L149W26-I145 HydrophobicContact CH2-CG2 3.66Å; W26-I145 HydrophobicContact CZ2-CG2 3.77Å; M86-I145 HydrophobicContact CE-CG2 3.76Å; I98-I145 HydrophobicContact CB-CD1 4.33Å; I98-I145 HydrophobicContact CG2-CD1 3.38Å; I141-I145 HydrophobicContact CG2-CD1 4.5Å; I141-I145 WeakPolarHBondContact O-CG1 3.14Å; I141-I145 PolarHBondContact O-N 2.89Å; M142-I145 HydrophobicContact SD-CD1 4.26Å; Y143-I145 VanDerWaalsContact C-N 3.34Å; Y143-I145 PolarHBondContact O-N 2.93Å; I145-P147 VanDerWaalsContact C-N 3.32Å; I145-S148 PolarHBondContact O-N 3.1Å; I145-S148 VanDerWaalsContact O-N 3.13Å; I145-S148 PolarHBondContact O-OG 3.49Å; I145-S148 VanDerWaalsContact O-OG 3.06Å; I145-L149 HydrophobicContact CD1-CD2 4.27Å; I145-L149 HydrophobicContact CG1-CD2 4.21Å; I145-L149 HydrophobicContact CG1-CG 4.43Å
146S92.9Very high94.6Very high11 Ų1135.8 Ų35.88%0.07720%0.201CC..G310 helixtrans-54.4-37.1-169.976.30000115.4M142 Y143 S148 L149 P198M142-S146 WeakPolarHBondContact O-CA 3.42Å; M142-S146 PolarHBondContact O-N 3.33Å; Y143-S146 WeakPolarHBondContact O-CB 3.11Å; Y143-S146 PolarHBondContact O-N 2.86Å; Y143-S146 PolarHBondContact O-OG 3.24Å; S146-S148 VanDerWaalsContact C-N 3.28Å; S146-S148 PolarHBondContact O-N 3.46Å; S146-L149 PolarHBondContact O-N 3.27Å; S146-P198 WeakPolarHBondContact OG-CG 3.49Å
147P89.9Confident94.6Very high118 Ų11833.8 Ų33.877%0.76619%0.19SC*.G310 helixtrans-70.5-22.8-177.1-20.235.2000113.8I145I145-P147 VanDerWaalsContact C-N 3.32Å
148S87.7Confident94.7Very high31 Ų3133.6 Ų33.622%0.21719%0.189CC..G310 helixtrans-99.38-177.754.60000113.9T90 S95 I145 S146T90-S148 PolarHBondContact OG1-OG 2.92Å; S95-S148 WeakPolarHBondContact CB-O 3.38Å; I145-S148 PolarHBondContact O-N 3.1Å; I145-S148 VanDerWaalsContact O-N 3.13Å; I145-S148 PolarHBondContact O-OG 3.49Å; I145-S148 VanDerWaalsContact O-OG 3.06Å; S146-S148 VanDerWaalsContact C-N 3.28Å; S146-S148 PolarHBondContact O-N 3.46Å
149L88.4Confident94.8Very high11 Ų1135 Ų356%0.05820%0.196CC..SBendtrans-74.9137.9177.3-68.3166.4000110.3M99 M142 I145 S146 V151 L154M99-L149 HydrophobicContact CG-CD2 3.31Å; M99-L149 HydrophobicContact SD-CB 4.29Å; M99-L149 HydrophobicContact SD-CD2 3.6Å; M99-L149 VanDerWaalsContact SD-CD2 3.6Å; M142-L149 HydrophobicContact CE-CD1 3.76Å; M142-L149 HydrophobicContact CE-CD2 3.69Å; M142-L149 HydrophobicContact CE-CG 4.45Å; M142-L149 HydrophobicContact SD-CD2 4.33Å; I145-L149 HydrophobicContact CD1-CD2 4.27Å; I145-L149 HydrophobicContact CG1-CD2 4.21Å; I145-L149 HydrophobicContact CG1-CG 4.43Å; S146-L149 PolarHBondContact O-N 3.27Å; L149-V151 PolarHBondContact O-N 3.43Å; L149-V151 VanDerWaalsContact O-N 3.12Å; L149-L154 HydrophobicContact CB-CD2 4.47Å; L149-L154 HydrophobicContact CD1-CD2 3.98Å
150D92.8Very high94.8Very high49 Ų4938.3 Ų38.326%0.26221%0.213SC..  trans-72.2107.9168177.67.2000109.1L96 M99 S152 L153 L154L96-D150 HydrophobicContact CD2-CB 4.45Å; M99-D150 HydrophobicContact CE-CB 3.88Å; D150-S152 VanDerWaalsContact CG-OG 3.24Å; D150-S152 PolarHBondContact O-N 2.82Å; D150-S152 WeakPolarHBondContact OD1-CB 3.34Å; D150-S152 PolarHBondContact OD1-N 3.35Å; D150-S152 VanDerWaalsContact OD1-N 3.07Å; D150-S152 PolarHBondContact OD1-OG 2.9Å; D150-S152 PolarHBondContact OD2-OG 3.46Å; D150-S152 VanDerWaalsContact OD2-OG 3.14Å; D150-L153 PolarHBondContact O-N 2.91Å; D150-L154 PolarHBondContact O-N 3.15Å
151V93.9Very high94.9Very high54 Ų5437 Ų3733%0.32720%0.204SC..Hα-helixtrans-56.7-36.3-177.1-177.40000111.1L149 L155 P195L149-V151 PolarHBondContact O-N 3.43Å; L149-V151 VanDerWaalsContact O-N 3.12Å; V151-L155 HydrophobicContact CG1-CD1 3.63Å; V151-L155 HydrophobicContact CG1-CG 4.14Å; V151-L155 WeakPolarHBondContact O-CB 3.22Å; V151-L155 VanDerWaalsContact O-CG 3.22Å; V151-L155 WeakPolarHBondContact O-CG 3.47Å; V151-L155 PolarHBondContact O-N 3.32Å; V151-P195 HydrophobicContact CG1-CG 4.19Å; V151-P195 HydrophobicContact CG2-CB 3.83Å; V151-P195 HydrophobicContact CG2-CG 4.38Å
152S95.1Very high95Very high65 Ų6537 Ų3746%0.45520%0.204SC..Hα-helixtrans-64.9-52.2-175.769.60000111.8D150 L155 I156D150-S152 VanDerWaalsContact CG-OG 3.24Å; D150-S152 PolarHBondContact O-N 2.82Å; D150-S152 WeakPolarHBondContact OD1-CB 3.34Å; D150-S152 PolarHBondContact OD1-N 3.35Å; D150-S152 VanDerWaalsContact OD1-N 3.07Å; D150-S152 PolarHBondContact OD1-OG 2.9Å; D150-S152 PolarHBondContact OD2-OG 3.46Å; D150-S152 VanDerWaalsContact OD2-OG 3.14Å; S152-L155 PolarHBondContact O-N 2.94Å; S152-I156 WeakPolarHBondContact O-CD1 3.49Å; S152-I156 VanDerWaalsContact O-CG1 3.27Å; S152-I156 WeakPolarHBondContact O-CG1 3.48Å; S152-I156 PolarHBondContact O-N 3.34Å; S152-I156 VanDerWaalsContact O-N 3.11Å
153L96.1Very high95.1Very high41 Ų4139.4 Ų39.422%0.21522%0.216CC..Hα-helixtrans-64.4-43.7178.7-17766.7000111.4L96 M99 D150 L155 I156 L157L96-L153 HydrophobicContact CD2-CB 4.43Å; L96-L153 HydrophobicContact CD2-CD2 3.5Å; L96-L153 VanDerWaalsContact CD2-CD2 3.5Å; M99-L153 HydrophobicContact CE-CB 4.29Å; M99-L153 HydrophobicContact CE-CD2 3.84Å; D150-L153 PolarHBondContact O-N 2.91Å; L153-L155 VanDerWaalsContact C-N 3.34Å; L153-L155 PolarHBondContact O-N 3Å; L153-I156 PolarHBondContact O-N 3.01Å; L153-L157 HydrophobicContact CD1-CG 4.49Å; L153-L157 HydrophobicContact CG-CD1 4.18Å; L153-L157 HydrophobicContact CG-CG 4.44Å; L153-L157 WeakPolarHBondContact O-CG 3.5Å; L153-L157 PolarHBondContact O-N 2.76Å
154L96.7Very high95.3Very high3 Ų336.2 Ų36.22%0.01621%0.208CC..Hα-helixtrans-62.2-42.6-178-173.265.7000111.8M99 M142 L149 D150 L157 S158 M191 L194 P195M99-L154 HydrophobicContact SD-CB 4.19Å; M142-L154 HydrophobicContact CE-CD1 3.97Å; L149-L154 HydrophobicContact CB-CD2 4.47Å; L149-L154 HydrophobicContact CD1-CD2 3.98Å; D150-L154 PolarHBondContact O-N 3.15Å; L154-L157 PolarHBondContact O-N 3.23Å; L154-S158 WeakPolarHBondContact O-CB 3.37Å; L154-S158 PolarHBondContact O-N 2.89Å; L154-M191 HydrophobicContact CD1-CB 4.06Å; L154-M191 HydrophobicContact CD1-SD 4.48Å; L154-M191 WeakPolarHBondContact CD2-O 3.19Å; L154-L194 HydrophobicContact CD2-CB 4.16Å; L154-P195 HydrophobicContact CD2-CG 4.17Å
155L97.3Very high95.4Very high18 Ų1833.1 Ų33.19%0.09419%0.193CC..Hα-helixtrans-64.6-41.3175.7-72.3173.5000111.8V151 S152 L153 L157 S158 I159 A192 F270 I278V151-L155 HydrophobicContact CG1-CD1 3.63Å; V151-L155 HydrophobicContact CG1-CG 4.14Å; V151-L155 WeakPolarHBondContact O-CB 3.22Å; V151-L155 VanDerWaalsContact O-CG 3.22Å; V151-L155 WeakPolarHBondContact O-CG 3.47Å; V151-L155 PolarHBondContact O-N 3.32Å; S152-L155 PolarHBondContact O-N 2.94Å; L153-L155 VanDerWaalsContact C-N 3.34Å; L153-L155 PolarHBondContact O-N 3Å; L155-L157 PolarHBondContact O-N 3.11Å; L155-S158 WeakPolarHBondContact CA-OG 3.17Å; L155-S158 PolarHBondContact O-N 3.4Å; L155-S158 PolarHBondContact O-OG 3.39Å; L155-I159 WeakPolarHBondContact O-CG1 3.33Å; L155-I159 PolarHBondContact O-N 3.35Å; L155-A192 HydrophobicContact CD2-CB 4.45Å; L155-F270 HydrophobicContact CD2-CE1 4.17Å; L155-F270 HydrophobicContact CD2-CZ 4.33Å; L155-I278 HydrophobicContact CD1-CD1 3.66Å; L155-I278 HydrophobicContact CD2-CD1 4.41Å; L155-I278 HydrophobicContact CD2-CG2 4.39Å
156I97.8Very high95.6Very high95 Ų9532.9 Ų32.949%0.48719%0.192SC..Hα-helixtrans-58.4-49.7175.1-70.1164.2000110.7S152 L153 S158 I159 L160S152-I156 WeakPolarHBondContact O-CD1 3.49Å; S152-I156 VanDerWaalsContact O-CG1 3.27Å; S152-I156 WeakPolarHBondContact O-CG1 3.48Å; S152-I156 PolarHBondContact O-N 3.34Å; S152-I156 VanDerWaalsContact O-N 3.11Å; L153-I156 PolarHBondContact O-N 3.01Å; I156-S158 VanDerWaalsContact C-N 3.3Å; I156-S158 PolarHBondContact O-N 3.49Å; I156-I159 PolarHBondContact O-N 3.38Å; I156-L160 HydrophobicContact CG2-CD1 3.69Å; I156-L160 HydrophobicContact CG2-CG 4.4Å; I156-L160 VanDerWaalsContact O-CB 3.31Å; I156-L160 WeakPolarHBondContact O-CB 3.12Å; I156-L160 VanDerWaalsContact O-CG 3.27Å; I156-L160 WeakPolarHBondContact O-CG 3.46Å; I156-L160 PolarHBondContact O-N 3.36Å
157L98.1Very high95.7Very high9 Ų939.7 Ų39.75%0.04722%0.216CC..Hα-helixtrans-60.8-40.4177.4-66.8173.5000111.7A103 A109 L153 L154 L155 S161A103-L157 HydrophobicContact CB-CD1 4.21Å; A109-L157 VanDerWaalsContact O-CD2 3.27Å; A109-L157 WeakPolarHBondContact O-CD2 3.46Å; L153-L157 HydrophobicContact CD1-CG 4.49Å; L153-L157 HydrophobicContact CG-CD1 4.18Å; L153-L157 HydrophobicContact CG-CG 4.44Å; L153-L157 WeakPolarHBondContact O-CG 3.5Å; L153-L157 PolarHBondContact O-N 2.76Å; L154-L157 PolarHBondContact O-N 3.23Å; L155-L157 PolarHBondContact O-N 3.11Å; L157-S161 WeakPolarHBondContact O-CB 3.34Å; L157-S161 PolarHBondContact O-N 3.2Å; L157-S161 PolarHBondContact O-OG 3.09Å
158S98.1Very high96Very high0 Ų035 Ų350%019%0.19CC..Hα-helixtrans-63.8-48.7179.678.50000112.1L154 L155 I156 S161 I162 G188L154-S158 WeakPolarHBondContact O-CB 3.37Å; L154-S158 PolarHBondContact O-N 2.89Å; L155-S158 WeakPolarHBondContact CA-OG 3.17Å; L155-S158 PolarHBondContact O-N 3.4Å; L155-S158 PolarHBondContact O-OG 3.39Å; I156-S158 VanDerWaalsContact C-N 3.3Å; I156-S158 PolarHBondContact O-N 3.49Å; S158-S161 PolarHBondContact O-N 2.93Å; S158-S161 PolarHBondContact O-OG 3.36Å; S158-I162 WeakPolarHBondContact O-CG1 3.33Å; S158-I162 PolarHBondContact O-N 3.32Å; S158-G188 WeakPolarHBondContact CB-O 3.41Å
159I98.2Very high96.3Very high34 Ų3433.6 Ų33.617%0.17418%0.18CC..Hα-helixtrans-66.4-44.1179.6-65.9168000110.2L155 I156 S161 I162 M163 I278 I281 M282L155-I159 WeakPolarHBondContact O-CG1 3.33Å; L155-I159 PolarHBondContact O-N 3.35Å; I156-I159 PolarHBondContact O-N 3.38Å; I159-S161 VanDerWaalsContact C-N 3.25Å; I159-S161 PolarHBondContact O-N 3.37Å; I159-I162 PolarHBondContact O-N 3.31Å; I159-M163 HydrophobicContact CG2-CE 3.73Å; I159-M163 HydrophobicContact CG2-CG 4.47Å; I159-M163 HydrophobicContact CG2-SD 4.2Å; I159-M163 WeakPolarHBondContact O-CG 3.46Å; I159-M163 PolarHBondContact O-N 2.9Å; I159-I278 HydrophobicContact CD1-CG2 4.3Å; I159-I281 HydrophobicContact CG2-CG2 4.32Å; I159-M282 HydrophobicContact CG1-CG 4.47Å
160L98.3Very high96.6Very high78 Ų7835.5 Ų35.541%0.40819%0.19SC..Hα-helixtrans-58.1-39.1175.3-77.7170.4000111.8A109 I156 M163 A164A109-L160 HydrophobicContact CB-CB 3.9Å; I156-L160 HydrophobicContact CG2-CD1 3.69Å; I156-L160 HydrophobicContact CG2-CG 4.4Å; I156-L160 VanDerWaalsContact O-CB 3.31Å; I156-L160 WeakPolarHBondContact O-CB 3.12Å; I156-L160 VanDerWaalsContact O-CG 3.27Å; I156-L160 WeakPolarHBondContact O-CG 3.46Å; I156-L160 PolarHBondContact O-N 3.36Å; L160-M163 PolarHBondContact O-N 3.08Å; L160-A164 VanDerWaalsContact O-CB 3.27Å; L160-A164 WeakPolarHBondContact O-CB 3.39Å; L160-A164 PolarHBondContact O-N 3.47Å
161S98.3Very high96.7Very high0 Ų039.8 Ų39.80%021%0.213CC..Hα-helixtrans-69.6-37.717872.40000112.8L157 S158 I159 A164 G165 I184 G188L157-S161 WeakPolarHBondContact O-CB 3.34Å; L157-S161 PolarHBondContact O-N 3.2Å; L157-S161 PolarHBondContact O-OG 3.09Å; S158-S161 PolarHBondContact O-N 2.93Å; S158-S161 PolarHBondContact O-OG 3.36Å; I159-S161 VanDerWaalsContact C-N 3.25Å; I159-S161 PolarHBondContact O-N 3.37Å; S161-A164 PolarHBondContact O-N 3.45Å; S161-G165 PolarHBondContact O-N 3.22Å; S161-I184 WeakPolarHBondContact O-CG2 3.34Å; S161-G188 WeakPolarHBondContact OG-CA 3.42Å; S161-G188 PolarHBondContact OG-N 3.48Å
162I98.3Very high96.8Very high0 Ų039.4 Ų39.40%021%0.207CC..Hα-helixtrans-64.7-43.3174-65.4166.1000110S158 I159 S166 W189 M282 I285 T286S158-I162 WeakPolarHBondContact O-CG1 3.33Å; S158-I162 PolarHBondContact O-N 3.32Å; I159-I162 PolarHBondContact O-N 3.31Å; I162-S166 WeakPolarHBondContact O-CB 3.39Å; I162-S166 PolarHBondContact O-N 3.01Å; I162-S166 PolarHBondContact O-OG 2.91Å; I162-W189 HydrophobicContact CD1-CD2 4.48Å; I162-W189 HydrophobicContact CD1-CG 4.17Å; I162-M282 HydrophobicContact CD1-CB 4.07Å; I162-M282 HydrophobicContact CD1-CE 3.47Å; I162-M282 VanDerWaalsContact CD1-CE 3.47Å; I162-M282 HydrophobicContact CD1-CG 3.71Å; I162-M282 HydrophobicContact CD1-SD 4.29Å; I162-I285 HydrophobicContact CG2-CB 4.08Å; I162-I285 HydrophobicContact CG2-CG2 3.79Å; I162-T286 HydrophobicContact CG2-CG2 4.04Å
163M98.1Very high96.8Very high53 Ų5339.7 Ų39.726%0.26121%0.207SC..Hα-helixtrans-60.4-52.4174.7-74.2-179.9176.600112.1I159 L160 G165 S166 W167 I285I159-M163 HydrophobicContact CG2-CE 3.73Å; I159-M163 HydrophobicContact CG2-CG 4.47Å; I159-M163 HydrophobicContact CG2-SD 4.2Å; I159-M163 WeakPolarHBondContact O-CG 3.46Å; I159-M163 PolarHBondContact O-N 2.9Å; L160-M163 PolarHBondContact O-N 3.08Å; M163-G165 PolarHBondContact O-N 3.11Å; M163-S166 PolarHBondContact O-N 3.43Å; M163-W167 HydrophobicContact CB-CE3 3.96Å; M163-W167 HydrophobicContact CB-CH2 4.43Å; M163-W167 HydrophobicContact CB-CZ3 3.68Å; M163-W167 HydrophobicContact CG-CH2 4.25Å; M163-W167 HydrophobicContact CG-CZ3 3.96Å; M163-W167 PolarHBondContact O-N 3.39Å; M163-W167 HydrophobicContact SD-CH2 4.32Å; M163-W167 HydrophobicContact SD-CZ3 4.15Å; M163-I285 HydrophobicContact CE-CD1 3.64Å; M163-I285 HydrophobicContact CG-CD1 3.71Å; M163-I285 HydrophobicContact CG-CG2 4.46Å
164A97.9Very high96.8Very high21 Ų2140 Ų4017%0.17421%0.207CC..Hα-helixtrans-62.5-43.4-177.100000112.6A109 L160 S161 G168A109-A164 HydrophobicContact CB-CB 4.08Å; L160-A164 VanDerWaalsContact O-CB 3.27Å; L160-A164 WeakPolarHBondContact O-CB 3.39Å; L160-A164 PolarHBondContact O-N 3.47Å; S161-A164 PolarHBondContact O-N 3.45Å; A164-G168 WeakPolarHBondContact O-CA 3.41Å; A164-G168 PolarHBondContact O-N 3.1Å
165G97Very high96.8Very high0 Ų040.1 Ų40.10%021%0.208CC..Hα-helixtrans-67.2-3917700000112.6S161 M163 G169 T185S161-G165 PolarHBondContact O-N 3.22Å; M163-G165 PolarHBondContact O-N 3.11Å; G165-G169 PolarHBondContact O-N 3.49Å; G165-G169 VanDerWaalsContact O-N 3.14Å; G165-T185 VanDerWaalsContact CA-CG2 3.45Å
166S96.5Very high96.7Very high0 Ų040.9 Ų40.90%021%0.209CC..Hα-helixtrans-69.1-47.1-178.3-550000113.3I162 M163 N289I162-S166 WeakPolarHBondContact O-CB 3.39Å; I162-S166 PolarHBondContact O-N 3.01Å; I162-S166 PolarHBondContact O-OG 2.91Å; M163-S166 PolarHBondContact O-N 3.43Å; S166-N289 WeakPolarHBondContact CA-OD1 3.22Å; S166-N289 PolarHBondContact OG-OD1 3.16Å
167W96.1Very high96.7Very high153 Ų15338 Ų3858%0.5819%0.193SC*.Hα-helixtrans-73.7-38.1176.9-71.6-46000112.8M163 G169M163-W167 HydrophobicContact CB-CE3 3.96Å; M163-W167 HydrophobicContact CB-CH2 4.43Å; M163-W167 HydrophobicContact CB-CZ3 3.68Å; M163-W167 HydrophobicContact CG-CH2 4.25Å; M163-W167 HydrophobicContact CG-CZ3 3.96Å; M163-W167 PolarHBondContact O-N 3.39Å; M163-W167 HydrophobicContact SD-CH2 4.32Å; M163-W167 HydrophobicContact SD-CZ3 4.15Å; W167-G169 VanDerWaalsContact C-N 3.3Å; W167-G169 PolarHBondContact O-N 2.95Å
168G95.8Very high96.6Very high21 Ų2137.9 Ų37.922%0.21619%0.192CC..Hα-helixtrans-64.5-31.6-179.700000113.9A164 Y181A164-G168 WeakPolarHBondContact O-CA 3.41Å; A164-G168 PolarHBondContact O-N 3.1Å; G168-Y181 WeakPolarHBondContact O-CE2 3.45Å
169G94.6Very high96.6Very high1 Ų138.1 Ų38.11%0.0119%0.194CC..Hα-helixtrans-68.5-32.7-178.300000114.8G165 W167 N171 Q172G165-G169 PolarHBondContact O-N 3.49Å; G165-G169 VanDerWaalsContact O-N 3.14Å; W167-G169 VanDerWaalsContact C-N 3.3Å; W167-G169 PolarHBondContact O-N 2.95Å; G169-N171 VanDerWaalsContact C-N 3.26Å; G169-N171 PolarHBondContact O-N 3.21Å; G169-Q172 PolarHBondContact O-N 3.14Å
170L94.1Very high96.5Very high50 Ų5036.5 Ų36.526%0.26219%0.186SC..THydrogen-bonded Turntrans-61.1-31.1-172.1-70.9165000114L288 Y291 F292L170-L288 HydrophobicContact CD1-CD2 4.46Å; L170-Y291 HydrophobicContact CD2-CD1 3.65Å; L170-Y291 HydrophobicContact CD2-CE1 4.17Å; L170-F292 HydrophobicContact CD2-CB 4.05Å; L170-F292 HydrophobicContact CD2-CD1 4.46Å
171N95.4Very high96.5Very high139 Ų13934.3 Ų34.374%0.74317%0.172SC*.THydrogen-bonded Turntrans-89.3-5.7-173.7-162.615000113.4G169G169-N171 VanDerWaalsContact C-N 3.26Å; G169-N171 PolarHBondContact O-N 3.21Å
172Q95Very high96.5Very high46 Ų4634.3 Ų34.322%0.21517%0.172CC..  trans-97138.2-171.5-62.6-65.2-22.200112.5G169 K177 I178 Y181G169-Q172 PolarHBondContact O-N 3.14Å; Q172-K177 HydrophobicContact CB-CB 4.15Å; Q172-K177 VanDerWaalsContact CD-CD 3.49Å; Q172-K177 HydrophobicContact CG-CB 3.95Å; Q172-K177 HydrophobicContact CG-CD 4.28Å; Q172-I178 HydrophobicContact CB-CG1 4.03Å; Q172-I178 WeakPolarHBondContact O-CD1 3.41Å; Q172-Y181 HydrophobicContact CG-CD2 4.12Å; Q172-Y181 HydrophobicContact CG-CE2 3.76Å
173T94.9Very high96.4Very high72 Ų7234.4 Ų34.444%0.44217%0.173SC..  trans-108.5-7.717058.10000112.8T227T173-T227 WeakPolarHBondContact O-CG2 2.93Å; T173-T227 PolarHBondContact O-N 2.68Å
174Q96.5Very high96.4Very high47 Ų4731.9 Ų31.922%0.2216%0.16CC..BIsolated β-bridgetrans-86.1118.4179.2-63.6-71.7-32.800108.9R176 K177 I178Q174-R176 PolarHBondContact O-N 3.11Å; Q174-K177 HydrophobicContact CB-CB 4.3Å; Q174-K177 HydrophobicContact CB-CG 4.39Å; Q174-K177 PolarHBondContact O-N 3.27Å; Q174-I178 WeakPolarHBondContact O-CG1 3.47Å; Q174-I178 PolarHBondContact O-N 3.09Å
175L96.1Very high96.4Very high5 Ų531 Ų313%0.02615%0.153CC..Hα-helixtrans-60.3-36.1-172.6-60.2170.2000111.9K177 I178 L179 L219 T225 T227 L230 L296L175-K177 VanDerWaalsContact C-N 3.32Å; L175-K177 PolarHBondContact O-N 2.77Å; L175-I178 HydrophobicContact CD2-CD1 4.45Å; L175-I178 PolarHBondContact O-N 3.2Å; L175-L179 WeakPolarHBondContact O-CG 3.43Å; L175-L179 PolarHBondContact O-N 2.7Å; L175-L219 HydrophobicContact CB-CD1 4.23Å; L175-L219 HydrophobicContact CB-CD2 4.23Å; L175-L219 HydrophobicContact CD1-CD2 3.39Å; L175-L219 HydrophobicContact CG-CD2 4.34Å; L175-T225 WeakPolarHBondContact CB-O 3.27Å; L175-T225 PolarHBondContact N-O 3.15Å; L175-T227 HydrophobicContact CD2-CG2 4.18Å; L175-L230 HydrophobicContact CD1-CB 4.03Å; L175-L230 HydrophobicContact CD1-CD1 4.18Å; L175-L230 HydrophobicContact CD1-CD2 3.98Å; L175-L230 HydrophobicContact CD1-CG 4.31Å; L175-L230 HydrophobicContact CD2-CD2 3.77Å; L175-L296 HydrophobicContact CD2-CD1 3.66Å; L175-L296 HydrophobicContact CD2-CG 4.36Å
176R96.2Very high96.5Very high35 Ų3531.6 Ų31.613%0.13216%0.156CC..Hα-helixtrans-62.9-36.8176.4-64.8-167-64.9-87.3-2.3112.7T119 Q120 L124 Q174 A180T119-R176 WeakPolarHBondContact O-CD 3.37Å; T119-R176 PolarHBondContact O-NE 2.94Å; Q120-R176 PolarHBondContact O-NE 2.76Å; Q120-R176 VanDerWaalsContact O-NE 3.1Å; Q120-R176 PolarHBondContact O-NH2 3.48Å; L124-R176 HydrophobicContact CD2-CG 3.76Å; Q174-R176 PolarHBondContact O-N 3.11Å; R176-A180 WeakPolarHBondContact O-CB 3.33Å; R176-A180 PolarHBondContact O-N 3.49Å
177K96.8Very high96.6Very high34 Ų3431.7 Ų31.715%0.14816%0.156CC..Hα-helixtrans-75.4-37.5176.9-75.5-171.4149.9167.60112.2P116 Q120 Q172 Q174 L175 L179 A180 Y181P116-K177 HydrophobicContact CB-CD 4.42Å; P116-K177 HydrophobicContact CB-CG 4.22Å; Q120-K177 HydrophobicContact CB-CG 4.07Å; Q120-K177 HydrophobicContact CG-CG 4.39Å; Q172-K177 HydrophobicContact CB-CB 4.15Å; Q172-K177 VanDerWaalsContact CD-CD 3.49Å; Q172-K177 HydrophobicContact CG-CB 3.95Å; Q172-K177 HydrophobicContact CG-CD 4.28Å; Q174-K177 HydrophobicContact CB-CB 4.3Å; Q174-K177 HydrophobicContact CB-CG 4.39Å; Q174-K177 PolarHBondContact O-N 3.27Å; L175-K177 VanDerWaalsContact C-N 3.32Å; L175-K177 PolarHBondContact O-N 2.77Å; K177-L179 VanDerWaalsContact C-N 3.32Å; K177-L179 PolarHBondContact O-N 3.05Å; K177-A180 WeakPolarHBondContact O-CB 3.4Å; K177-A180 PolarHBondContact O-N 2.88Å; K177-Y181 WeakPolarHBondContact O-CD2 3.39Å; K177-Y181 PolarHBondContact O-N 3.45Å
178I96.9Very high96.6Very high6 Ų624.4 Ų24.43%0.03113%0.128CC..Hα-helixtrans-58.5-48.2173.3-63.4173.9000109.6Q172 Q174 L175 A180 Y181 S182 F292 Y293 L296Q172-I178 HydrophobicContact CB-CG1 4.03Å; Q172-I178 WeakPolarHBondContact O-CD1 3.41Å; Q174-I178 WeakPolarHBondContact O-CG1 3.47Å; Q174-I178 PolarHBondContact O-N 3.09Å; L175-I178 HydrophobicContact CD2-CD1 4.45Å; L175-I178 PolarHBondContact O-N 3.2Å; I178-A180 VanDerWaalsContact C-N 3.33Å; I178-A180 PolarHBondContact O-N 3.46Å; I178-Y181 PolarHBondContact O-N 2.91Å; I178-S182 PolarHBondContact O-N 3.18Å; I178-F292 HydrophobicContact CG2-CD2 3.8Å; I178-F292 HydrophobicContact CG2-CE2 3.45Å; I178-F292 VanDerWaalsContact CG2-CE2 3.45Å; I178-F292 HydrophobicContact CG2-CZ 4.46Å; I178-Y293 HydrophobicContact CG2-CE1 4.24Å; I178-L296 HydrophobicContact CD1-CD1 3.99Å
179L96.8Very high96.8Very high6 Ų623.5 Ų23.53%0.03112%0.118CC..Hα-helixtrans-64.2-36175.3-68.7176.5000112.6L175 K177 S182 S183 A215 F216 L219 L251L175-L179 WeakPolarHBondContact O-CG 3.43Å; L175-L179 PolarHBondContact O-N 2.7Å; K177-L179 VanDerWaalsContact C-N 3.32Å; K177-L179 PolarHBondContact O-N 3.05Å; L179-S182 WeakPolarHBondContact CA-OG 3.39Å; L179-S182 PolarHBondContact O-N 3.29Å; L179-S182 PolarHBondContact O-OG 3.44Å; L179-S183 PolarHBondContact O-N 2.9Å; L179-A215 HydrophobicContact CD1-CB 4.34Å; L179-A215 HydrophobicContact CD2-CB 4.05Å; L179-F216 HydrophobicContact CB-CZ 4.36Å; L179-F216 HydrophobicContact CD1-CD1 4.36Å; L179-F216 HydrophobicContact CD1-CD2 4.31Å; L179-F216 HydrophobicContact CD1-CE1 4.06Å; L179-F216 HydrophobicContact CD1-CE2 4Å; L179-F216 HydrophobicContact CD1-CG 4.48Å; L179-F216 HydrophobicContact CD1-CZ 3.86Å; L179-L219 HydrophobicContact CD1-CD1 3.58Å; L179-L251 HydrophobicContact CD2-CD1 4.25Å
180A97.5Very high96.9Very high0 Ų023.5 Ų23.50%012%0.118CC..Hα-helixtrans-60.9-48.5173.400000112.3V115 T119 R176 K177 I178 S182 S183 I184V115-A180 HydrophobicContact CG1-CB 4.1Å; T119-A180 HydrophobicContact CG2-CB 4.02Å; T119-A180 WeakPolarHBondContact OG1-CB 3.26Å; R176-A180 WeakPolarHBondContact O-CB 3.33Å; R176-A180 PolarHBondContact O-N 3.49Å; K177-A180 WeakPolarHBondContact O-CB 3.4Å; K177-A180 PolarHBondContact O-N 2.88Å; I178-A180 VanDerWaalsContact C-N 3.33Å; I178-A180 PolarHBondContact O-N 3.46Å; A180-S182 VanDerWaalsContact C-N 3.32Å; A180-S182 PolarHBondContact O-N 3.14Å; A180-S183 WeakPolarHBondContact O-CB 3.45Å; A180-S183 PolarHBondContact O-N 2.8Å; A180-S183 VanDerWaalsContact O-N 3.13Å; A180-S183 PolarHBondContact O-OG 3.32Å; A180-I184 WeakPolarHBondContact O-CG1 3.27Å; A180-I184 PolarHBondContact O-N 3.19Å; A180-I184 VanDerWaalsContact O-N 3.12Å
181Y98.1Very high97.1Very high32 Ų3221.3 Ų21.313%0.12511%0.106CC..Hα-helixtrans-65.7-35.8177.3-74.5-63.5000112.6P116 G168 Q172 K177 I178 S183 I184 T185P116-Y181 HydrophobicContact CB-CE2 4.34Å; P116-Y181 HydrophobicContact CG-CE1 3.89Å; P116-Y181 HydrophobicContact CG-CE2 4.05Å; G168-Y181 WeakPolarHBondContact O-CE2 3.45Å; Q172-Y181 HydrophobicContact CG-CD2 4.12Å; Q172-Y181 HydrophobicContact CG-CE2 3.76Å; K177-Y181 WeakPolarHBondContact O-CD2 3.39Å; K177-Y181 PolarHBondContact O-N 3.45Å; I178-Y181 PolarHBondContact O-N 2.91Å; Y181-S183 VanDerWaalsContact C-N 3.31Å; Y181-S183 PolarHBondContact O-N 3Å; Y181-I184 HydrophobicContact CD1-CD1 3.83Å; Y181-I184 HydrophobicContact CE1-CD1 4.27Å; Y181-I184 PolarHBondContact O-N 3.25Å; Y181-T185 PolarHBondContact O-N 2.94Å; Y181-T185 VanDerWaalsContact O-N 3.16Å
182S97Very high97.2Very high0 Ų014.7 Ų14.70%07%0.071CC..Hα-helixtrans-57.6-45.2170.278.50000111.9I178 L179 A180 I184 T185 H186 Y293I178-S182 PolarHBondContact O-N 3.18Å; L179-S182 WeakPolarHBondContact CA-OG 3.39Å; L179-S182 PolarHBondContact O-N 3.29Å; L179-S182 PolarHBondContact O-OG 3.44Å; A180-S182 VanDerWaalsContact C-N 3.32Å; A180-S182 PolarHBondContact O-N 3.14Å; S182-I184 VanDerWaalsContact C-N 3.3Å; S182-I184 PolarHBondContact O-N 3.17Å; S182-T185 PolarHBondContact O-N 3.09Å; S182-T185 VanDerWaalsContact O-N 3.15Å; S182-T185 PolarHBondContact O-OG1 3.29Å; S182-H186 PolarHBondContact O-CD2 3.31Å; S182-H186 PolarHBondContact O-N 3.49Å; S182-Y293 WeakPolarHBondContact CB-OH 3.39Å
183S97.4Very high97.3Very high1 Ų112.5 Ų12.51%0.0076%0.061CC..Hα-helixtrans-60.5-39.8178.775.80000112.2L131 L179 A180 Y181 T185 H186 M187 Y208L131-S183 WeakPolarHBondContact CD2-OG 3.37Å; L179-S183 PolarHBondContact O-N 2.9Å; A180-S183 WeakPolarHBondContact O-CB 3.45Å; A180-S183 PolarHBondContact O-N 2.8Å; A180-S183 VanDerWaalsContact O-N 3.13Å; A180-S183 PolarHBondContact O-OG 3.32Å; Y181-S183 VanDerWaalsContact C-N 3.31Å; Y181-S183 PolarHBondContact O-N 3Å; S183-T185 VanDerWaalsContact C-N 3.33Å; S183-T185 PolarHBondContact O-N 3.36Å; S183-H186 PolarHBondContact O-N 3.24Å; S183-M187 WeakPolarHBondContact O-CB 3.5Å; S183-M187 VanDerWaalsContact O-CG 3.25Å; S183-M187 WeakPolarHBondContact O-CG 3.29Å; S183-M187 PolarHBondContact O-N 3.05Å; S183-Y208 WeakPolarHBondContact CB-OH 3.26Å
184I98.4Very high97.3Very high1 Ų19 Ų91%0.0054%0.04CC..Hα-helixtrans-62.1-43.4178.1-64161.5000110.2H112 V115 S161 A180 Y181 S182 M187 G188H112-I184 HydrophobicContact CB-CD1 3.8Å; H112-I184 HydrophobicContact CB-CG1 4.15Å; H112-I184 HydrophobicContact CB-CG2 4.07Å; V115-I184 HydrophobicContact CB-CD1 4.25Å; V115-I184 HydrophobicContact CB-CG1 4.46Å; V115-I184 HydrophobicContact CG1-CG1 4.44Å; S161-I184 WeakPolarHBondContact O-CG2 3.34Å; A180-I184 WeakPolarHBondContact O-CG1 3.27Å; A180-I184 PolarHBondContact O-N 3.19Å; A180-I184 VanDerWaalsContact O-N 3.12Å; Y181-I184 HydrophobicContact CD1-CD1 3.83Å; Y181-I184 HydrophobicContact CE1-CD1 4.27Å; Y181-I184 PolarHBondContact O-N 3.25Å; S182-I184 VanDerWaalsContact C-N 3.3Å; S182-I184 PolarHBondContact O-N 3.17Å; I184-M187 PolarHBondContact O-N 2.96Å; I184-G188 PolarHBondContact O-N 3.16Å; I184-G188 VanDerWaalsContact O-N 3.11Å
185T98.1Very high97.2Very high3 Ų38.3 Ų8.32%0.0184%0.039CC..Hα-helixtrans-67.9-41.3177.863.10000113.1G165 Y181 S182 S183 M187 G188 W189 N289G165-T185 VanDerWaalsContact CA-CG2 3.45Å; Y181-T185 PolarHBondContact O-N 2.94Å; Y181-T185 VanDerWaalsContact O-N 3.16Å; S182-T185 PolarHBondContact O-N 3.09Å; S182-T185 VanDerWaalsContact O-N 3.15Å; S182-T185 PolarHBondContact O-OG1 3.29Å; S183-T185 VanDerWaalsContact C-N 3.33Å; S183-T185 PolarHBondContact O-N 3.36Å; T185-M187 VanDerWaalsContact C-N 3.32Å; T185-M187 PolarHBondContact O-N 2.95Å; T185-G188 WeakPolarHBondContact O-CA 3.38Å; T185-G188 PolarHBondContact O-N 3.37Å; T185-G188 VanDerWaalsContact O-N 3.1Å; T185-W189 PolarHBondContact O-N 3.22Å; T185-W189 VanDerWaalsContact O-N 3.09Å; T185-N289 VanDerWaalsContact CB-ND2 3.27Å; T185-N289 WeakPolarHBondContact CB-ND2 3.17Å; T185-N289 WeakPolarHBondContact CG2-ND2 3.32Å; T185-N289 PolarHBondContact OG1-ND2 2.81Å
186H98.1Very high97.1Very high12 Ų1211.3 Ų11.36%0.0565%0.051CC..Hα-helixtrans-63.3-39.5176.2-79.6-74.7000111.7S182 S183 G188 W189 M190 Y208 L251S182-H186 PolarHBondContact O-CD2 3.31Å; S182-H186 PolarHBondContact O-N 3.49Å; S183-H186 PolarHBondContact O-N 3.24Å; H186-G188 PolarHBondContact O-N 3.38Å; H186-W189 PolarHBondContact O-N 3.3Å; H186-M190 HydrophobicContact CB-CE 4.15Å; H186-M190 VanDerWaalsContact O-CG 3.28Å; H186-M190 WeakPolarHBondContact O-CG 3.37Å; H186-M190 PolarHBondContact O-N 3.37Å; H186-Y208 HydrophobicContact CB-CD2 3.63Å; H186-Y208 HydrophobicContact CB-CE2 3.91Å; H186-Y208 HydrophobicContact CB-CG 4.33Å; H186-Y208 AromaticContact CD2-CD2 3.72Å; H186-Y208 AromaticContact CD2-CE2 3.97Å; H186-Y208 AromaticContact CG-CD2 3.58Å; H186-L251 PolarHBondContact NE2-O 3.46Å
187M98Very high97Very high1 Ų111.9 Ų11.91%0.0056%0.056CC..Hα-helixtrans-59.9-36.5172.6-71.8-51.8-45.400112.2L106 M108 K135 I139 S183 I184 T185 M190 M191L106-M187 HydrophobicContact CB-CE 3.95Å; L106-M187 HydrophobicContact CD1-CE 3.8Å; L106-M187 HydrophobicContact CD2-CE 3.65Å; L106-M187 HydrophobicContact CD2-SD 4.45Å; L106-M187 HydrophobicContact CG-CE 4.01Å; M108-M187 HydrophobicContact CE-CB 4.32Å; M108-M187 HydrophobicContact CE-CE 3.6Å; M108-M187 HydrophobicContact CG-CB 4.47Å; K135-M187 HydrophobicContact CB-SD 4.45Å; K135-M187 HydrophobicContact CD-SD 3.75Å; K135-M187 HydrophobicContact CG-SD 4.09Å; I139-M187 HydrophobicContact CD1-CE 3.77Å; I139-M187 HydrophobicContact CD1-SD 4.33Å; I139-M187 HydrophobicContact CG1-CE 4.28Å; S183-M187 WeakPolarHBondContact O-CB 3.5Å; S183-M187 VanDerWaalsContact O-CG 3.25Å; S183-M187 WeakPolarHBondContact O-CG 3.29Å; S183-M187 PolarHBondContact O-N 3.05Å; I184-M187 PolarHBondContact O-N 2.96Å; T185-M187 VanDerWaalsContact C-N 3.32Å; T185-M187 PolarHBondContact O-N 2.95Å; M187-M190 HydrophobicContact CE-SD 4.44Å; M187-M190 PolarHBondContact O-N 2.55Å; M187-M190 HydrophobicContact SD-SD 4Å; M187-M191 HydrophobicContact CE-CE 3.82Å; M187-M191 WeakPolarHBondContact O-CG 3.45Å; M187-M191 PolarHBondContact O-N 3.34Å; M187-M191 VanDerWaalsContact O-N 3.08Å
188G97.8Very high97Very high0 Ų011.4 Ų11.40%06%0.056CC..Hα-helixtrans-60.9-50.8172.500000113.1S158 S161 I184 T185 H186 M190 M191 A192S158-G188 WeakPolarHBondContact CB-O 3.41Å; S161-G188 WeakPolarHBondContact OG-CA 3.42Å; S161-G188 PolarHBondContact OG-N 3.48Å; I184-G188 PolarHBondContact O-N 3.16Å; I184-G188 VanDerWaalsContact O-N 3.11Å; T185-G188 WeakPolarHBondContact O-CA 3.38Å; T185-G188 PolarHBondContact O-N 3.37Å; T185-G188 VanDerWaalsContact O-N 3.1Å; H186-G188 PolarHBondContact O-N 3.38Å; G188-M190 VanDerWaalsContact C-N 3.3Å; G188-M190 PolarHBondContact O-N 3.07Å; G188-M191 PolarHBondContact O-N 2.93Å; G188-A192 WeakPolarHBondContact O-CB 3.47Å; G188-A192 PolarHBondContact O-N 3.36Å
189W98.1Very high97Very high3 Ų313.7 Ų13.71%0.0117%0.069CC..Hα-helixtrans-59.8-40.1176.2-80.184.5000112.8I162 T185 H186 I266 I267 M282 A283 T286I162-W189 HydrophobicContact CD1-CD2 4.48Å; I162-W189 HydrophobicContact CD1-CG 4.17Å; T185-W189 PolarHBondContact O-N 3.22Å; T185-W189 VanDerWaalsContact O-N 3.09Å; H186-W189 PolarHBondContact O-N 3.3Å; W189-I266 HydrophobicContact CB-CD1 4.3Å; W189-I266 HydrophobicContact CE3-CB 4.29Å; W189-I266 HydrophobicContact CE3-CD1 4Å; W189-I266 HydrophobicContact CE3-CG2 3.63Å; W189-I266 HydrophobicContact CZ3-CB 4.42Å; W189-I266 HydrophobicContact CZ3-CG2 3.7Å; W189-I267 HydrophobicContact CZ3-CG1 4.32Å; W189-M282 HydrophobicContact CB-CE 4.49Å; W189-M282 HydrophobicContact CD2-CE 3.54Å; W189-M282 HydrophobicContact CE3-CE 3.52Å; W189-M282 HydrophobicContact CG-CE 4.01Å; W189-M282 HydrophobicContact CH2-CB 3.79Å; W189-M282 HydrophobicContact CH2-CE 4.3Å; W189-M282 HydrophobicContact CZ2-CB 3.58Å; W189-M282 HydrophobicContact CZ2-CE 4.33Å; W189-M282 HydrophobicContact CZ3-CB 4.47Å; W189-M282 HydrophobicContact CZ3-CE 3.92Å; W189-A283 HydrophobicContact CH2-CB 4.48Å; W189-T286 HydrophobicContact CZ2-CG2 3.78Å
190M98.1Very high97Very high1 Ų114.8 Ų14.81%0.0057%0.074CC..Hα-helixtrans-62.5-45.2178.4-70.6171.3-163.500111.8I139 H186 M187 G188 T201 N204 L205 Y208I139-M190 HydrophobicContact CD1-SD 4.08Å; H186-M190 HydrophobicContact CB-CE 4.15Å; H186-M190 VanDerWaalsContact O-CG 3.28Å; H186-M190 WeakPolarHBondContact O-CG 3.37Å; H186-M190 PolarHBondContact O-N 3.37Å; M187-M190 HydrophobicContact CE-SD 4.44Å; M187-M190 PolarHBondContact O-N 2.55Å; M187-M190 HydrophobicContact SD-SD 4Å; G188-M190 VanDerWaalsContact C-N 3.3Å; G188-M190 PolarHBondContact O-N 3.07Å; M190-T201 WeakPolarHBondContact O-CB 3.28Å; M190-T201 WeakPolarHBondContact O-CG2 3.38Å; M190-N204 HydrophobicContact CE-CB 4.49Å; M190-N204 HydrophobicContact CG-CB 3.97Å; M190-N204 WeakPolarHBondContact CG-ND2 3.08Å; M190-L205 HydrophobicContact CE-CB 4.34Å; M190-L205 HydrophobicContact SD-CB 4.15Å; M190-Y208 HydrophobicContact CE-CD1 3.77Å; M190-Y208 HydrophobicContact CE-CD2 4.35Å; M190-Y208 HydrophobicContact CE-CG 3.57Å
191M97.6Very high96.9Very high3 Ų314.9 Ų14.92%0.0158%0.075CC..Hα-helixtrans-74.6-29.7-178.3-67.2-66.1128.300114L106 M108 I139 M142 L154 M187 G188 V193 L194L106-M191 HydrophobicContact CD1-CE 3.54Å; L106-M191 HydrophobicContact CD1-SD 4.25Å; M108-M191 HydrophobicContact CE-CB 4.3Å; M108-M191 HydrophobicContact CE-CE 3.65Å; M108-M191 HydrophobicContact CE-CG 2.97Å; M108-M191 HydrophobicContact CE-SD 3.46Å; M108-M191 WeakPolarHBondContact CE-SD 3.14Å; M108-M191 HydrophobicContact SD-CB 4.47Å; M108-M191 HydrophobicContact SD-CG 3.55Å; M108-M191 VanDerWaalsContact SD-CG 3.55Å; M108-M191 HydrophobicContact SD-SD 4.28Å; I139-M191 HydrophobicContact CD1-CE 4.2Å; I139-M191 HydrophobicContact CG1-CE 3.64Å; M142-M191 HydrophobicContact CE-SD 4.11Å; M142-M191 HydrophobicContact CG-SD 4.42Å; L154-M191 HydrophobicContact CD1-CB 4.06Å; L154-M191 HydrophobicContact CD1-SD 4.48Å; L154-M191 WeakPolarHBondContact CD2-O 3.19Å; M187-M191 HydrophobicContact CE-CE 3.82Å; M187-M191 WeakPolarHBondContact O-CG 3.45Å; M187-M191 PolarHBondContact O-N 3.34Å; M187-M191 VanDerWaalsContact O-N 3.08Å; G188-M191 PolarHBondContact O-N 2.93Å; M191-V193 PolarHBondContact O-N 3.33Å; M191-V193 VanDerWaalsContact O-N 3.16Å; M191-L194 HydrophobicContact CE-CD1 3.88Å; M191-L194 HydrophobicContact CG-CD1 4.43Å; M191-L194 PolarHBondContact O-N 3.39Å; M191-L194 HydrophobicContact SD-CD1 3.21Å; M191-L194 WeakPolarHBondContact SD-CD1 3.11Å; M191-L194 HydrophobicContact SD-CG 4.34Å
192A97.5Very high96.9Very high0 Ų015.2 Ų15.20%08%0.078CC..Hα-helixtrans-59-30.3-177.400000112.2L155 G188 F270 M282L155-A192 HydrophobicContact CD2-CB 4.45Å; G188-A192 WeakPolarHBondContact O-CB 3.47Å; G188-A192 PolarHBondContact O-N 3.36Å; A192-F270 HydrophobicContact CB-CE2 4.28Å; A192-F270 HydrophobicContact CB-CZ 3.82Å; A192-F270 WeakPolarHBondContact O-CZ 3.43Å; A192-M282 HydrophobicContact CB-CE 3.46Å; A192-M282 VanDerWaalsContact CB-CE 3.46Å; A192-M282 HydrophobicContact CB-SD 3.96Å
193V97.3Very high96.9Very high0 Ų015.4 Ų15.40%08%0.079CC..Hα-helixtrans-97.1-14.4-175.5178.40000114.6M191 P195 Y196 N197 M200 T201 I266 E269 F270M191-V193 PolarHBondContact O-N 3.33Å; M191-V193 VanDerWaalsContact O-N 3.16Å; V193-P195 VanDerWaalsContact C-N 3.33Å; V193-P195 VanDerWaalsContact O-N 3.15Å; V193-Y196 PolarHBondContact O-N 3Å; V193-N197 PolarHBondContact O-N 3.5Å; V193-M200 HydrophobicContact CG1-CB 3.91Å; V193-T201 HydrophobicContact CB-CG2 4.03Å; V193-T201 HydrophobicContact CG1-CG2 4.28Å; V193-I266 HydrophobicContact CB-CG1 4.37Å; V193-I266 HydrophobicContact CG2-CB 3.81Å; V193-I266 HydrophobicContact CG2-CD1 4.28Å; V193-I266 HydrophobicContact CG2-CG1 3.65Å; V193-I266 HydrophobicContact CG2-CG2 3.2Å; V193-E269 WeakPolarHBondContact CG1-OE2 3.5Å; V193-F270 HydrophobicContact CG2-CD2 4.1Å; V193-F270 HydrophobicContact CG2-CE2 3.42Å; V193-F270 VanDerWaalsContact CG2-CE2 3.42Å; V193-F270 HydrophobicContact CG2-CZ 4.02Å
194L95.9Very high97Very high0 Ų015.5 Ų15.50%08%0.08CC..THydrogen-bonded Turntrans-46.9-44.7179.6-82.6177.2000115.3M142 L154 M191 Y196 P198 T201M142-L194 HydrophobicContact CB-CD1 3.82Å; M142-L194 HydrophobicContact CE-CD1 3.96Å; L154-L194 HydrophobicContact CD2-CB 4.16Å; M191-L194 HydrophobicContact CE-CD1 3.88Å; M191-L194 HydrophobicContact CG-CD1 4.43Å; M191-L194 PolarHBondContact O-N 3.39Å; M191-L194 HydrophobicContact SD-CD1 3.21Å; M191-L194 WeakPolarHBondContact SD-CD1 3.11Å; M191-L194 HydrophobicContact SD-CG 4.34Å; L194-Y196 VanDerWaalsContact C-N 3.25Å; L194-Y196 PolarHBondContact O-N 3.22Å; L194-P198 WeakPolarHBondContact O-CG 3.23Å; L194-T201 HydrophobicContact CB-CG2 4.27Å; L194-T201 HydrophobicContact CD2-CG2 3.66Å; L194-T201 WeakPolarHBondContact CD2-OG1 3.49Å; L194-T201 HydrophobicContact CG-CG2 3.77Å
195P93.6Very high96.9Very high32 Ų3216.1 Ų16.121%0.2088%0.083CC..THydrogen-bonded Turntrans-75.3-17.1-176.429.1-32000112.9V151 L154 V193V151-P195 HydrophobicContact CG1-CG 4.19Å; V151-P195 HydrophobicContact CG2-CB 3.83Å; V151-P195 HydrophobicContact CG2-CG 4.38Å; L154-P195 HydrophobicContact CD2-CG 4.17Å; V193-P195 VanDerWaalsContact C-N 3.33Å; V193-P195 VanDerWaalsContact O-N 3.15Å
196Y93.6Very high96.9Very high68 Ų6818.6 Ų18.627%0.26710%0.098SC..THydrogen-bonded Turntrans-93.2-56.1-177.3-62.8-63.2000111.6V193 L194 F270 N273V193-Y196 PolarHBondContact O-N 3Å; L194-Y196 VanDerWaalsContact C-N 3.25Å; L194-Y196 PolarHBondContact O-N 3.22Å; Y196-F270 HydrophobicContact CD2-CD1 4.15Å; Y196-F270 AromaticContact CD2-CE1 3.86Å; Y196-F270 HydrophobicContact CD2-CE1 3.86Å; Y196-F270 HydrophobicContact CD2-CZ 4.32Å; Y196-F270 AromaticContact CE2-CD1 3.72Å; Y196-F270 HydrophobicContact CE2-CD1 3.72Å; Y196-F270 AromaticContact CE2-CE1 3.29Å; Y196-F270 HydrophobicContact CE2-CE1 3.29Å; Y196-F270 HydrophobicContact CE2-CZ 4.08Å; Y196-N273 WeakPolarHBondContact CB-ND2 3.45Å; Y196-N273 HydrophobicContact CD1-CB 3.86Å; Y196-N273 WeakPolarHBondContact CD1-ND2 3.35Å; Y196-N273 HydrophobicContact CE1-CB 3.92Å
197N95.3Very high96.9Very high46 Ų4618.2 Ų18.225%0.24610%0.097CC..  trans-150.4107.4172.3-174.8-1000110.1V193 N199 M200 E269V193-N197 PolarHBondContact O-N 3.5Å; N197-N199 PolarHBondContact O-N 2.9Å; N197-N199 VanDerWaalsContact O-N 3.1Å; N197-N199 WeakPolarHBondContact OD1-CB 3.46Å; N197-N199 PolarHBondContact OD1-N 3.34Å; N197-N199 VanDerWaalsContact OD1-N 3.09Å; N197-M200 PolarHBondContact O-N 3.13Å; N197-E269 VanDerWaalsContact CB-CD 3.46Å; N197-E269 WeakPolarHBondContact CB-OE1 3.2Å; N197-E269 WeakPolarHBondContact CB-OE2 3.4Å; N197-E269 VanDerWaalsContact CG-OE1 3.31Å; N197-E269 PolarHBondContact ND2-OE1 3.21Å
198P95.3Very high96.9Very high24 Ų2418.3 Ų18.316%0.15610%0.097CC..Hα-helixtrans-57.7-26.1179-27.236.2000114.3Y143 S146 L194 M200 T201 I202Y143-P198 HydrophobicContact CD2-CB 3.28Å; Y143-P198 HydrophobicContact CD2-CG 4.48Å; Y143-P198 HydrophobicContact CE2-CB 3.23Å; Y143-P198 HydrophobicContact CE2-CG 4.41Å; Y143-P198 HydrophobicContact CG-CB 4.23Å; S146-P198 WeakPolarHBondContact OG-CG 3.49Å; L194-P198 WeakPolarHBondContact O-CG 3.23Å; P198-M200 PolarHBondContact O-N 3.26Å; P198-T201 WeakPolarHBondContact O-CB 2.94Å; P198-T201 PolarHBondContact O-N 3.43Å; P198-T201 VanDerWaalsContact O-N 3.09Å; P198-T201 PolarHBondContact O-OG1 3.46Å; P198-I202 PolarHBondContact O-N 2.89Å
199N96.6Very high96.9Very high54 Ų5420.2 Ų20.229%0.28911%0.107SC..Hα-helixtrans-65.5-36-175.9-67.9-5.4000112.7Y143 N197 T201 I202 L203 L347Y143-N199 PolarHBondContact OH-OD1 3.39Å; N197-N199 PolarHBondContact O-N 2.9Å; N197-N199 VanDerWaalsContact O-N 3.1Å; N197-N199 WeakPolarHBondContact OD1-CB 3.46Å; N197-N199 PolarHBondContact OD1-N 3.34Å; N197-N199 VanDerWaalsContact OD1-N 3.09Å; N199-T201 PolarHBondContact O-N 3.02Å; N199-I202 PolarHBondContact O-N 3.04Å; N199-L203 PolarHBondContact O-N 3.04Å; N199-L347 WeakPolarHBondContact O-CD1 3.47Å
200M97Very high96.9Very high29 Ų2921.7 Ų21.714%0.14311%0.114CC..Hα-helixtrans-68.7-23.8175.7-64.3-51.4163.500113V193 N197 P198 L203 N204 A265 I266 E269 L344V193-M200 HydrophobicContact CG1-CB 3.91Å; N197-M200 PolarHBondContact O-N 3.13Å; P198-M200 PolarHBondContact O-N 3.26Å; M200-L203 PolarHBondContact O-N 3.5Å; M200-L203 HydrophobicContact SD-CD2 3.78Å; M200-N204 WeakPolarHBondContact O-CB 3.49Å; M200-N204 PolarHBondContact O-N 3.41Å; M200-A265 HydrophobicContact SD-CB 3.8Å; M200-I266 HydrophobicContact CB-CG1 4.45Å; M200-E269 WeakPolarHBondContact CB-OE2 3.45Å; M200-E269 WeakPolarHBondContact CE-OE1 3.35Å; M200-E269 HydrophobicContact CG-CG 4.19Å; M200-E269 WeakPolarHBondContact CG-OE1 3.36Å; M200-E269 WeakPolarHBondContact CG-OE2 3.44Å; M200-L344 HydrophobicContact CE-CD2 3.9Å; M200-L344 HydrophobicContact SD-CD2 3.74Å
201T96.9Very high96.9Very high2 Ų221.8 Ų21.81%0.01212%0.115CC..Hα-helixtrans-69.9-38.2174.579.50000110.9M190 V193 L194 P198 N199 N204 L205M190-T201 WeakPolarHBondContact O-CB 3.28Å; M190-T201 WeakPolarHBondContact O-CG2 3.38Å; V193-T201 HydrophobicContact CB-CG2 4.03Å; V193-T201 HydrophobicContact CG1-CG2 4.28Å; L194-T201 HydrophobicContact CB-CG2 4.27Å; L194-T201 HydrophobicContact CD2-CG2 3.66Å; L194-T201 WeakPolarHBondContact CD2-OG1 3.49Å; L194-T201 HydrophobicContact CG-CG2 3.77Å; P198-T201 WeakPolarHBondContact O-CB 2.94Å; P198-T201 PolarHBondContact O-N 3.43Å; P198-T201 VanDerWaalsContact O-N 3.09Å; P198-T201 PolarHBondContact O-OG1 3.46Å; N199-T201 PolarHBondContact O-N 3.02Å; T201-N204 PolarHBondContact O-N 2.89Å; T201-L205 WeakPolarHBondContact O-CB 3.31Å; T201-L205 PolarHBondContact O-N 3.48Å
202I97.3Very high96.9Very high39 Ų3921.7 Ų21.720%0.211%0.114CC..Hα-helixtrans-68.3-42.5173.9-59.6173.2000110.3Y143 P198 N199 N204 L205 T206 L347Y143-I202 HydrophobicContact CD2-CD1 3.59Å; Y143-I202 HydrophobicContact CD2-CG1 4.05Å; Y143-I202 HydrophobicContact CE2-CD1 3.32Å; Y143-I202 HydrophobicContact CE2-CG1 4.16Å; Y143-I202 HydrophobicContact CG-CD1 4.49Å; P198-I202 PolarHBondContact O-N 2.89Å; N199-I202 PolarHBondContact O-N 3.04Å; I202-N204 VanDerWaalsContact C-N 3.34Å; I202-N204 PolarHBondContact O-N 3.21Å; I202-L205 PolarHBondContact O-N 3.06Å; I202-T206 HydrophobicContact CG2-CG2 4.29Å; I202-T206 WeakPolarHBondContact O-CG2 3.28Å; I202-T206 PolarHBondContact O-N 3.09Å; I202-T206 PolarHBondContact O-OG1 3.43Å; I202-L347 HydrophobicContact CB-CD1 3.59Å; I202-L347 HydrophobicContact CB-CD2 4.42Å; I202-L347 HydrophobicContact CD1-CD2 4.45Å; I202-L347 HydrophobicContact CG2-CD1 3.57Å; I202-L347 HydrophobicContact CG2-CD2 3.66Å; I202-L347 HydrophobicContact CG2-CG 4.23Å
203L97.8Very high96.9Very high4 Ų422.7 Ų22.72%0.02112%0.121CC..Hα-helixtrans-55.8-48.7173.9179.473.7000111.4N199 M200 L205 T206 I207 L261 A265 M343 L344N199-L203 PolarHBondContact O-N 3.04Å; M200-L203 PolarHBondContact O-N 3.5Å; M200-L203 HydrophobicContact SD-CD2 3.78Å; L203-L205 PolarHBondContact O-N 3.01Å; L203-T206 PolarHBondContact O-N 3.42Å; L203-T206 PolarHBondContact O-OG1 2.96Å; L203-I207 HydrophobicContact CD1-CD1 4.14Å; L203-I207 HydrophobicContact CG-CD1 4.18Å; L203-I207 WeakPolarHBondContact O-CG1 3.44Å; L203-I207 PolarHBondContact O-N 3.16Å; L203-I207 VanDerWaalsContact O-N 3.17Å; L203-L261 HydrophobicContact CD1-CD2 4.25Å; L203-L261 HydrophobicContact CD2-CD2 3.6Å; L203-L261 HydrophobicContact CG-CD2 4.22Å; L203-A265 HydrophobicContact CD2-CB 4.23Å; L203-M343 HydrophobicContact CD1-CB 4.31Å; L203-M343 HydrophobicContact CD1-CE 4.47Å; L203-L344 HydrophobicContact CD2-CD2 3.59Å
204N97.9Very high96.9Very high4 Ų422.7 Ų22.72%0.02112%0.121CC..Hα-helixtrans-63.8-41.5177.5-170.13.8000111.4M190 M200 T201 I202 T206 Y208 P262 I266M190-N204 HydrophobicContact CE-CB 4.49Å; M190-N204 HydrophobicContact CG-CB 3.97Å; M190-N204 WeakPolarHBondContact CG-ND2 3.08Å; M200-N204 WeakPolarHBondContact O-CB 3.49Å; M200-N204 PolarHBondContact O-N 3.41Å; T201-N204 PolarHBondContact O-N 2.89Å; I202-N204 VanDerWaalsContact C-N 3.34Å; I202-N204 PolarHBondContact O-N 3.21Å; N204-T206 PolarHBondContact O-N 2.87Å; N204-Y208 WeakPolarHBondContact O-CB 3.26Å; N204-Y208 PolarHBondContact O-N 2.95Å; N204-P262 HydrophobicContact CB-CB 3.85Å; N204-I266 HydrophobicContact CB-CD1 4.33Å; N204-I266 WeakPolarHBondContact ND2-CD1 2.93Å
205L98.1Very high96.9Very high14 Ų1423 Ų237%0.07312%0.123CC..Hα-helixtrans-58.6-47.3176.1171.6148.1000112.5L136 I139 M190 T201 I202 L203 Y208 I209L136-L205 HydrophobicContact CD2-CD1 4.23Å; L136-L205 HydrophobicContact CD2-CD2 3.87Å; I139-L205 HydrophobicContact CB-CD1 4.07Å; I139-L205 HydrophobicContact CD1-CD1 3.32Å; I139-L205 HydrophobicContact CD1-CG 4.48Å; I139-L205 HydrophobicContact CG1-CD1 4.25Å; I139-L205 HydrophobicContact CG2-CD1 3.96Å; M190-L205 HydrophobicContact CE-CB 4.34Å; M190-L205 HydrophobicContact SD-CB 4.15Å; T201-L205 WeakPolarHBondContact O-CB 3.31Å; T201-L205 PolarHBondContact O-N 3.48Å; I202-L205 PolarHBondContact O-N 3.06Å; L203-L205 PolarHBondContact O-N 3.01Å; L205-Y208 PolarHBondContact O-N 2.66Å; L205-I209 HydrophobicContact CD2-CD1 3.57Å; L205-I209 HydrophobicContact CG-CD1 3.98Å; L205-I209 VanDerWaalsContact O-CG1 3.3Å; L205-I209 WeakPolarHBondContact O-CG1 3.27Å; L205-I209 PolarHBondContact O-N 3.27Å
206T97.6Very high97Very high54 Ų5421.5 Ų21.533%0.33111%0.113SC..Hα-helixtrans-65-46.4-177.254.60000111I202 L203 N204 Y208 I209 I210I202-T206 HydrophobicContact CG2-CG2 4.29Å; I202-T206 WeakPolarHBondContact O-CG2 3.28Å; I202-T206 PolarHBondContact O-N 3.09Å; I202-T206 PolarHBondContact O-OG1 3.43Å; L203-T206 PolarHBondContact O-N 3.42Å; L203-T206 PolarHBondContact O-OG1 2.96Å; N204-T206 PolarHBondContact O-N 2.87Å; T206-Y208 PolarHBondContact O-N 2.95Å; T206-I209 PolarHBondContact O-N 3.4Å; T206-I210 WeakPolarHBondContact O-CG1 3.16Å; T206-I210 PolarHBondContact O-N 3.39Å; T206-I210 VanDerWaalsContact O-N 3.11Å
207I97.8Very high97Very high5 Ų519.6 Ų19.63%0.02611%0.107CC..Hα-helixtrans-61.8-45.4176.1-66173.8000110.3L203 I209 I210 L211 L261 P262L203-I207 HydrophobicContact CD1-CD1 4.14Å; L203-I207 HydrophobicContact CG-CD1 4.18Å; L203-I207 WeakPolarHBondContact O-CG1 3.44Å; L203-I207 PolarHBondContact O-N 3.16Å; L203-I207 VanDerWaalsContact O-N 3.17Å; I207-I209 VanDerWaalsContact C-N 3.34Å; I207-I209 PolarHBondContact O-N 2.98Å; I207-I210 WeakPolarHBondContact O-CB 3.38Å; I207-I210 PolarHBondContact O-N 2.83Å; I207-I210 VanDerWaalsContact O-N 3.15Å; I207-L211 HydrophobicContact CG2-CD1 3.94Å; I207-L211 HydrophobicContact CG2-CG 4.21Å; I207-L211 VanDerWaalsContact O-CG 3.29Å; I207-L211 WeakPolarHBondContact O-CG 3.48Å; I207-L211 PolarHBondContact O-N 3.3Å; I207-L261 HydrophobicContact CD1-CD2 4.23Å; I207-P262 HydrophobicContact CB-CG 4.46Å; I207-P262 HydrophobicContact CD1-CB 4.26Å; I207-P262 HydrophobicContact CD1-CG 3.99Å; I207-P262 HydrophobicContact CG2-CG 4.22Å
208Y98.1Very high97Very high3 Ų317.5 Ų17.51%0.01210%0.097CC..Hα-helixtrans-59.7-40177.1165.6-97.4000113L131 S183 H186 M190 N204 L205 T206 L211 T212L131-Y208 VanDerWaalsContact O-CE1 3.26Å; L131-Y208 WeakPolarHBondContact O-CE1 3.27Å; L131-Y208 PolarHBondContact O-OH 3.48Å; S183-Y208 WeakPolarHBondContact CB-OH 3.26Å; H186-Y208 HydrophobicContact CB-CD2 3.63Å; H186-Y208 HydrophobicContact CB-CE2 3.91Å; H186-Y208 HydrophobicContact CB-CG 4.33Å; H186-Y208 AromaticContact CD2-CD2 3.72Å; H186-Y208 AromaticContact CD2-CE2 3.97Å; H186-Y208 AromaticContact CG-CD2 3.58Å; M190-Y208 HydrophobicContact CE-CD1 3.77Å; M190-Y208 HydrophobicContact CE-CD2 4.35Å; M190-Y208 HydrophobicContact CE-CG 3.57Å; N204-Y208 WeakPolarHBondContact O-CB 3.26Å; N204-Y208 PolarHBondContact O-N 2.95Å; L205-Y208 PolarHBondContact O-N 2.66Å; T206-Y208 PolarHBondContact O-N 2.95Å; Y208-L211 PolarHBondContact O-N 3.03Å; Y208-T212 HydrophobicContact CD2-CG2 3.84Å; Y208-T212 HydrophobicContact CE1-CG2 4.25Å; Y208-T212 HydrophobicContact CE2-CG2 3.3Å; Y208-T212 HydrophobicContact CG-CG2 4.49Å; Y208-T212 WeakPolarHBondContact O-CB 3.5Å; Y208-T212 WeakPolarHBondContact O-CG2 3.43Å; Y208-T212 PolarHBondContact O-N 3.4Å; Y208-T212 PolarHBondContact O-OG1 3.06Å
209I98.3Very high96.9Very high40 Ų4016.9 Ų16.921%0.2059%0.092CC..Hα-helixtrans-63.4-42.6175.4-69.6170.9000110.6T132 L136 L205 T206 I207 L211 T212 T213T132-I209 HydrophobicContact CG2-CG1 4.32Å; T132-I209 HydrophobicContact CG2-CG2 4.28Å; L136-I209 HydrophobicContact CD2-CD1 3.83Å; L205-I209 HydrophobicContact CD2-CD1 3.57Å; L205-I209 HydrophobicContact CG-CD1 3.98Å; L205-I209 VanDerWaalsContact O-CG1 3.3Å; L205-I209 WeakPolarHBondContact O-CG1 3.27Å; L205-I209 PolarHBondContact O-N 3.27Å; T206-I209 PolarHBondContact O-N 3.4Å; I207-I209 VanDerWaalsContact C-N 3.34Å; I207-I209 PolarHBondContact O-N 2.98Å; I209-L211 PolarHBondContact O-N 3.16Å; I209-T212 PolarHBondContact O-OG1 2.81Å; I209-T213 HydrophobicContact CG2-CG2 4.16Å; I209-T213 WeakPolarHBondContact O-CB 3.44Å; I209-T213 WeakPolarHBondContact O-CG2 3.25Å; I209-T213 PolarHBondContact O-N 3.45Å; I209-T213 PolarHBondContact O-OG1 3.25Å
210I97.9Very high96.7Very high34 Ų3416.1 Ų16.117%0.1749%0.088CC..Hα-helixtrans-61.4-45.5175.9-64.9167.1000110.7T206 I207 T213 T214 L329 L332 T333T206-I210 WeakPolarHBondContact O-CG1 3.16Å; T206-I210 PolarHBondContact O-N 3.39Å; T206-I210 VanDerWaalsContact O-N 3.11Å; I207-I210 WeakPolarHBondContact O-CB 3.38Å; I207-I210 PolarHBondContact O-N 2.83Å; I207-I210 VanDerWaalsContact O-N 3.15Å; I210-T213 PolarHBondContact O-OG1 3.29Å; I210-T214 WeakPolarHBondContact O-CG2 3.14Å; I210-T214 PolarHBondContact O-N 3.45Å; I210-T214 PolarHBondContact O-OG1 3.21Å; I210-L329 HydrophobicContact CG2-CD2 4.15Å; I210-L332 HydrophobicContact CG2-CB 4.01Å; I210-T333 HydrophobicContact CG2-CG2 4.09Å
211L97.7Very high96.4Very high2 Ų215.4 Ų15.41%0.018%0.084CC..Hα-helixtrans-66.8-41.6-178.8-67-179.4000112.8I207 Y208 I209 T214 A215 S250 L251 T333I207-L211 HydrophobicContact CG2-CD1 3.94Å; I207-L211 HydrophobicContact CG2-CG 4.21Å; I207-L211 VanDerWaalsContact O-CG 3.29Å; I207-L211 WeakPolarHBondContact O-CG 3.48Å; I207-L211 PolarHBondContact O-N 3.3Å; Y208-L211 PolarHBondContact O-N 3.03Å; I209-L211 PolarHBondContact O-N 3.16Å; L211-T214 PolarHBondContact O-OG1 2.93Å; L211-A215 PolarHBondContact O-N 3.41Å; L211-A215 VanDerWaalsContact O-N 3.15Å; L211-S250 WeakPolarHBondContact CD2-OG 3.38Å; L211-L251 HydrophobicContact CB-CD2 3.52Å; L211-L251 HydrophobicContact CB-CG 3.95Å; L211-L251 HydrophobicContact CD1-CD2 3.87Å; L211-L251 HydrophobicContact CD1-CG 4.23Å; L211-L251 HydrophobicContact CG-CD2 4.33Å; L211-T333 HydrophobicContact CD2-CG2 3.68Å
212T97.4Very high96Very high1 Ų116.4 Ų16.41%0.0069%0.089CC..Hα-helixtrans-75.3-37.9-179.349.70000112.7T132 Y208 I209 T214 A215 F216 L251T132-T212 WeakPolarHBondContact CG2-OG1 3.01Å; Y208-T212 HydrophobicContact CD2-CG2 3.84Å; Y208-T212 HydrophobicContact CE1-CG2 4.25Å; Y208-T212 HydrophobicContact CE2-CG2 3.3Å; Y208-T212 HydrophobicContact CG-CG2 4.49Å; Y208-T212 WeakPolarHBondContact O-CB 3.5Å; Y208-T212 WeakPolarHBondContact O-CG2 3.43Å; Y208-T212 PolarHBondContact O-N 3.4Å; Y208-T212 PolarHBondContact O-OG1 3.06Å; I209-T212 PolarHBondContact O-OG1 2.81Å; T212-T214 PolarHBondContact O-N 3.19Å; T212-A215 PolarHBondContact O-N 3.31Å; T212-F216 VanDerWaalsContact O-CD2 3.28Å; T212-F216 WeakPolarHBondContact O-CD2 3.09Å; T212-F216 PolarHBondContact O-N 3.39Å; T212-L251 HydrophobicContact CG2-CD2 4.46Å
213T97.3Very high95.5Very high22 Ų2218 Ų1814%0.13510%0.104CC..Hα-helixtrans-59.5-45173.951.90000111.5L128 T132 I209 I210 F216 L217L128-T213 HydrophobicContact CD1-CG2 3.79Å; T132-T213 HydrophobicContact CG2-CG2 4.32Å; I209-T213 HydrophobicContact CG2-CG2 4.16Å; I209-T213 WeakPolarHBondContact O-CB 3.44Å; I209-T213 WeakPolarHBondContact O-CG2 3.25Å; I209-T213 PolarHBondContact O-N 3.45Å; I209-T213 PolarHBondContact O-OG1 3.25Å; I210-T213 PolarHBondContact O-OG1 3.29Å; T213-F216 PolarHBondContact O-N 3.21Å; T213-L217 WeakPolarHBondContact O-CB 3.41Å; T213-L217 VanDerWaalsContact O-CG 3.23Å; T213-L217 WeakPolarHBondContact O-CG 3.38Å; T213-L217 PolarHBondContact O-N 2.73Å
214T97Very high95Very high0 Ų017.9 Ų17.90%010%0.104CC..Hα-helixtrans-61.7-46.6174.851.20000112.4I210 L211 T212 F216 L217 L218 L329 I330 T333I210-T214 WeakPolarHBondContact O-CG2 3.14Å; I210-T214 PolarHBondContact O-N 3.45Å; I210-T214 PolarHBondContact O-OG1 3.21Å; L211-T214 PolarHBondContact O-OG1 2.93Å; T212-T214 PolarHBondContact O-N 3.19Å; T214-F216 PolarHBondContact O-N 2.97Å; T214-L217 PolarHBondContact O-N 2.63Å; T214-L218 WeakPolarHBondContact O-CB 3.37Å; T214-L218 VanDerWaalsContact O-CG 3.31Å; T214-L218 WeakPolarHBondContact O-CG 3.48Å; T214-L218 PolarHBondContact O-N 3.34Å; T214-L329 HydrophobicContact CG2-CB 3.29Å; T214-L329 HydrophobicContact CG2-CD1 4.4Å; T214-L329 HydrophobicContact CG2-CG 4.41Å; T214-I330 HydrophobicContact CG2-CG1 4.44Å; T214-T333 HydrophobicContact CG2-CG2 3.65Å; T214-T333 WeakPolarHBondContact OG1-CG2 3.45Å
215A95.9Very high94.8Very high6 Ų619.4 Ų19.45%0.0511%0.113CC..Hα-helixtrans-57-49.6178.300000111.8L179 L211 T212 L217 L218 L219L179-A215 HydrophobicContact CD1-CB 4.34Å; L179-A215 HydrophobicContact CD2-CB 4.05Å; L211-A215 PolarHBondContact O-N 3.41Å; L211-A215 VanDerWaalsContact O-N 3.15Å; T212-A215 PolarHBondContact O-N 3.31Å; A215-L217 PolarHBondContact O-N 3.12Å; A215-L218 PolarHBondContact O-N 2.58Å; A215-L219 VanDerWaalsContact O-CG 3.26Å; A215-L219 WeakPolarHBondContact O-CG 3.47Å; A215-L219 PolarHBondContact O-N 2.82Å
216F95.9Very high94.6Very high0 Ų020.1 Ų20.10%012%0.118CC..Hα-helixtrans-65.9-37178.6-83.7-73.4000113.5L124 L128 L131 L179 T212 T213 T214 L219 N220L124-F216 HydrophobicContact CB-CD1 4.36Å; L124-F216 HydrophobicContact CD2-CD1 3.94Å; L124-F216 HydrophobicContact CD2-CE1 4.06Å; L128-F216 HydrophobicContact CB-CB 4.14Å; L128-F216 HydrophobicContact CB-CD1 4.47Å; L128-F216 HydrophobicContact CB-CD2 4.06Å; L128-F216 HydrophobicContact CB-CG 3.98Å; L128-F216 HydrophobicContact CD1-CB 4.03Å; L128-F216 HydrophobicContact CD1-CD2 3.68Å; L128-F216 HydrophobicContact CD1-CG 4.13Å; L128-F216 HydrophobicContact CD2-CB 4.44Å; L128-F216 HydrophobicContact CG-CB 4.43Å; L128-F216 HydrophobicContact CG-CD2 4.49Å; L131-F216 HydrophobicContact CB-CE2 4.43Å; L131-F216 HydrophobicContact CD1-CE2 3.85Å; L131-F216 HydrophobicContact CD1-CZ 3.8Å; L179-F216 HydrophobicContact CB-CZ 4.36Å; L179-F216 HydrophobicContact CD1-CD1 4.36Å; L179-F216 HydrophobicContact CD1-CD2 4.31Å; L179-F216 HydrophobicContact CD1-CE1 4.06Å; L179-F216 HydrophobicContact CD1-CE2 4Å; L179-F216 HydrophobicContact CD1-CG 4.48Å; L179-F216 HydrophobicContact CD1-CZ 3.86Å; T212-F216 VanDerWaalsContact O-CD2 3.28Å; T212-F216 WeakPolarHBondContact O-CD2 3.09Å; T212-F216 PolarHBondContact O-N 3.39Å; T213-F216 PolarHBondContact O-N 3.21Å; T214-F216 PolarHBondContact O-N 2.97Å; F216-L219 PolarHBondContact O-N 3.13Å; F216-N220 WeakPolarHBondContact O-CB 2.93Å; F216-N220 PolarHBondContact O-N 3.41Å; F216-N220 PolarHBondContact O-ND2 3.01Å
217L95.2Very high94.5Very high28 Ų2818.8 Ų18.815%0.14711%0.11CC..Hα-helixtrans-69.4-38.7177.4-69.4172.4000111.6T213 T214 A215 N220 L221 T323 L326 L329T213-L217 WeakPolarHBondContact O-CB 3.41Å; T213-L217 VanDerWaalsContact O-CG 3.23Å; T213-L217 WeakPolarHBondContact O-CG 3.38Å; T213-L217 PolarHBondContact O-N 2.73Å; T214-L217 PolarHBondContact O-N 2.63Å; A215-L217 PolarHBondContact O-N 3.12Å; L217-N220 WeakPolarHBondContact O-CB 3.48Å; L217-N220 PolarHBondContact O-N 3.23Å; L217-N220 VanDerWaalsContact O-N 3.16Å; L217-L221 PolarHBondContact O-N 3.38Å; L217-T323 HydrophobicContact CD2-CG2 4.5Å; L217-L326 HydrophobicContact CB-CD1 3.56Å; L217-L326 HydrophobicContact CD1-CB 4.38Å; L217-L329 HydrophobicContact CD1-CD1 4.06Å
218L94.4Very high94.3Very high3 Ų324.6 Ų24.62%0.01614%0.14CC..Hα-helixtrans-63.2-40172-71.6169.7000111.9T214 A215 N220 L221 N222 L243 I244 T247 L326 I330T214-L218 WeakPolarHBondContact O-CB 3.37Å; T214-L218 VanDerWaalsContact O-CG 3.31Å; T214-L218 WeakPolarHBondContact O-CG 3.48Å; T214-L218 PolarHBondContact O-N 3.34Å; A215-L218 PolarHBondContact O-N 2.58Å; L218-N220 VanDerWaalsContact C-N 3.33Å; L218-L221 HydrophobicContact CD2-CD1 4.37Å; L218-L221 PolarHBondContact O-N 2.9Å; L218-N222 PolarHBondContact O-N 2.91Å; L218-N222 PolarHBondContact O-ND2 3.33Å; L218-L243 HydrophobicContact CD1-CB 4.22Å; L218-L243 HydrophobicContact CD2-CB 4.06Å; L218-L243 HydrophobicContact CD2-CD1 4.25Å; L218-I244 HydrophobicContact CB-CG1 3.9Å; L218-I244 HydrophobicContact CD1-CG1 4Å; L218-I244 HydrophobicContact CG-CG1 4.37Å; L218-T247 HydrophobicContact CD1-CG2 3.94Å; L218-L326 HydrophobicContact CD2-CD1 4.16Å; L218-L326 HydrophobicContact CG-CD1 4.29Å; L218-I330 HydrophobicContact CD2-CD1 4.49Å
219L93.1Very high94Very high10 Ų1027.1 Ų27.15%0.05215%0.154CC..Hα-helixtrans-63-39.8171.8-68.8177.8000111.8L124 L175 L179 A215 F216 N222 S223 S224 L230L124-L219 HydrophobicContact CD1-CB 4.17Å; L124-L219 HydrophobicContact CD2-CB 4.43Å; L124-L219 HydrophobicContact CD2-CD1 4.3Å; L175-L219 HydrophobicContact CB-CD1 4.23Å; L175-L219 HydrophobicContact CB-CD2 4.23Å; L175-L219 HydrophobicContact CD1-CD2 3.39Å; L175-L219 HydrophobicContact CG-CD2 4.34Å; L179-L219 HydrophobicContact CD1-CD1 3.58Å; A215-L219 VanDerWaalsContact O-CG 3.26Å; A215-L219 WeakPolarHBondContact O-CG 3.47Å; A215-L219 PolarHBondContact O-N 2.82Å; F216-L219 PolarHBondContact O-N 3.13Å; L219-N222 PolarHBondContact O-N 2.98Å; L219-S223 WeakPolarHBondContact O-CA 3.49Å; L219-S223 PolarHBondContact O-N 3.44Å; L219-S224 PolarHBondContact O-N 2.95Å; L219-L230 HydrophobicContact CD2-CD1 4.05Å
220N92.4Very high93.7Very high38 Ų3825.3 Ų25.320%0.20315%0.145CC..Hα-helixtrans-63.3-43.8175.2-80.6-30.2000111.5L124 F216 L217 L218 N222 S223 K321L124-N220 WeakPolarHBondContact CB-OD1 3.31Å; L124-N220 WeakPolarHBondContact CD1-OD1 3.18Å; F216-N220 WeakPolarHBondContact O-CB 2.93Å; F216-N220 PolarHBondContact O-N 3.41Å; F216-N220 PolarHBondContact O-ND2 3.01Å; L217-N220 WeakPolarHBondContact O-CB 3.48Å; L217-N220 PolarHBondContact O-N 3.23Å; L217-N220 VanDerWaalsContact O-N 3.16Å; L218-N220 VanDerWaalsContact C-N 3.33Å; N220-N222 VanDerWaalsContact C-N 3.32Å; N220-N222 PolarHBondContact O-N 3.45Å; N220-S223 PolarHBondContact O-N 3.31Å; N220-S223 VanDerWaalsContact O-N 3.14Å; N220-K321 WeakPolarHBondContact O-CD 3.49Å; N220-K321 WeakPolarHBondContact O-CE 3.16Å; N220-K321 PolarHBondContact O-NZ 2.92Å
221L91.1Very high93.5Very high14 Ų1424.1 Ų24.17%0.07314%0.139CC..Hα-helixtrans-54.5-48.8175.6-74.7176.6000111.4L217 L218 S223 L240 H319 K321 T323 L326L217-L221 PolarHBondContact O-N 3.38Å; L218-L221 HydrophobicContact CD2-CD1 4.37Å; L218-L221 PolarHBondContact O-N 2.9Å; L221-S223 PolarHBondContact O-N 3.1Å; L221-L240 HydrophobicContact CD1-CD1 4.38Å; L221-H319 PolarHBondContact O-CE1 3.16Å; L221-H319 PolarHBondContact O-ND1 3.36Å; L221-K321 HydrophobicContact CD2-CB 4.31Å; L221-K321 PolarHBondContact O-NZ 3.2Å; L221-T323 HydrophobicContact CD1-CG2 4.43Å; L221-T323 HydrophobicContact CD2-CG2 3.45Å; L221-T323 VanDerWaalsContact CD2-CG2 3.45Å; L221-T323 HydrophobicContact CG-CG2 3.75Å; L221-L326 HydrophobicContact CD1-CD1 3.64Å; L221-L326 HydrophobicContact CD1-CD2 4.12Å; L221-L326 HydrophobicContact CG-CD1 4.35Å
222N87.8Confident93.2Very high23 Ų2328.3 Ų28.312%0.12316%0.155CC..Hα-helixtrans-77.5-18.4179.8-71.3-42.4000114.2L218 L219 N220 S224 T233 L237 I244L218-N222 PolarHBondContact O-N 2.91Å; L218-N222 PolarHBondContact O-ND2 3.33Å; L219-N222 PolarHBondContact O-N 2.98Å; N220-N222 VanDerWaalsContact C-N 3.32Å; N220-N222 PolarHBondContact O-N 3.45Å; N222-S224 VanDerWaalsContact CB-OG 3.29Å; N222-S224 WeakPolarHBondContact CB-OG 3.27Å; N222-S224 PolarHBondContact O-N 2.77Å; N222-T233 WeakPolarHBondContact ND2-CG2 3.31Å; N222-L237 VanDerWaalsContact OD1-CD1 3.24Å; N222-L237 WeakPolarHBondContact OD1-CD1 3.38Å; N222-I244 WeakPolarHBondContact ND2-CD1 3.41Å
223S88.1Confident92.8Very high73 Ų7328.4 Ų28.451%0.5116%0.156SC..THydrogen-bonded Turntrans49.233.8-168.5400000112.6L219 N220 L221 K321L219-S223 WeakPolarHBondContact O-CA 3.49Å; L219-S223 PolarHBondContact O-N 3.44Å; N220-S223 PolarHBondContact O-N 3.31Å; N220-S223 VanDerWaalsContact O-N 3.14Å; L221-S223 PolarHBondContact O-N 3.1Å; S223-K321 PolarHBondContact OG-NZ 3.05Å
224S86.7Confident92.4Very high2 Ų232.6 Ų32.61%0.01417%0.169CC..  trans-104.5136.8178.852.80000109.3L219 N222 L229 L230L219-S224 PolarHBondContact O-N 2.95Å; N222-S224 VanDerWaalsContact CB-OG 3.29Å; N222-S224 WeakPolarHBondContact CB-OG 3.27Å; N222-S224 PolarHBondContact O-N 2.77Å; S224-L229 VanDerWaalsContact CB-C 3.46Å; S224-L229 WeakPolarHBondContact CB-O 3.36Å; S224-L230 WeakPolarHBondContact OG-CD1 3.42Å
225T92.4Very high92Very high36 Ų3634.2 Ų34.222%0.22118%0.178CC..  trans-124-6.4-178.1640000112.8L124 L175L124-T225 HydrophobicContact CD1-CG2 4.42Å; L175-T225 WeakPolarHBondContact CB-O 3.27Å; L175-T225 PolarHBondContact N-O 3.15Å
226T95.4Very high91.5Very high29 Ų2936.7 Ų36.718%0.17819%0.187CC..BIsolated β-bridgetrans-126.6156.2178.462.70000109.6L228 L229 L230T226-L228 VanDerWaalsContact C-N 3.31Å; T226-L228 PolarHBondContact O-N 2.92Å; T226-L229 PolarHBondContact O-N 3.16Å; T226-L229 VanDerWaalsContact O-N 3.08Å; T226-L229 VanDerWaalsContact OG1-CG 3.3Å; T226-L229 WeakPolarHBondContact OG1-CG 3.36Å; T226-L229 PolarHBondContact OG1-N 3.48Å; T226-L230 PolarHBondContact O-N 3.23Å
227T93.9Very high91.1Very high26 Ų2637.9 Ų37.916%0.1619%0.193CC..Hα-helixtrans-54.6-43.917750.60000112.8T173 L175 L229 L230 S231 L296T173-T227 WeakPolarHBondContact O-CG2 2.93Å; T173-T227 PolarHBondContact O-N 2.68Å; L175-T227 HydrophobicContact CD2-CG2 4.18Å; T227-L229 VanDerWaalsContact C-N 3.31Å; T227-L229 PolarHBondContact O-N 2.95Å; T227-L230 WeakPolarHBondContact O-CA 3.3Å; T227-L230 VanDerWaalsContact O-CB 3.3Å; T227-L230 WeakPolarHBondContact O-CB 3.41Å; T227-L230 PolarHBondContact O-N 3.32Å; T227-S231 PolarHBondContact O-N 2.94Å; T227-L296 HydrophobicContact CG2-CG 4.39Å
228L93.6Very high90.8Very high126 Ų12638.9 Ų38.966%0.6620%0.201SC*.Hα-helixtrans-64.2-31.2176.6-71171.9000113.8T226 L230 S231T226-L228 VanDerWaalsContact C-N 3.31Å; T226-L228 PolarHBondContact O-N 2.92Å; L228-L230 VanDerWaalsContact C-N 3.35Å; L228-S231 PolarHBondContact O-OG 3.34Å
229L92.4Very high90.6Very high56 Ų5649.6 Ų49.629%0.29324%0.241SC..Hα-helixtrans-77.7-27.8173.3-71174.7000111.4S224 T226 T227 R232S224-L229 VanDerWaalsContact CB-C 3.46Å; S224-L229 WeakPolarHBondContact CB-O 3.36Å; T226-L229 PolarHBondContact O-N 3.16Å; T226-L229 VanDerWaalsContact O-N 3.08Å; T226-L229 VanDerWaalsContact OG1-CG 3.3Å; T226-L229 WeakPolarHBondContact OG1-CG 3.36Å; T226-L229 PolarHBondContact OG1-N 3.48Å; T227-L229 VanDerWaalsContact C-N 3.31Å; T227-L229 PolarHBondContact O-N 2.95Å; L229-R232 VanDerWaalsContact CD2-CZ 3.46Å; L229-R232 VanDerWaalsContact CD2-NH1 3.34Å; L229-R232 WeakPolarHBondContact O-CB 3.27Å
230L92.9Very high90.5Very high2 Ų251.6 Ų51.61%0.0125%0.252CS..Hα-helixtrans-71.8-30.6177.8-164.664.1000112.1L175 L219 S224 T226 T227 L228 R232 T233 I244 L296 T300L175-L230 HydrophobicContact CD1-CB 4.03Å; L175-L230 HydrophobicContact CD1-CD1 4.18Å; L175-L230 HydrophobicContact CD1-CD2 3.98Å; L175-L230 HydrophobicContact CD1-CG 4.31Å; L175-L230 HydrophobicContact CD2-CD2 3.77Å; L219-L230 HydrophobicContact CD2-CD1 4.05Å; S224-L230 WeakPolarHBondContact OG-CD1 3.42Å; T226-L230 PolarHBondContact O-N 3.23Å; T227-L230 WeakPolarHBondContact O-CA 3.3Å; T227-L230 VanDerWaalsContact O-CB 3.3Å; T227-L230 WeakPolarHBondContact O-CB 3.41Å; T227-L230 PolarHBondContact O-N 3.32Å; L228-L230 VanDerWaalsContact C-N 3.35Å; L230-R232 PolarHBondContact O-N 3.05Å; L230-T233 HydrophobicContact CD1-CG2 4.31Å; L230-T233 WeakPolarHBondContact O-CG2 3.41Å; L230-T233 PolarHBondContact O-N 3.4Å; L230-T233 VanDerWaalsContact O-N 3.13Å; L230-T233 PolarHBondContact O-OG1 3.27Å; L230-T233 VanDerWaalsContact O-OG1 3.11Å; L230-I244 HydrophobicContact CD1-CD1 3.61Å; L230-I244 HydrophobicContact CD1-CG2 4.41Å; L230-I244 HydrophobicContact CD2-CG2 4.07Å; L230-I244 HydrophobicContact CG-CD1 4.47Å; L230-L296 HydrophobicContact CD2-CD2 3.53Å; L230-L296 HydrophobicContact CD2-CG 4.31Å; L230-T300 HydrophobicContact CB-CG2 3.89Å; L230-T300 HydrophobicContact CD2-CG2 3.59Å; L230-T300 HydrophobicContact CG-CG2 3.54Å
231S93.3Very high90.4Very high9 Ų951.4 Ų51.46%0.06325%0.252CS..THydrogen-bonded Turntrans-60-18.4176.671.10000113.8T227 L228 T233 S299 M307T227-S231 PolarHBondContact O-N 2.94Å; L228-S231 PolarHBondContact O-OG 3.34Å; S231-T233 PolarHBondContact O-N 3.22Å; S231-T233 VanDerWaalsContact O-N 3.14Å; S231-S299 WeakPolarHBondContact CB-O 3.26Å; S231-M307 VanDerWaalsContact C-CE 3.46Å; S231-M307 WeakPolarHBondContact O-CE 3.4Å
232R90.2Very high90.6Very high90 Ų9054.3 Ų54.334%0.3427%0.272SS..THydrogen-bonded Turntrans-66.4-8.3176-61.5-179.2175.9174.5-2.7114.3L229 L230 W234 N235 K236 M307L229-R232 VanDerWaalsContact CD2-CZ 3.46Å; L229-R232 VanDerWaalsContact CD2-NH1 3.34Å; L229-R232 WeakPolarHBondContact O-CB 3.27Å; L230-R232 PolarHBondContact O-N 3.05Å; R232-W234 VanDerWaalsContact C-N 3.35Å; R232-W234 PolarHBondContact O-N 3.08Å; R232-N235 PolarHBondContact O-N 3.33Å; R232-N235 VanDerWaalsContact O-N 3.17Å; R232-K236 PolarHBondContact O-N 2.9Å; R232-M307 HydrophobicContact CB-SD 4.24Å; R232-M307 HydrophobicContact CG-CE 4.41Å; R232-M307 HydrophobicContact CG-SD 3.82Å
233T90.3Very high90.9Very high4 Ų454.7 Ų54.73%0.02527%0.274CS..Hα-helixtrans-55-48.1-179.545.50000112.1N222 L230 S231 N235 K236 L237 I244N222-T233 WeakPolarHBondContact ND2-CG2 3.31Å; L230-T233 HydrophobicContact CD1-CG2 4.31Å; L230-T233 WeakPolarHBondContact O-CG2 3.41Å; L230-T233 PolarHBondContact O-N 3.4Å; L230-T233 VanDerWaalsContact O-N 3.13Å; L230-T233 PolarHBondContact O-OG1 3.27Å; L230-T233 VanDerWaalsContact O-OG1 3.11Å; S231-T233 PolarHBondContact O-N 3.22Å; S231-T233 VanDerWaalsContact O-N 3.14Å; T233-N235 VanDerWaalsContact C-N 3.29Å; T233-N235 PolarHBondContact O-N 3.49Å; T233-K236 PolarHBondContact O-N 3.21Å; T233-L237 CarbonylContact O-C 3.05Å; T233-L237 WeakPolarHBondContact O-CA 3.25Å; T233-L237 PolarHBondContact O-N 3.14Å; T233-L237 VanDerWaalsContact O-O 3.12Å; T233-I244 HydrophobicContact CG2-CD1 3.51Å
234W89.6Confident91Very high110 Ų11051.8 Ų51.842%0.41725%0.252SS..Hα-helixtrans-54.5-45177.1139.4-114.2000111.6R232 T238 T241 L304R232-W234 VanDerWaalsContact C-N 3.35Å; R232-W234 PolarHBondContact O-N 3.08Å; W234-T238 HydrophobicContact CE3-CG2 3.75Å; W234-T238 HydrophobicContact CZ3-CG2 3.62Å; W234-T238 WeakPolarHBondContact O-CA 3.37Å; W234-T238 WeakPolarHBondContact O-CG2 3.42Å; W234-T241 VanDerWaalsContact CA-CG2 3.48Å; W234-T241 HydrophobicContact CB-CG2 4.03Å; W234-L304 HydrophobicContact CB-CD2 4.34Å; W234-L304 VanDerWaalsContact CD1-CD2 3.44Å; W234-L304 HydrophobicContact CD2-CD2 3.99Å; W234-L304 HydrophobicContact CG-CD2 3.65Å
235N87.9Confident91.3Very high33 Ų3352.1 Ų52.118%0.17626%0.255CS..Hα-helixtrans-77.5-37.9-176.6-85.6-22.7000114.4R232 T233 M307 V311 W315R232-N235 PolarHBondContact O-N 3.33Å; R232-N235 VanDerWaalsContact O-N 3.17Å; T233-N235 VanDerWaalsContact C-N 3.29Å; T233-N235 PolarHBondContact O-N 3.49Å; N235-M307 HydrophobicContact CB-SD 4.16Å; N235-M307 PolarHBondContact ND2-SD 3.18Å; N235-V311 HydrophobicContact CB-CG1 3.75Å; N235-W315 VanDerWaalsContact O-CD1 3.3Å; N235-W315 PolarHBondContact O-NE1 3.03Å
236K85.3Confident91.4Very high59 Ų5951.7 Ų51.726%0.25725%0.253SS..Hα-helixtrans-89.5-37.7-174.3-162.8-175.6-173.6-148.40112.8R232 T233 H319R232-K236 PolarHBondContact O-N 2.9Å; T233-K236 PolarHBondContact O-N 3.21Å; K236-H319 WeakPolarHBondContact CD-NE2 3.42Å; K236-H319 WeakPolarHBondContact CE-NE2 3.3Å; K236-H319 PolarHBondContact NZ-CE1 3.44Å; K236-H319 PolarHBondContact NZ-NE2 2.96Å
237L87.9Confident91.4Very high24 Ų2450.4 Ų50.413%0.12625%0.245CC..  trans-140.163.4-170.7-73.5167.7000108.6N222 T233 W239 L240 T241 H319N222-L237 VanDerWaalsContact OD1-CD1 3.24Å; N222-L237 WeakPolarHBondContact OD1-CD1 3.38Å; T233-L237 CarbonylContact O-C 3.05Å; T233-L237 WeakPolarHBondContact O-CA 3.25Å; T233-L237 PolarHBondContact O-N 3.14Å; T233-L237 VanDerWaalsContact O-O 3.12Å; L237-W239 PolarHBondContact O-N 3.13Å; L237-L240 HydrophobicContact CB-CB 4.07Å; L237-L240 HydrophobicContact CB-CD1 4.1Å; L237-L240 HydrophobicContact CB-CG 4.2Å; L237-L240 HydrophobicContact CD1-CD1 3.78Å; L237-L240 HydrophobicContact CD2-CD1 3.85Å; L237-L240 HydrophobicContact CD2-CG 4.44Å; L237-L240 HydrophobicContact CG-CD1 4.11Å; L237-L240 PolarHBondContact O-N 2.95Å; L237-T241 PolarHBondContact O-N 3.16Å; L237-H319 WeakPolarHBondContact CD1-CE1 3.32Å; L237-H319 VanDerWaalsContact CD1-NE2 3.27Å; L237-H319 WeakPolarHBondContact CD1-NE2 3.48Å; L237-H319 VanDerWaalsContact CG-NE2 3.34Å; L237-H319 WeakPolarHBondContact CG-NE2 3.47Å
238T89.2Confident91.4Very high49 Ų4949.7 Ų49.730%0.30124%0.24SC..G310 helixtrans-46.4-47.7-179.652.20000111.7W234 L240 T241W234-T238 HydrophobicContact CE3-CG2 3.75Å; W234-T238 HydrophobicContact CZ3-CG2 3.62Å; W234-T238 WeakPolarHBondContact O-CA 3.37Å; W234-T238 WeakPolarHBondContact O-CG2 3.42Å; T238-L240 VanDerWaalsContact C-N 3.28Å; T238-L240 PolarHBondContact O-N 3.23Å; T238-T241 WeakPolarHBondContact O-CB 3.48Å; T238-T241 WeakPolarHBondContact O-CG2 3.47Å; T238-T241 PolarHBondContact O-N 3.39Å; T238-T241 PolarHBondContact O-OG1 3.11Å
239W90.3Very high91.5Very high228 Ų22845.5 Ų45.586%0.86422%0.218SC*.G310 helixtrans-66.8-22.9-178.8-60.1-73000114.4L237L237-W239 PolarHBondContact O-N 3.13Å
240L90.9Very high91.8Very high52 Ų5242.8 Ų42.827%0.27220%0.204SC..G310 helixtrans-94.83.6-179.8-54.8-177.9000112.8L221 L237 T238 P242 L243L221-L240 HydrophobicContact CD1-CD1 4.38Å; L237-L240 HydrophobicContact CB-CB 4.07Å; L237-L240 HydrophobicContact CB-CD1 4.1Å; L237-L240 HydrophobicContact CB-CG 4.2Å; L237-L240 HydrophobicContact CD1-CD1 3.78Å; L237-L240 HydrophobicContact CD2-CD1 3.85Å; L237-L240 HydrophobicContact CD2-CG 4.44Å; L237-L240 HydrophobicContact CG-CD1 4.11Å; L237-L240 PolarHBondContact O-N 2.95Å; T238-L240 VanDerWaalsContact C-N 3.28Å; T238-L240 PolarHBondContact O-N 3.23Å; L240-P242 VanDerWaalsContact C-CD 3.46Å; L240-L243 HydrophobicContact CB-CD1 3.94Å; L240-L243 HydrophobicContact CD2-CD1 3.35Å; L240-L243 HydrophobicContact CG-CD1 4.17Å; L240-L243 WeakPolarHBondContact O-CB 3.21Å; L240-L243 PolarHBondContact O-N 3.01Å
241T89.8Confident91.9Very high35 Ų3542.9 Ų42.922%0.21520%0.204CC..THydrogen-bonded Turntrans-53.5-41.2178.350.50000115.1W234 L237 T238 L243 P245W234-T241 VanDerWaalsContact CA-CG2 3.48Å; W234-T241 HydrophobicContact CB-CG2 4.03Å; L237-T241 PolarHBondContact O-N 3.16Å; T238-T241 WeakPolarHBondContact O-CB 3.48Å; T238-T241 WeakPolarHBondContact O-CG2 3.47Å; T238-T241 PolarHBondContact O-N 3.39Å; T238-T241 PolarHBondContact O-OG1 3.11Å; T241-L243 VanDerWaalsContact C-N 3.32Å; T241-L243 PolarHBondContact O-N 3.31Å; T241-P245 WeakPolarHBondContact O-CD 3.3Å
242P93.9Very high91.9Very high75 Ų7542.7 Ų42.749%0.48720%0.204SC..THydrogen-bonded Turntrans-75.1-20.1-179.429-35.7000113.6L240 P245 S246L240-P242 VanDerWaalsContact C-CD 3.46Å; P242-P245 WeakPolarHBondContact O-CD 3.26Å; P242-S246 WeakPolarHBondContact O-CB 3.44Å; P242-S246 PolarHBondContact O-N 3.42Å; P242-S246 PolarHBondContact O-OG 3.44Å
243L94.3Very high92.1Very high31 Ų3138.9 Ų38.916%0.16219%0.193CC..Hα-helixtrans-67.2-48.2-169.3-63.5178.1000112.6L218 L240 T241 S246 T247 I330L218-L243 HydrophobicContact CD1-CB 4.22Å; L218-L243 HydrophobicContact CD2-CB 4.06Å; L218-L243 HydrophobicContact CD2-CD1 4.25Å; L240-L243 HydrophobicContact CB-CD1 3.94Å; L240-L243 HydrophobicContact CD2-CD1 3.35Å; L240-L243 HydrophobicContact CG-CD1 4.17Å; L240-L243 WeakPolarHBondContact O-CB 3.21Å; L240-L243 PolarHBondContact O-N 3.01Å; T241-L243 VanDerWaalsContact C-N 3.32Å; T241-L243 PolarHBondContact O-N 3.31Å; L243-S246 PolarHBondContact O-N 3.2Å; L243-S246 PolarHBondContact O-OG 2.89Å; L243-T247 WeakPolarHBondContact O-CG2 3.16Å; L243-T247 PolarHBondContact O-N 3.36Å; L243-T247 VanDerWaalsContact O-N 3.11Å; L243-T247 PolarHBondContact O-OG1 3.24Å; L243-I330 HydrophobicContact CD1-CD1 3.84Å; L243-I330 HydrophobicContact CD2-CD1 4.16Å; L243-I330 HydrophobicContact CD2-CG2 3.67Å; L243-I330 HydrophobicContact CG-CD1 4.5Å
244I91.8Very high92.3Very high11 Ų1141.2 Ų41.26%0.05621%0.205CC..Hα-helixtrans-61.7-52.4-179.8-66.9159.6000111.6L218 N222 L230 T233 S246 T247 L248L218-I244 HydrophobicContact CB-CG1 3.9Å; L218-I244 HydrophobicContact CD1-CG1 4Å; L218-I244 HydrophobicContact CG-CG1 4.37Å; N222-I244 WeakPolarHBondContact ND2-CD1 3.41Å; L230-I244 HydrophobicContact CD1-CD1 3.61Å; L230-I244 HydrophobicContact CD1-CG2 4.41Å; L230-I244 HydrophobicContact CD2-CG2 4.07Å; L230-I244 HydrophobicContact CG-CD1 4.47Å; T233-I244 HydrophobicContact CG2-CD1 3.51Å; I244-S246 VanDerWaalsContact C-N 3.34Å; I244-S246 PolarHBondContact O-N 3.5Å; I244-T247 PolarHBondContact O-N 3.46Å; I244-T247 PolarHBondContact O-OG1 2.82Å; I244-L248 HydrophobicContact CG2-CD1 4.01Å; I244-L248 WeakPolarHBondContact O-CG 3.38Å; I244-L248 PolarHBondContact O-N 2.67Å; I244-L248 VanDerWaalsContact O-N 3.16Å
245P91.9Very high92.4Very high10 Ų1039.5 Ų39.57%0.06521%0.208CC..Hα-helixtrans-52.7-46.9172.5-26.631.9000113.9T241 P242 T247 L248 L249 I297 S301T241-P245 WeakPolarHBondContact O-CD 3.3Å; P242-P245 WeakPolarHBondContact O-CD 3.26Å; P245-T247 VanDerWaalsContact C-N 3.32Å; P245-T247 PolarHBondContact O-N 3.45Å; P245-L248 PolarHBondContact O-N 2.9Å; P245-L248 VanDerWaalsContact O-N 3.1Å; P245-L249 WeakPolarHBondContact O-CG 3.27Å; P245-L249 PolarHBondContact O-N 3.15Å; P245-I297 HydrophobicContact CB-CD1 4.18Å; P245-I297 HydrophobicContact CB-CG1 3.85Å; P245-I297 HydrophobicContact CB-CG2 3.95Å; P245-I297 HydrophobicContact CG-CG1 4.45Å; P245-I297 HydrophobicContact CG-CG2 4.26Å; P245-S301 WeakPolarHBondContact CG-OG 3.14Å
246S94.9Very high92.7Very high26 Ų2642.3 Ų42.318%0.18223%0.228CC..Hα-helixtrans-60.3-41.5-177.168.60000112.3P242 L243 I244 L248 L249 S250P242-S246 WeakPolarHBondContact O-CB 3.44Å; P242-S246 PolarHBondContact O-N 3.42Å; P242-S246 PolarHBondContact O-OG 3.44Å; L243-S246 PolarHBondContact O-N 3.2Å; L243-S246 PolarHBondContact O-OG 2.89Å; I244-S246 VanDerWaalsContact C-N 3.34Å; I244-S246 PolarHBondContact O-N 3.5Å; S246-L248 PolarHBondContact O-N 3.02Å; S246-L249 PolarHBondContact O-N 2.84Å; S246-S250 PolarHBondContact O-N 3.36Å; S246-S250 PolarHBondContact O-OG 3.39Å
247T95.1Very high93.3Very high2 Ų240.6 Ų40.61%0.01222%0.221CC..Hα-helixtrans-68-32.4175.959.70000113.4L218 L243 I244 P245 S250 L251 T333L218-T247 HydrophobicContact CD1-CG2 3.94Å; L243-T247 WeakPolarHBondContact O-CG2 3.16Å; L243-T247 PolarHBondContact O-N 3.36Å; L243-T247 VanDerWaalsContact O-N 3.11Å; L243-T247 PolarHBondContact O-OG1 3.24Å; I244-T247 PolarHBondContact O-N 3.46Å; I244-T247 PolarHBondContact O-OG1 2.82Å; P245-T247 VanDerWaalsContact C-N 3.32Å; P245-T247 PolarHBondContact O-N 3.45Å; T247-S250 WeakPolarHBondContact CA-OG 3.16Å; T247-S250 PolarHBondContact O-OG 3.2Å; T247-L251 WeakPolarHBondContact O-CG 3.3Å; T247-L251 PolarHBondContact O-N 3.32Å; T247-T333 HydrophobicContact CG2-CG2 4.33Å
248L94.5Very high93.7Very high11 Ų1139.6 Ų39.66%0.05822%0.216CC..Hα-helixtrans-73.1-38.5176-66.7169.9000111.5I244 P245 S246 S250 L251 G252 Y293 L296I244-L248 HydrophobicContact CG2-CD1 4.01Å; I244-L248 WeakPolarHBondContact O-CG 3.38Å; I244-L248 PolarHBondContact O-N 2.67Å; I244-L248 VanDerWaalsContact O-N 3.16Å; P245-L248 PolarHBondContact O-N 2.9Å; P245-L248 VanDerWaalsContact O-N 3.1Å; S246-L248 PolarHBondContact O-N 3.02Å; L248-S250 VanDerWaalsContact C-N 3.34Å; L248-L251 HydrophobicContact CD2-CD1 4.37Å; L248-L251 WeakPolarHBondContact O-CB 3.47Å; L248-L251 PolarHBondContact O-N 3.16Å; L248-G252 PolarHBondContact O-N 3.49Å; L248-Y293 HydrophobicContact CB-CD1 4.11Å; L248-Y293 HydrophobicContact CB-CG 4.22Å; L248-Y293 HydrophobicContact CD2-CD1 3.87Å; L248-Y293 HydrophobicContact CD2-CE1 3.92Å; L248-Y293 HydrophobicContact CG-CD1 4.48Å; L248-Y293 VanDerWaalsContact O-CD2 3.31Å; L248-Y293 WeakPolarHBondContact O-CD2 3.36Å; L248-L296 HydrophobicContact CD1-CD1 3.9Å; L248-L296 HydrophobicContact CD1-CD2 3.35Å; L248-L296 HydrophobicContact CD1-CG 4.14Å
249L96.1Very high94Very high38 Ų3837.4 Ų37.420%0.19920%0.204CC..Hα-helixtrans-66.9-35.9174.1-70-178.4000112P245 S246 G252 G253 L254 L257 L294 I297P245-L249 WeakPolarHBondContact O-CG 3.27Å; P245-L249 PolarHBondContact O-N 3.15Å; S246-L249 PolarHBondContact O-N 2.84Å; L249-G252 CarbonylContact O-C 3.54Å; L249-G252 WeakPolarHBondContact O-CA 3.11Å; L249-G252 PolarHBondContact O-N 3.2Å; L249-G253 PolarHBondContact O-N 3.05Å; L249-G253 VanDerWaalsContact O-N 3.09Å; L249-L254 HydrophobicContact CB-CD1 4.05Å; L249-L254 HydrophobicContact CD1-CD1 4.14Å; L249-L254 HydrophobicContact CD2-CD1 3.71Å; L249-L254 HydrophobicContact CG-CD1 4.16Å; L249-L254 PolarHBondContact O-N 3.5Å; L249-L257 HydrophobicContact CB-CD1 3.52Å; L249-L294 HydrophobicContact CD2-CD2 4.15Å; L249-I297 HydrophobicContact CD1-CD1 4.14Å; L249-I297 HydrophobicContact CD2-CD1 3.4Å; L249-I297 VanDerWaalsContact CD2-CD1 3.4Å; L249-I297 HydrophobicContact CG-CD1 3.54Å
250S96.9Very high94.3Very high0 Ų029.8 Ų29.80%018%0.177CC..Hα-helixtrans-69.9-38.6173.864.30000111.5L211 S246 T247 L248 G252 G253 G259L211-S250 WeakPolarHBondContact CD2-OG 3.38Å; S246-S250 PolarHBondContact O-N 3.36Å; S246-S250 PolarHBondContact O-OG 3.39Å; T247-S250 WeakPolarHBondContact CA-OG 3.16Å; T247-S250 PolarHBondContact O-OG 3.2Å; L248-S250 VanDerWaalsContact C-N 3.34Å; S250-G252 PolarHBondContact O-N 2.88Å; S250-G253 WeakPolarHBondContact O-CA 3.13Å; S250-G253 PolarHBondContact O-N 3.14Å; S250-G259 VanDerWaalsContact O-CA 3.28Å; S250-G259 WeakPolarHBondContact O-CA 3.14Å
251L95.1Very high94.6Very high3 Ų327.5 Ų27.52%0.01617%0.165CC..Hα-helixtrans-58.4-36.6166.9-76.6167.1000112.3L179 H186 L211 T212 T247 L248 G253 Y293L179-L251 HydrophobicContact CD2-CD1 4.25Å; H186-L251 PolarHBondContact NE2-O 3.46Å; L211-L251 HydrophobicContact CB-CD2 3.52Å; L211-L251 HydrophobicContact CB-CG 3.95Å; L211-L251 HydrophobicContact CD1-CD2 3.87Å; L211-L251 HydrophobicContact CD1-CG 4.23Å; L211-L251 HydrophobicContact CG-CD2 4.33Å; T212-L251 HydrophobicContact CG2-CD2 4.46Å; T247-L251 WeakPolarHBondContact O-CG 3.3Å; T247-L251 PolarHBondContact O-N 3.32Å; L248-L251 HydrophobicContact CD2-CD1 4.37Å; L248-L251 WeakPolarHBondContact O-CB 3.47Å; L248-L251 PolarHBondContact O-N 3.16Å; L251-G253 PolarHBondContact O-N 2.95Å; L251-Y293 HydrophobicContact CB-CE2 4.11Å
252G93.7Very high94.9Very high5 Ų526 Ų265%0.05216%0.155CC..Hα-helixtrans-64.1-21.3171.200000113.8L248 L249 S250 K263L248-G252 PolarHBondContact O-N 3.49Å; L249-G252 CarbonylContact O-C 3.54Å; L249-G252 WeakPolarHBondContact O-CA 3.11Å; L249-G252 PolarHBondContact O-N 3.2Å; S250-G252 PolarHBondContact O-N 2.88Å; G252-K263 PolarHBondContact O-NZ 3.21Å
253G94.4Very high95Very high10 Ų1023.4 Ų23.410%0.10314%0.137CC..THydrogen-bonded Turntrans74.340.8-178.800000113.2L249 S250 L251 G259 F260L249-G253 PolarHBondContact O-N 3.05Å; L249-G253 VanDerWaalsContact O-N 3.09Å; S250-G253 WeakPolarHBondContact O-CA 3.13Å; S250-G253 PolarHBondContact O-N 3.14Å; L251-G253 PolarHBondContact O-N 2.95Å; G253-G259 WeakPolarHBondContact CA-O 3.29Å; G253-F260 WeakPolarHBondContact O-CD2 3.4Å
254L94.1Very high95.1Very high54 Ų5427.7 Ų27.728%0.28315%0.15SC..  trans-67.8142.1172.9-81.1-175.4000111.7L249 P256 L257 F260 L290L249-L254 HydrophobicContact CB-CD1 4.05Å; L249-L254 HydrophobicContact CD1-CD1 4.14Å; L249-L254 HydrophobicContact CD2-CD1 3.71Å; L249-L254 HydrophobicContact CG-CD1 4.16Å; L249-L254 PolarHBondContact O-N 3.5Å; L254-P256 VanDerWaalsContact C-CD 3.44Å; L254-L257 HydrophobicContact CB-CD1 4.48Å; L254-L257 PolarHBondContact O-N 3.24Å; L254-F260 WeakPolarHBondContact O-CB 3.32Å; L254-L290 HydrophobicContact CD2-CD1 3.64Å; L254-L290 HydrophobicContact CG-CD1 3.91Å
255P92.3Very high95.4Very high73 Ų7327.3 Ų27.347%0.47415%0.149SC..THydrogen-bonded Turntrans-55.7-34.7-170.317.8-28.2000116.8L257 F260 L337P255-L257 PolarHBondContact O-N 3.04Å; P255-F260 HydrophobicContact CB-CD1 4.45Å; P255-F260 HydrophobicContact CB-CD2 4.26Å; P255-F260 HydrophobicContact CB-CE2 4.33Å; P255-F260 HydrophobicContact CB-CG 4.32Å; P255-F260 HydrophobicContact CB-CZ 4.46Å; P255-L337 WeakPolarHBondContact O-CD2 3.33Å
256P94.7Very high95.6Very high92 Ų9226.9 Ų26.960%0.59715%0.146SC*.THydrogen-bonded Turntrans-75-5.817728.5-35.1000114.1L254L254-P256 VanDerWaalsContact C-CD 3.44Å
257L96.8Very high95.8Very high23 Ų2328.3 Ų28.312%0.1215%0.152CC..SBendtrans-115.9166.3-171.1-58.4175.5000112L249 L254 P255 G259 F260 T334L249-L257 HydrophobicContact CB-CD1 3.52Å; L254-L257 HydrophobicContact CB-CD1 4.48Å; L254-L257 PolarHBondContact O-N 3.24Å; P255-L257 PolarHBondContact O-N 3.04Å; L257-G259 PolarHBondContact O-N 3.13Å; L257-F260 WeakPolarHBondContact O-CB 3.27Å; L257-F260 PolarHBondContact O-N 3.19Å; L257-T334 HydrophobicContact CD2-CG2 3.91Å
258T96.2Very high95.9Very high3 Ų331.6 Ų31.62%0.01817%0.167CC..THydrogen-bonded Turntrans-73-30.6-165.966.10000113.5F260 L261 P262 L332 T333 T334 L336T258-F260 PolarHBondContact O-N 3.35Å; T258-F260 VanDerWaalsContact O-N 3.16Å; T258-L261 VanDerWaalsContact O-CB 3.3Å; T258-L261 WeakPolarHBondContact O-CB 3.34Å; T258-L261 PolarHBondContact O-N 3.12Å; T258-L261 VanDerWaalsContact O-N 3.13Å; T258-P262 WeakPolarHBondContact O-CD 3.36Å; T258-L332 WeakPolarHBondContact CG2-O 3.26Å; T258-T333 WeakPolarHBondContact CG2-O 3.43Å; T258-T333 VanDerWaalsContact OG1-C 3.28Å; T258-T333 PolarHBondContact OG1-O 2.86Å; T258-T334 WeakPolarHBondContact CG2-O 3.49Å; T258-L336 HydrophobicContact CG2-CB 3.57Å
259G95.4Very high96Very high4 Ų431.8 Ų31.84%0.04117%0.167CC..THydrogen-bonded Turntrans-70.6-4.6176.900000114.7S250 G253 L257 P262S250-G259 VanDerWaalsContact O-CA 3.28Å; S250-G259 WeakPolarHBondContact O-CA 3.14Å; G253-G259 WeakPolarHBondContact CA-O 3.29Å; L257-G259 PolarHBondContact O-N 3.13Å; G259-P262 WeakPolarHBondContact O-CD 3.28Å
260F97.4Very high96Very high68 Ų6830 Ų3030%0.29816%0.158SC..Hα-helixtrans-71.4-39.2167.1178.2-108.1000112.1G253 L254 P255 L257 T258 K263 W264 L337G253-F260 WeakPolarHBondContact O-CD2 3.4Å; L254-F260 WeakPolarHBondContact O-CB 3.32Å; P255-F260 HydrophobicContact CB-CD1 4.45Å; P255-F260 HydrophobicContact CB-CD2 4.26Å; P255-F260 HydrophobicContact CB-CE2 4.33Å; P255-F260 HydrophobicContact CB-CG 4.32Å; P255-F260 HydrophobicContact CB-CZ 4.46Å; L257-F260 WeakPolarHBondContact O-CB 3.27Å; L257-F260 PolarHBondContact O-N 3.19Å; T258-F260 PolarHBondContact O-N 3.35Å; T258-F260 VanDerWaalsContact O-N 3.16Å; F260-K263 PolarHBondContact O-N 3.48Å; F260-K263 VanDerWaalsContact O-N 3.15Å; F260-W264 HydrophobicContact CD1-CB 4.33Å; F260-W264 HydrophobicContact CE1-CB 3.93Å; F260-W264 HydrophobicContact CE1-CG 4.15Å; F260-W264 HydrophobicContact CZ-CB 4.07Å; F260-W264 HydrophobicContact CZ-CG 4.32Å; F260-W264 PolarHBondContact O-N 2.82Å; F260-L337 HydrophobicContact CD1-CD1 4.37Å
261L97Very high96Very high3 Ų332.6 Ų32.62%0.01617%0.174CC..Hα-helixtrans-49.8-54.1-176.9-170.5169000113.2L203 I207 T258 K263 W264 A265 L336 L337 M343L203-L261 HydrophobicContact CD1-CD2 4.25Å; L203-L261 HydrophobicContact CD2-CD2 3.6Å; L203-L261 HydrophobicContact CG-CD2 4.22Å; I207-L261 HydrophobicContact CD1-CD2 4.23Å; T258-L261 VanDerWaalsContact O-CB 3.3Å; T258-L261 WeakPolarHBondContact O-CB 3.34Å; T258-L261 PolarHBondContact O-N 3.12Å; T258-L261 VanDerWaalsContact O-N 3.13Å; L261-K263 VanDerWaalsContact C-N 3.34Å; L261-K263 PolarHBondContact O-N 3.41Å; L261-W264 PolarHBondContact O-N 3.42Å; L261-A265 PolarHBondContact O-N 2.87Å; L261-L336 HydrophobicContact CD1-CD2 4.25Å; L261-L337 HydrophobicContact CB-CD1 4.19Å; L261-M343 HydrophobicContact CD1-CB 4.22Å; L261-M343 HydrophobicContact CD1-CG 4.37Å
262P96.3Very high96.1Very high3 Ų338.7 Ų38.72%0.01920%0.2CC..Hα-helixtrans-66.8-35.7-177.125.8-33.7000112N204 I207 T258 G259 I266N204-P262 HydrophobicContact CB-CB 3.85Å; I207-P262 HydrophobicContact CB-CG 4.46Å; I207-P262 HydrophobicContact CD1-CB 4.26Å; I207-P262 HydrophobicContact CD1-CG 3.99Å; I207-P262 HydrophobicContact CG2-CG 4.22Å; T258-P262 WeakPolarHBondContact O-CD 3.36Å; G259-P262 WeakPolarHBondContact O-CD 3.28Å; P262-I266 VanDerWaalsContact O-CB 3.31Å; P262-I266 WeakPolarHBondContact O-CB 3.05Å; P262-I266 WeakPolarHBondContact O-CD1 3.43Å; P262-I266 WeakPolarHBondContact O-CG1 3.21Å; P262-I266 PolarHBondContact O-N 3.11Å
263K96.1Very high96.1Very high22 Ų2242.2 Ų42.210%0.09622%0.218CC..Hα-helixtrans-66.5-40.3177.5-66.4-174.6-178.1-1770111.4G252 F260 L261 I267G252-K263 PolarHBondContact O-NZ 3.21Å; F260-K263 PolarHBondContact O-N 3.48Å; F260-K263 VanDerWaalsContact O-N 3.15Å; L261-K263 VanDerWaalsContact C-N 3.34Å; L261-K263 PolarHBondContact O-N 3.41Å; K263-I267 WeakPolarHBondContact O-CD1 3.29Å; K263-I267 VanDerWaalsContact O-CG1 3.26Å; K263-I267 WeakPolarHBondContact O-CG1 3.24Å; K263-I267 PolarHBondContact O-N 3.41Å; K263-I267 VanDerWaalsContact O-N 3.08Å
264W96.7Very high96.1Very high120 Ų12048.9 Ų48.946%0.45525%0.251SS..Hα-helixtrans-65.1-48.3177.3177.252.4000111.8F260 L261 I266 I267 E268F260-W264 HydrophobicContact CD1-CB 4.33Å; F260-W264 HydrophobicContact CE1-CB 3.93Å; F260-W264 HydrophobicContact CE1-CG 4.15Å; F260-W264 HydrophobicContact CZ-CB 4.07Å; F260-W264 HydrophobicContact CZ-CG 4.32Å; F260-W264 PolarHBondContact O-N 2.82Å; L261-W264 PolarHBondContact O-N 3.42Å; W264-I266 VanDerWaalsContact C-N 3.32Å; W264-I266 PolarHBondContact O-N 3.43Å; W264-I267 PolarHBondContact O-N 2.96Å; W264-I267 VanDerWaalsContact O-N 3.17Å; W264-E268 PolarHBondContact O-N 3.18Å
265A97.1Very high96Very high4 Ų447.4 Ų47.43%0.03325%0.245CC..Hα-helixtrans-59.5-4217700000112.3M200 L203 L261 I267 E268 E269 L344M200-A265 HydrophobicContact SD-CB 3.8Å; L203-A265 HydrophobicContact CD2-CB 4.23Å; L261-A265 PolarHBondContact O-N 2.87Å; A265-I267 PolarHBondContact O-N 2.91Å; A265-E268 WeakPolarHBondContact O-CB 3.22Å; A265-E268 PolarHBondContact O-N 3.44Å; A265-E269 PolarHBondContact O-N 3.18Å; A265-E269 VanDerWaalsContact O-N 3.16Å; A265-L344 HydrophobicContact CB-CD2 4.19Å
266I97.6Very high96.2Very high0 Ų049.1 Ų49.10%025%0.25CS..Hα-helixtrans-58.5-48.2174.9-74169.3000111.3W189 V193 M200 N204 P262 W264 E268 E269 F270W189-I266 HydrophobicContact CB-CD1 4.3Å; W189-I266 HydrophobicContact CE3-CB 4.29Å; W189-I266 HydrophobicContact CE3-CD1 4Å; W189-I266 HydrophobicContact CE3-CG2 3.63Å; W189-I266 HydrophobicContact CZ3-CB 4.42Å; W189-I266 HydrophobicContact CZ3-CG2 3.7Å; V193-I266 HydrophobicContact CB-CG1 4.37Å; V193-I266 HydrophobicContact CG2-CB 3.81Å; V193-I266 HydrophobicContact CG2-CD1 4.28Å; V193-I266 HydrophobicContact CG2-CG1 3.65Å; V193-I266 HydrophobicContact CG2-CG2 3.2Å; M200-I266 HydrophobicContact CB-CG1 4.45Å; N204-I266 HydrophobicContact CB-CD1 4.33Å; N204-I266 WeakPolarHBondContact ND2-CD1 2.93Å; P262-I266 VanDerWaalsContact O-CB 3.31Å; P262-I266 WeakPolarHBondContact O-CB 3.05Å; P262-I266 WeakPolarHBondContact O-CD1 3.43Å; P262-I266 WeakPolarHBondContact O-CG1 3.21Å; P262-I266 PolarHBondContact O-N 3.11Å; W264-I266 VanDerWaalsContact C-N 3.32Å; W264-I266 PolarHBondContact O-N 3.43Å; I266-E268 VanDerWaalsContact C-N 3.28Å; I266-E268 PolarHBondContact O-N 3.3Å; I266-E269 PolarHBondContact O-N 3.44Å; I266-F270 HydrophobicContact CG2-CD2 3.73Å; I266-F270 HydrophobicContact CG2-CE2 3.59Å; I266-F270 VanDerWaalsContact O-CD2 3.23Å; I266-F270 WeakPolarHBondContact O-CD2 3.39Å; I266-F270 PolarHBondContact O-N 3.33Å; I266-F270 VanDerWaalsContact O-N 3.13Å
267I97.7Very high96.3Very high57 Ų5750.8 Ų50.829%0.29225%0.253SS..Hα-helixtrans-60.8-41.5179.7-69.4165.6000110.5W189 K263 W264 A265 E269 F270 T271 P279W189-I267 HydrophobicContact CZ3-CG1 4.32Å; K263-I267 WeakPolarHBondContact O-CD1 3.29Å; K263-I267 VanDerWaalsContact O-CG1 3.26Å; K263-I267 WeakPolarHBondContact O-CG1 3.24Å; K263-I267 PolarHBondContact O-N 3.41Å; K263-I267 VanDerWaalsContact O-N 3.08Å; W264-I267 PolarHBondContact O-N 2.96Å; W264-I267 VanDerWaalsContact O-N 3.17Å; A265-I267 PolarHBondContact O-N 2.91Å; I267-E269 VanDerWaalsContact C-N 3.32Å; I267-E269 PolarHBondContact O-N 3.38Å; I267-F270 PolarHBondContact O-N 3.32Å; I267-T271 HydrophobicContact CG2-CG2 4.24Å; I267-T271 WeakPolarHBondContact O-CG2 3.4Å; I267-T271 PolarHBondContact O-N 2.95Å; I267-P279 HydrophobicContact CG1-CB 4.12Å; I267-P279 HydrophobicContact CG2-CB 4.43Å
268E97.3Very high96.3Very high71 Ų7151.2 Ų51.233%0.33226%0.255SS..Hα-helixtrans-58.1-44.1177.9-164.3-171.814700111.5W264 A265 I266 T271 K272W264-E268 PolarHBondContact O-N 3.18Å; A265-E268 WeakPolarHBondContact O-CB 3.22Å; A265-E268 PolarHBondContact O-N 3.44Å; I266-E268 VanDerWaalsContact C-N 3.28Å; I266-E268 PolarHBondContact O-N 3.3Å; E268-T271 PolarHBondContact O-N 3.08Å; E268-T271 PolarHBondContact O-OG1 3.45Å; E268-K272 WeakPolarHBondContact O-CG 3.38Å; E268-K272 PolarHBondContact O-N 2.97Å; E268-K272 WeakPolarHBondContact OE1-CE 3.36Å; E268-K272 IonicContact OE1-NZ 2.7Å; E268-K272 PolarHBondContact OE1-NZ 2.9Å
269E96.6Very high96.3Very high14 Ų1451.3 Ų51.37%0.06526%0.255CS..Hα-helixtrans-68.3-36.8178.9-68.4-171.3155.400114V193 N197 M200 A265 I266 I267 T271 K272 N273V193-E269 WeakPolarHBondContact CG1-OE2 3.5Å; N197-E269 VanDerWaalsContact CB-CD 3.46Å; N197-E269 WeakPolarHBondContact CB-OE1 3.2Å; N197-E269 WeakPolarHBondContact CB-OE2 3.4Å; N197-E269 VanDerWaalsContact CG-OE1 3.31Å; N197-E269 PolarHBondContact ND2-OE1 3.21Å; M200-E269 WeakPolarHBondContact CB-OE2 3.45Å; M200-E269 WeakPolarHBondContact CE-OE1 3.35Å; M200-E269 HydrophobicContact CG-CG 4.19Å; M200-E269 WeakPolarHBondContact CG-OE1 3.36Å; M200-E269 WeakPolarHBondContact CG-OE2 3.44Å; A265-E269 PolarHBondContact O-N 3.18Å; A265-E269 VanDerWaalsContact O-N 3.16Å; I266-E269 PolarHBondContact O-N 3.44Å; I267-E269 VanDerWaalsContact C-N 3.32Å; I267-E269 PolarHBondContact O-N 3.38Å; E269-T271 VanDerWaalsContact C-N 3.29Å; E269-T271 PolarHBondContact O-N 3.49Å; E269-K272 PolarHBondContact O-N 3.45Å; E269-N273 PolarHBondContact O-N 3.17Å; E269-N273 PolarHBondContact O-ND2 2.98Å; E269-N273 VanDerWaalsContact O-ND2 3.14Å
270F96.7Very high96.3Very high0 Ų055.1 Ų55.10%028%0.278CS..Hα-helixtrans-61.3-41.2171-83.5-72.9000111.6L155 A192 V193 Y196 I266 I267 N273 N274 S275 I278 P279 M282L155-F270 HydrophobicContact CD2-CE1 4.17Å; L155-F270 HydrophobicContact CD2-CZ 4.33Å; A192-F270 HydrophobicContact CB-CE2 4.28Å; A192-F270 HydrophobicContact CB-CZ 3.82Å; A192-F270 WeakPolarHBondContact O-CZ 3.43Å; V193-F270 HydrophobicContact CG2-CD2 4.1Å; V193-F270 HydrophobicContact CG2-CE2 3.42Å; V193-F270 VanDerWaalsContact CG2-CE2 3.42Å; V193-F270 HydrophobicContact CG2-CZ 4.02Å; Y196-F270 HydrophobicContact CD2-CD1 4.15Å; Y196-F270 AromaticContact CD2-CE1 3.86Å; Y196-F270 HydrophobicContact CD2-CE1 3.86Å; Y196-F270 HydrophobicContact CD2-CZ 4.32Å; Y196-F270 AromaticContact CE2-CD1 3.72Å; Y196-F270 HydrophobicContact CE2-CD1 3.72Å; Y196-F270 AromaticContact CE2-CE1 3.29Å; Y196-F270 HydrophobicContact CE2-CE1 3.29Å; Y196-F270 HydrophobicContact CE2-CZ 4.08Å; I266-F270 HydrophobicContact CG2-CD2 3.73Å; I266-F270 HydrophobicContact CG2-CE2 3.59Å; I266-F270 VanDerWaalsContact O-CD2 3.23Å; I266-F270 WeakPolarHBondContact O-CD2 3.39Å; I266-F270 PolarHBondContact O-N 3.33Å; I266-F270 VanDerWaalsContact O-N 3.13Å; I267-F270 PolarHBondContact O-N 3.32Å; F270-N273 CarbonylContact O-C 3.43Å; F270-N273 PolarHBondContact O-N 3.32Å; F270-N274 PolarHBondContact O-N 2.79Å; F270-S275 WeakPolarHBondContact CD1-OG 3.12Å; F270-S275 PolarHBondContact O-N 3.17Å; F270-S275 VanDerWaalsContact O-N 3.07Å; F270-S275 PolarHBondContact O-OG 3.06Å; F270-S275 VanDerWaalsContact O-OG 3.11Å; F270-I278 HydrophobicContact CE1-CB 4.42Å; F270-I278 HydrophobicContact CE1-CG2 3.9Å; F270-I278 HydrophobicContact CZ-CG2 4.13Å; F270-P279 HydrophobicContact CB-CB 4.17Å; F270-P279 HydrophobicContact CB-CG 3.78Å; F270-P279 HydrophobicContact CD2-CB 4.26Å; F270-P279 HydrophobicContact CG-CB 4.33Å; F270-P279 HydrophobicContact CG-CG 4.24Å; F270-M282 HydrophobicContact CE2-CE 4.49Å; F270-M282 HydrophobicContact CE2-SD 4.21Å; F270-M282 HydrophobicContact CZ-SD 4.24Å
271T96.6Very high96.3Very high55 Ų5554.9 Ų54.934%0.33728%0.279SS..Hα-helixtrans-68.5-36.5179.3670000112.4I267 E268 E269 N273 N274 L276I267-T271 HydrophobicContact CG2-CG2 4.24Å; I267-T271 WeakPolarHBondContact O-CG2 3.4Å; I267-T271 PolarHBondContact O-N 2.95Å; E268-T271 PolarHBondContact O-N 3.08Å; E268-T271 PolarHBondContact O-OG1 3.45Å; E269-T271 VanDerWaalsContact C-N 3.29Å; E269-T271 PolarHBondContact O-N 3.49Å; T271-N273 PolarHBondContact O-N 2.96Å; T271-N274 PolarHBondContact O-N 3.14Å; T271-N274 VanDerWaalsContact O-N 3.09Å; T271-L276 HydrophobicContact CG2-CD2 3.53Å
272K96.8Very high96.3Very high131 Ų13154.8 Ų54.857%0.5728%0.278SS*.Hα-helixtrans-60.5-31.7172.6-74.6174-177.5165.10112.2E268 E269 N274E268-K272 WeakPolarHBondContact O-CG 3.38Å; E268-K272 PolarHBondContact O-N 2.97Å; E268-K272 WeakPolarHBondContact OE1-CE 3.36Å; E268-K272 IonicContact OE1-NZ 2.7Å; E268-K272 PolarHBondContact OE1-NZ 2.9Å; E269-K272 PolarHBondContact O-N 3.45Å; K272-N274 VanDerWaalsContact C-N 3.35Å
273N94.8Very high96.3Very high80 Ų8056.3 Ų56.343%0.42829%0.291SS..THydrogen-bonded Turntrans-95.122.1177.2-64-42000113.5Y196 E269 F270 T271 S275Y196-N273 WeakPolarHBondContact CB-ND2 3.45Å; Y196-N273 HydrophobicContact CD1-CB 3.86Å; Y196-N273 WeakPolarHBondContact CD1-ND2 3.35Å; Y196-N273 HydrophobicContact CE1-CB 3.92Å; E269-N273 PolarHBondContact O-N 3.17Å; E269-N273 PolarHBondContact O-ND2 2.98Å; E269-N273 VanDerWaalsContact O-ND2 3.14Å; F270-N273 CarbonylContact O-C 3.43Å; F270-N273 PolarHBondContact O-N 3.32Å; T271-N273 PolarHBondContact O-N 2.96Å; N273-S275 PolarHBondContact O-N 3.17Å; N273-S275 VanDerWaalsContact O-N 3.08Å
274N95Very high96.4Very high149 Ų14959.4 Ų59.480%0.79731%0.312SS*.THydrogen-bonded Turntrans60.913.4174.9-62-28.7000116.5F270 T271 K272F270-N274 PolarHBondContact O-N 2.79Å; T271-N274 PolarHBondContact O-N 3.14Å; T271-N274 VanDerWaalsContact O-N 3.09Å; K272-N274 VanDerWaalsContact C-N 3.35Å
275S91.7Very high96.4Very high23 Ų2354.6 Ų54.616%0.16130%0.295CS..  trans-102.886.3-177.654.70000111.1F270 N273 P279F270-S275 WeakPolarHBondContact CD1-OG 3.12Å; F270-S275 PolarHBondContact O-N 3.17Å; F270-S275 VanDerWaalsContact O-N 3.07Å; F270-S275 PolarHBondContact O-OG 3.06Å; F270-S275 VanDerWaalsContact O-OG 3.11Å; N273-S275 PolarHBondContact O-N 3.17Å; N273-S275 VanDerWaalsContact O-N 3.08Å; S275-P279 WeakPolarHBondContact O-CD 3.38Å; S275-P279 WeakPolarHBondContact O-CG 3.36Å
276L95.3Very high96.2Very high110 Ų11055 Ų5558%0.57630%0.297SS*.  trans-83.6-24-179.2-63.4175000113.6T271 P279 T280T271-L276 HydrophobicContact CG2-CD2 3.53Å; L276-P279 WeakPolarHBondContact O-CG 3.42Å; L276-T280 VanDerWaalsContact O-CG2 3.31Å; L276-T280 WeakPolarHBondContact O-CG2 3.11Å; L276-T280 PolarHBondContact O-N 3.38Å; L276-T280 PolarHBondContact O-OG1 2.87Å
277I96.9Very high96.1Very high127 Ų12760.3 Ų60.365%0.65133%0.325SS*.Hα-helixtrans-71.8-44.2-173-62.2170.5000111.5T280 I281I277-T280 PolarHBondContact O-N 3.49Å; I277-T280 PolarHBondContact O-OG1 3.14Å; I277-I281 HydrophobicContact CG2-CD1 3.75Å; I277-I281 HydrophobicContact CG2-CG1 4.49Å; I277-I281 VanDerWaalsContact O-CG1 3.29Å; I277-I281 WeakPolarHBondContact O-CG1 3.42Å; I277-I281 PolarHBondContact O-N 3.01Å; I277-I281 VanDerWaalsContact O-N 3.09Å
278I96.5Very high95.9Very high32 Ų3260.3 Ų60.316%0.16433%0.325CS..Hα-helixtrans-64.2-52.1-178.3-66.4156.7000112.5L155 I159 F270 T280 I281 M282L155-I278 HydrophobicContact CD1-CD1 3.66Å; L155-I278 HydrophobicContact CD2-CD1 4.41Å; L155-I278 HydrophobicContact CD2-CG2 4.39Å; I159-I278 HydrophobicContact CD1-CG2 4.3Å; F270-I278 HydrophobicContact CE1-CB 4.42Å; F270-I278 HydrophobicContact CE1-CG2 3.9Å; F270-I278 HydrophobicContact CZ-CG2 4.13Å; I278-T280 VanDerWaalsContact C-N 3.26Å; I278-T280 PolarHBondContact O-N 3.05Å; I278-I281 PolarHBondContact O-N 3.08Å; I278-M282 HydrophobicContact CG2-CG 4.25Å; I278-M282 HydrophobicContact CG2-SD 3.59Å; I278-M282 VanDerWaalsContact CG2-SD 3.59Å; I278-M282 WeakPolarHBondContact O-CG 3.49Å; I278-M282 PolarHBondContact O-N 3.17Å
279P96.2Very high95.7Very high5 Ų557.2 Ų57.23%0.03231%0.311CS..Hα-helixtrans-63.6-30.9-179.524.5-35.4000112.5I267 F270 S275 L276 A283I267-P279 HydrophobicContact CG1-CB 4.12Å; I267-P279 HydrophobicContact CG2-CB 4.43Å; F270-P279 HydrophobicContact CB-CB 4.17Å; F270-P279 HydrophobicContact CB-CG 3.78Å; F270-P279 HydrophobicContact CD2-CB 4.26Å; F270-P279 HydrophobicContact CG-CB 4.33Å; F270-P279 HydrophobicContact CG-CG 4.24Å; S275-P279 WeakPolarHBondContact O-CD 3.38Å; S275-P279 WeakPolarHBondContact O-CG 3.36Å; L276-P279 WeakPolarHBondContact O-CG 3.42Å; P279-A283 WeakPolarHBondContact O-CB 3.27Å; P279-A283 PolarHBondContact O-N 3.47Å
280T96.4Very high95.5Very high83 Ų8357.9 Ų57.951%0.50932%0.315SS..Hα-helixtrans-69-42174.650.90000112.1L276 I277 I278 T284L276-T280 VanDerWaalsContact O-CG2 3.31Å; L276-T280 WeakPolarHBondContact O-CG2 3.11Å; L276-T280 PolarHBondContact O-N 3.38Å; L276-T280 PolarHBondContact O-OG1 2.87Å; I277-T280 PolarHBondContact O-N 3.49Å; I277-T280 PolarHBondContact O-OG1 3.14Å; I278-T280 VanDerWaalsContact C-N 3.26Å; I278-T280 PolarHBondContact O-N 3.05Å; T280-T284 WeakPolarHBondContact O-CB 3.2Å; T280-T284 WeakPolarHBondContact O-CG2 3.32Å; T280-T284 PolarHBondContact O-N 3.28Å; T280-T284 PolarHBondContact O-OG1 3.34Å
281I97.8Very high95.4Very high63 Ų6364.5 Ų64.532%0.32334%0.341SS..Hα-helixtrans-60.5-49.6172.2-68167.5000110.7I159 I277 I278 A283 T284 I285I159-I281 HydrophobicContact CG2-CG2 4.32Å; I277-I281 HydrophobicContact CG2-CD1 3.75Å; I277-I281 HydrophobicContact CG2-CG1 4.49Å; I277-I281 VanDerWaalsContact O-CG1 3.29Å; I277-I281 WeakPolarHBondContact O-CG1 3.42Å; I277-I281 PolarHBondContact O-N 3.01Å; I277-I281 VanDerWaalsContact O-N 3.09Å; I278-I281 PolarHBondContact O-N 3.08Å; I281-A283 PolarHBondContact O-N 3.34Å; I281-T284 PolarHBondContact O-N 3.48Å; I281-T284 PolarHBondContact O-OG1 3.38Å; I281-I285 HydrophobicContact CG2-CD1 3.57Å; I281-I285 WeakPolarHBondContact O-CD1 3.46Å; I281-I285 VanDerWaalsContact O-CG1 3.25Å; I281-I285 WeakPolarHBondContact O-CG1 3.25Å; I281-I285 PolarHBondContact O-N 3.36Å; I281-I285 VanDerWaalsContact O-N 3.13Å
282M97.5Very high95.3Very high1 Ų162.4 Ų62.41%0.00533%0.327CS..Hα-helixtrans-60.7-47.3-179.9-66.616966.500111.7I159 I162 W189 A192 F270 I278 I285 T286I159-M282 HydrophobicContact CG1-CG 4.47Å; I162-M282 HydrophobicContact CD1-CB 4.07Å; I162-M282 HydrophobicContact CD1-CE 3.47Å; I162-M282 VanDerWaalsContact CD1-CE 3.47Å; I162-M282 HydrophobicContact CD1-CG 3.71Å; I162-M282 HydrophobicContact CD1-SD 4.29Å; W189-M282 HydrophobicContact CB-CE 4.49Å; W189-M282 HydrophobicContact CD2-CE 3.54Å; W189-M282 HydrophobicContact CE3-CE 3.52Å; W189-M282 HydrophobicContact CG-CE 4.01Å; W189-M282 HydrophobicContact CH2-CB 3.79Å; W189-M282 HydrophobicContact CH2-CE 4.3Å; W189-M282 HydrophobicContact CZ2-CB 3.58Å; W189-M282 HydrophobicContact CZ2-CE 4.33Å; W189-M282 HydrophobicContact CZ3-CB 4.47Å; W189-M282 HydrophobicContact CZ3-CE 3.92Å; A192-M282 HydrophobicContact CB-CE 3.46Å; A192-M282 VanDerWaalsContact CB-CE 3.46Å; A192-M282 HydrophobicContact CB-SD 3.96Å; F270-M282 HydrophobicContact CE2-CE 4.49Å; F270-M282 HydrophobicContact CE2-SD 4.21Å; F270-M282 HydrophobicContact CZ-SD 4.24Å; I278-M282 HydrophobicContact CG2-CG 4.25Å; I278-M282 HydrophobicContact CG2-SD 3.59Å; I278-M282 VanDerWaalsContact CG2-SD 3.59Å; I278-M282 WeakPolarHBondContact O-CG 3.49Å; I278-M282 PolarHBondContact O-N 3.17Å; M282-I285 PolarHBondContact O-N 3.31Å; M282-T286 WeakPolarHBondContact O-CG2 3.41Å; M282-T286 PolarHBondContact O-N 3.15Å; M282-T286 VanDerWaalsContact O-N 3.14Å
283A96.2Very high95.2Very high35 Ų3556.2 Ų56.229%0.28930%0.3SS..Hα-helixtrans-61.9-46.1-178.600000111.9W189 P279 I281 I285 T286W189-A283 HydrophobicContact CH2-CB 4.48Å; P279-A283 WeakPolarHBondContact O-CB 3.27Å; P279-A283 PolarHBondContact O-N 3.47Å; I281-A283 PolarHBondContact O-N 3.34Å; A283-I285 PolarHBondContact O-N 3.3Å; A283-T286 PolarHBondContact O-N 3.38Å; A283-T286 PolarHBondContact O-OG1 2.86Å
284T96.9Very high95.2Very high87 Ų8755 Ų5553%0.53429%0.293SS..Hα-helixtrans-63.6-42.3179.551.20000112.5T280 I281 T286 L287T280-T284 WeakPolarHBondContact O-CB 3.2Å; T280-T284 WeakPolarHBondContact O-CG2 3.32Å; T280-T284 PolarHBondContact O-N 3.28Å; T280-T284 PolarHBondContact O-OG1 3.34Å; I281-T284 PolarHBondContact O-N 3.48Å; I281-T284 PolarHBondContact O-OG1 3.38Å; T284-T286 VanDerWaalsContact C-N 3.31Å; T284-T286 PolarHBondContact O-N 2.65Å; T284-L287 WeakPolarHBondContact O-CB 3.37Å; T284-L287 PolarHBondContact O-N 3.43Å
285I96.8Very high95.2Very high19 Ų1955 Ų5510%0.09728%0.282CS..Hα-helixtrans-63.9-37.8178.3-63.2162.6000111I162 M163 I281 M282 A283 L287 L288I162-I285 HydrophobicContact CG2-CB 4.08Å; I162-I285 HydrophobicContact CG2-CG2 3.79Å; M163-I285 HydrophobicContact CE-CD1 3.64Å; M163-I285 HydrophobicContact CG-CD1 3.71Å; M163-I285 HydrophobicContact CG-CG2 4.46Å; I281-I285 HydrophobicContact CG2-CD1 3.57Å; I281-I285 WeakPolarHBondContact O-CD1 3.46Å; I281-I285 VanDerWaalsContact O-CG1 3.25Å; I281-I285 WeakPolarHBondContact O-CG1 3.25Å; I281-I285 PolarHBondContact O-N 3.36Å; I281-I285 VanDerWaalsContact O-N 3.13Å; M282-I285 PolarHBondContact O-N 3.31Å; A283-I285 PolarHBondContact O-N 3.3Å; I285-L287 PolarHBondContact O-N 2.96Å; I285-L287 VanDerWaalsContact O-N 3.14Å; I285-L288 WeakPolarHBondContact O-CB 3.22Å; I285-L288 PolarHBondContact O-N 3Å; I285-L288 VanDerWaalsContact O-N 3.11Å
286T93.8Very high95.3Very high12 Ų1254.3 Ų54.37%0.07428%0.277CS..Hα-helixtrans-66.6-13.3179.558.80000115.3I162 W189 M282 A283 T284 L288 N289 L290I162-T286 HydrophobicContact CG2-CG2 4.04Å; W189-T286 HydrophobicContact CZ2-CG2 3.78Å; M282-T286 WeakPolarHBondContact O-CG2 3.41Å; M282-T286 PolarHBondContact O-N 3.15Å; M282-T286 VanDerWaalsContact O-N 3.14Å; A283-T286 PolarHBondContact O-N 3.38Å; A283-T286 PolarHBondContact O-OG1 2.86Å; T284-T286 VanDerWaalsContact C-N 3.31Å; T284-T286 PolarHBondContact O-N 2.65Å; T286-L288 PolarHBondContact O-N 3.26Å; T286-N289 VanDerWaalsContact O-CB 3.3Å; T286-N289 WeakPolarHBondContact O-CB 3.46Å; T286-N289 PolarHBondContact O-N 3.03Å; T286-N289 VanDerWaalsContact O-N 3.08Å; T286-L290 PolarHBondContact O-N 3.08Å
287L94.8Very high95.2Very high113 Ų11349.4 Ų49.459%0.59225%0.251SS*.Hα-helixtrans-63.4-29.6172.7-65173.7000111.6T284 I285 N289 L290 Y291T284-L287 WeakPolarHBondContact O-CB 3.37Å; T284-L287 PolarHBondContact O-N 3.43Å; I285-L287 PolarHBondContact O-N 2.96Å; I285-L287 VanDerWaalsContact O-N 3.14Å; L287-N289 VanDerWaalsContact C-N 3.32Å; L287-N289 PolarHBondContact O-N 2.97Å; L287-L290 PolarHBondContact O-N 3.41Å; L287-Y291 PolarHBondContact O-N 3.22Å
288L94.1Very high95.1Very high57 Ų5749.2 Ų49.230%0.29824%0.243SC..Hα-helixtrans-64.4-37.2172.9-65169.6000111.8L170 I285 T286 L290 Y291 F292L170-L288 HydrophobicContact CD1-CD2 4.46Å; I285-L288 WeakPolarHBondContact O-CB 3.22Å; I285-L288 PolarHBondContact O-N 3Å; I285-L288 VanDerWaalsContact O-N 3.11Å; T286-L288 PolarHBondContact O-N 3.26Å; L288-L290 VanDerWaalsContact C-N 3.34Å; L288-Y291 PolarHBondContact O-N 3Å; L288-F292 WeakPolarHBondContact O-CD1 3.22Å; L288-F292 PolarHBondContact O-N 2.87Å
289N91.7Very high94.9Very high5 Ų548.9 Ų48.93%0.02724%0.244CC..Hα-helixtrans-60.6-47.6173.4-79.8-18.1000111.6S166 T185 T286 L287 Y291 F292 Y293S166-N289 WeakPolarHBondContact CA-OD1 3.22Å; S166-N289 PolarHBondContact OG-OD1 3.16Å; T185-N289 VanDerWaalsContact CB-ND2 3.27Å; T185-N289 WeakPolarHBondContact CB-ND2 3.17Å; T185-N289 WeakPolarHBondContact CG2-ND2 3.32Å; T185-N289 PolarHBondContact OG1-ND2 2.81Å; T286-N289 VanDerWaalsContact O-CB 3.3Å; T286-N289 WeakPolarHBondContact O-CB 3.46Å; T286-N289 PolarHBondContact O-N 3.03Å; T286-N289 VanDerWaalsContact O-N 3.08Å; L287-N289 VanDerWaalsContact C-N 3.32Å; L287-N289 PolarHBondContact O-N 2.97Å; N289-Y291 VanDerWaalsContact C-N 3.26Å; N289-Y291 PolarHBondContact O-N 2.63Å; N289-F292 HydrophobicContact CB-CE1 3.97Å; N289-F292 HydrophobicContact CB-CZ 4.22Å; N289-F292 WeakPolarHBondContact O-CD1 3.37Å; N289-F292 WeakPolarHBondContact O-CG 3.14Å; N289-F292 PolarHBondContact O-N 3.39Å; N289-F292 WeakPolarHBondContact OD1-CE1 3.39Å; N289-Y293 WeakPolarHBondContact O-CD2 3.43Å; N289-Y293 PolarHBondContact O-N 3.06Å
290L93.9Very high94.6Very high29 Ų2948.9 Ų48.915%0.15224%0.244CC..Hα-helixtrans-61.8-38.9-179.8-167.1149.7000111.2L254 T286 L287 L288 F292 Y293 L294L254-L290 HydrophobicContact CD2-CD1 3.64Å; L254-L290 HydrophobicContact CG-CD1 3.91Å; T286-L290 PolarHBondContact O-N 3.08Å; L287-L290 PolarHBondContact O-N 3.41Å; L288-L290 VanDerWaalsContact C-N 3.34Å; L290-F292 PolarHBondContact O-N 2.99Å; L290-Y293 WeakPolarHBondContact O-CB 3.39Å; L290-Y293 PolarHBondContact O-N 3.5Å; L290-Y293 VanDerWaalsContact O-N 3.17Å; L290-L294 HydrophobicContact CD2-CD1 3.77Å; L290-L294 HydrophobicContact CD2-CG 3.98Å; L290-L294 PolarHBondContact O-N 3.49Å
291Y94.8Very high94.3Very high139 Ų13946.9 Ų46.955%0.54523%0.233SC..Hα-helixtrans-60.9-43.7177.9175.3-108.6000113.2L170 L287 L288 N289 Y293 L294 R295L170-Y291 HydrophobicContact CD2-CD1 3.65Å; L170-Y291 HydrophobicContact CD2-CE1 4.17Å; L287-Y291 PolarHBondContact O-N 3.22Å; L288-Y291 PolarHBondContact O-N 3Å; N289-Y291 VanDerWaalsContact C-N 3.26Å; N289-Y291 PolarHBondContact O-N 2.63Å; Y291-Y293 VanDerWaalsContact C-N 3.27Å; Y291-Y293 PolarHBondContact O-N 3.41Å; Y291-L294 WeakPolarHBondContact O-CB 3.44Å; Y291-L294 PolarHBondContact O-N 3.49Å; Y291-L294 VanDerWaalsContact O-N 3.14Å; Y291-R295 PolarHBondContact O-N 2.99Å
292F93.3Very high94.1Very high10 Ų1049 Ų494%0.04424%0.243CC..Hα-helixtrans-69.8-26.1177.370.7-114.8000112.7L170 I178 L288 N289 L290 R295 L296L170-F292 HydrophobicContact CD2-CB 4.05Å; L170-F292 HydrophobicContact CD2-CD1 4.46Å; I178-F292 HydrophobicContact CG2-CD2 3.8Å; I178-F292 HydrophobicContact CG2-CE2 3.45Å; I178-F292 VanDerWaalsContact CG2-CE2 3.45Å; I178-F292 HydrophobicContact CG2-CZ 4.46Å; L288-F292 WeakPolarHBondContact O-CD1 3.22Å; L288-F292 PolarHBondContact O-N 2.87Å; N289-F292 HydrophobicContact CB-CE1 3.97Å; N289-F292 HydrophobicContact CB-CZ 4.22Å; N289-F292 WeakPolarHBondContact O-CD1 3.37Å; N289-F292 WeakPolarHBondContact O-CG 3.14Å; N289-F292 PolarHBondContact O-N 3.39Å; N289-F292 WeakPolarHBondContact OD1-CE1 3.39Å; L290-F292 PolarHBondContact O-N 2.99Å; F292-R295 PolarHBondContact O-N 2.79Å; F292-L296 PolarHBondContact O-N 3.21Å; F292-L296 VanDerWaalsContact O-N 3.15Å
293Y94.4Very high93.9Very high1 Ų151.8 Ų51.80%0.00426%0.261CS..Hα-helixtrans-65.4-43.2168.4-62.9-43.1000111.6I178 S182 L248 L251 N289 L290 Y291 R295 L296 I297I178-Y293 HydrophobicContact CG2-CE1 4.24Å; S182-Y293 WeakPolarHBondContact CB-OH 3.39Å; L248-Y293 HydrophobicContact CB-CD1 4.11Å; L248-Y293 HydrophobicContact CB-CG 4.22Å; L248-Y293 HydrophobicContact CD2-CD1 3.87Å; L248-Y293 HydrophobicContact CD2-CE1 3.92Å; L248-Y293 HydrophobicContact CG-CD1 4.48Å; L248-Y293 VanDerWaalsContact O-CD2 3.31Å; L248-Y293 WeakPolarHBondContact O-CD2 3.36Å; L251-Y293 HydrophobicContact CB-CE2 4.11Å; N289-Y293 WeakPolarHBondContact O-CD2 3.43Å; N289-Y293 PolarHBondContact O-N 3.06Å; L290-Y293 WeakPolarHBondContact O-CB 3.39Å; L290-Y293 PolarHBondContact O-N 3.5Å; L290-Y293 VanDerWaalsContact O-N 3.17Å; Y291-Y293 VanDerWaalsContact C-N 3.27Å; Y291-Y293 PolarHBondContact O-N 3.41Å; Y293-R295 VanDerWaalsContact C-N 3.31Å; Y293-R295 PolarHBondContact O-N 3.44Å; Y293-L296 WeakPolarHBondContact O-CB 3.42Å; Y293-L296 PolarHBondContact O-N 3.47Å; Y293-L296 VanDerWaalsContact O-N 3.08Å; Y293-I297 WeakPolarHBondContact O-CG1 3.44Å; Y293-I297 PolarHBondContact O-N 3.42Å
294L94.9Very high93.7Very high55 Ų5556 Ų5629%0.28828%0.278SS..Hα-helixtrans-58.5-42.9175.3-68.1175.2000111.7L249 L290 Y291 L296 I297 Y298L249-L294 HydrophobicContact CD2-CD2 4.15Å; L290-L294 HydrophobicContact CD2-CD1 3.77Å; L290-L294 HydrophobicContact CD2-CG 3.98Å; L290-L294 PolarHBondContact O-N 3.49Å; Y291-L294 WeakPolarHBondContact O-CB 3.44Å; Y291-L294 PolarHBondContact O-N 3.49Å; Y291-L294 VanDerWaalsContact O-N 3.14Å; L294-L296 VanDerWaalsContact C-N 3.28Å; L294-L296 PolarHBondContact O-N 2.87Å; L294-I297 PolarHBondContact O-N 3.02Å; L294-I297 VanDerWaalsContact O-N 3.17Å; L294-Y298 HydrophobicContact CB-CE2 4.37Å; L294-Y298 VanDerWaalsContact O-CD2 3.25Å; L294-Y298 WeakPolarHBondContact O-CD2 3.12Å; L294-Y298 PolarHBondContact O-N 3.19Å
295R94.4Very high93.6Very high150 Ų15054.8 Ų54.857%0.56627%0.268SS*.Hα-helixtrans-57.9-41.1174.8-172.9-179.3179.1-1722.7112.3Y291 F292 Y293 S299Y291-R295 PolarHBondContact O-N 2.99Å; F292-R295 PolarHBondContact O-N 2.79Å; Y293-R295 VanDerWaalsContact C-N 3.31Å; Y293-R295 PolarHBondContact O-N 3.44Å; R295-S299 PolarHBondContact O-N 2.8Å
296L93.7Very high93.3Very high8 Ų859.9 Ų59.94%0.04230%0.302CS..Hα-helixtrans-67.6-42.7176.6-171.2166000111.2L175 I178 T227 L230 L248 F292 Y293 L294 Y298 S299 T300L175-L296 HydrophobicContact CD2-CD1 3.66Å; L175-L296 HydrophobicContact CD2-CG 4.36Å; I178-L296 HydrophobicContact CD1-CD1 3.99Å; T227-L296 HydrophobicContact CG2-CG 4.39Å; L230-L296 HydrophobicContact CD2-CD2 3.53Å; L230-L296 HydrophobicContact CD2-CG 4.31Å; L248-L296 HydrophobicContact CD1-CD1 3.9Å; L248-L296 HydrophobicContact CD1-CD2 3.35Å; L248-L296 HydrophobicContact CD1-CG 4.14Å; F292-L296 PolarHBondContact O-N 3.21Å; F292-L296 VanDerWaalsContact O-N 3.15Å; Y293-L296 WeakPolarHBondContact O-CB 3.42Å; Y293-L296 PolarHBondContact O-N 3.47Å; Y293-L296 VanDerWaalsContact O-N 3.08Å; L294-L296 VanDerWaalsContact C-N 3.28Å; L294-L296 PolarHBondContact O-N 2.87Å; L296-Y298 VanDerWaalsContact C-N 3.34Å; L296-Y298 PolarHBondContact O-N 2.89Å; L296-S299 PolarHBondContact O-N 3.03Å; L296-S299 VanDerWaalsContact O-N 3.11Å; L296-S299 PolarHBondContact O-OG 3.1Å; L296-T300 HydrophobicContact CD2-CG2 4.07Å; L296-T300 WeakPolarHBondContact O-CG2 3.47Å; L296-T300 PolarHBondContact O-N 3.3Å; L296-T300 PolarHBondContact O-OG1 3.12Å; L296-T300 VanDerWaalsContact O-OG1 3.08Å
297I94.8Very high93.3Very high6 Ų661.9 Ų61.93%0.03131%0.311CS..Hα-helixtrans-62-42.8178.7-66.5166000110.9P245 L249 Y293 L294 S299 T300 S301 I302P245-I297 HydrophobicContact CB-CD1 4.18Å; P245-I297 HydrophobicContact CB-CG1 3.85Å; P245-I297 HydrophobicContact CB-CG2 3.95Å; P245-I297 HydrophobicContact CG-CG1 4.45Å; P245-I297 HydrophobicContact CG-CG2 4.26Å; L249-I297 HydrophobicContact CD1-CD1 4.14Å; L249-I297 HydrophobicContact CD2-CD1 3.4Å; L249-I297 VanDerWaalsContact CD2-CD1 3.4Å; L249-I297 HydrophobicContact CG-CD1 3.54Å; Y293-I297 WeakPolarHBondContact O-CG1 3.44Å; Y293-I297 PolarHBondContact O-N 3.42Å; L294-I297 PolarHBondContact O-N 3.02Å; L294-I297 VanDerWaalsContact O-N 3.17Å; I297-S299 VanDerWaalsContact C-N 3.26Å; I297-S299 PolarHBondContact O-N 3.12Å; I297-T300 WeakPolarHBondContact CA-OG1 3.3Å; I297-T300 PolarHBondContact O-N 3.08Å; I297-T300 PolarHBondContact O-OG1 2.73Å; I297-T300 VanDerWaalsContact O-OG1 3.06Å; I297-S301 PolarHBondContact O-N 3.11Å; I297-I302 HydrophobicContact CG2-CD1 3.52Å; I297-I302 HydrophobicContact CG2-CG1 3.81Å
298Y94.4Very high93.2Very high123 Ų12359.6 Ų59.648%0.48231%0.305SS..Iπ-helixtrans-58.6-39.3174.2-68.6-42.2000112.1L294 L296 T300 I302 T303L294-Y298 HydrophobicContact CB-CE2 4.37Å; L294-Y298 VanDerWaalsContact O-CD2 3.25Å; L294-Y298 WeakPolarHBondContact O-CD2 3.12Å; L294-Y298 PolarHBondContact O-N 3.19Å; L296-Y298 VanDerWaalsContact C-N 3.34Å; L296-Y298 PolarHBondContact O-N 2.89Å; Y298-T300 PolarHBondContact O-N 3.24Å; Y298-I302 HydrophobicContact CD1-CB 4.11Å; Y298-I302 HydrophobicContact CD1-CD1 3.78Å; Y298-I302 HydrophobicContact CD1-CG2 4.02Å; Y298-I302 HydrophobicContact CE1-CD1 3.74Å; Y298-I302 HydrophobicContact CE1-CG2 4.31Å; Y298-T303 WeakPolarHBondContact O-CB 3.41Å; Y298-T303 PolarHBondContact O-N 3.09Å; Y298-T303 PolarHBondContact O-OG1 3.45Å
299S92.4Very high93.2Very high26 Ų2662.4 Ų62.418%0.18232%0.32CS..Iπ-helixtrans-71.9-3.4177.273.20000115.3S231 R295 L296 I297 L305S231-S299 WeakPolarHBondContact CB-O 3.26Å; R295-S299 PolarHBondContact O-N 2.8Å; L296-S299 PolarHBondContact O-N 3.03Å; L296-S299 VanDerWaalsContact O-N 3.11Å; L296-S299 PolarHBondContact O-OG 3.1Å; I297-S299 VanDerWaalsContact C-N 3.26Å; I297-S299 PolarHBondContact O-N 3.12Å; S299-L305 WeakPolarHBondContact O-CD1 3.34Å
300T89.9Confident93.3Very high5 Ų568.4 Ų68.43%0.03135%0.352CS..Iπ-helixtrans-125.7-74.7-170.452.10000114.4L230 L296 I297 Y298L230-T300 HydrophobicContact CB-CG2 3.89Å; L230-T300 HydrophobicContact CD2-CG2 3.59Å; L230-T300 HydrophobicContact CG-CG2 3.54Å; L296-T300 HydrophobicContact CD2-CG2 4.07Å; L296-T300 WeakPolarHBondContact O-CG2 3.47Å; L296-T300 PolarHBondContact O-N 3.3Å; L296-T300 PolarHBondContact O-OG1 3.12Å; L296-T300 VanDerWaalsContact O-OG1 3.08Å; I297-T300 WeakPolarHBondContact CA-OG1 3.3Å; I297-T300 PolarHBondContact O-N 3.08Å; I297-T300 PolarHBondContact O-OG1 2.73Å; I297-T300 VanDerWaalsContact O-OG1 3.06Å; Y298-T300 PolarHBondContact O-N 3.24Å
301S90Very high93.2Very high41 Ų4167.4 Ų67.429%0.28735%0.347SS..Iπ-helixtrans-95.7-35.3-169.464.30000113.3P245 I297P245-S301 WeakPolarHBondContact CG-OG 3.14Å; I297-S301 PolarHBondContact O-N 3.11Å
302I92.8Very high93.1Very high106 Ų10666.2 Ų66.254%0.54435%0.345SS..Iπ-helixtrans-78.8-36.9-173.4-63.8178.8000111I297 Y298I297-I302 HydrophobicContact CG2-CD1 3.52Å; I297-I302 HydrophobicContact CG2-CG1 3.81Å; Y298-I302 HydrophobicContact CD1-CB 4.11Å; Y298-I302 HydrophobicContact CD1-CD1 3.78Å; Y298-I302 HydrophobicContact CD1-CG2 4.02Å; Y298-I302 HydrophobicContact CE1-CD1 3.74Å; Y298-I302 HydrophobicContact CE1-CG2 4.31Å
303T93.3Very high93.2Very high60 Ų6070.8 Ų70.837%0.36837%0.368SS..SBendtrans-116.9147.8179.577.40000111.4Y298Y298-T303 WeakPolarHBondContact O-CB 3.41Å; Y298-T303 PolarHBondContact O-N 3.09Å; Y298-T303 PolarHBondContact O-OG1 3.45Å
304L93.4Very high92.9Very high123 Ų12375.2 Ų75.264%0.64439%0.387SS*.  trans-91.2126.6174.8-57.8177000109.1W234W234-L304 HydrophobicContact CB-CD2 4.34Å; W234-L304 VanDerWaalsContact CD1-CD2 3.44Å; W234-L304 HydrophobicContact CD2-CD2 3.99Å; W234-L304 HydrophobicContact CG-CD2 3.65Å
305L93.6Very high92.7Very high62 Ų6279.5 Ų79.533%0.32540%0.399SS..  trans-104.1149.4177-72.5-180000112.1S299S299-L305 WeakPolarHBondContact O-CD1 3.34Å
306P92Very high92.6Very high126 Ų12679.1 Ų79.182%0.81840%0.404SS*.  trans-64.1141.7176.326.3-33.9000111.4
307M92.3Very high92.5Very high54 Ų5485.1 Ų85.127%0.26643%0.43SS..  trans-138.2160.7-178.2-61-167.4-158.100112.3S231 R232 N235 V311S231-M307 VanDerWaalsContact C-CE 3.46Å; S231-M307 WeakPolarHBondContact O-CE 3.4Å; R232-M307 HydrophobicContact CB-SD 4.24Å; R232-M307 HydrophobicContact CG-CE 4.41Å; R232-M307 HydrophobicContact CG-SD 3.82Å; N235-M307 HydrophobicContact CB-SD 4.16Å; N235-M307 PolarHBondContact ND2-SD 3.18Å; M307-V311 HydrophobicContact CB-CG2 4.27Å; M307-V311 HydrophobicContact SD-CG2 4.37Å
308S93.8Very high92.3Very high65 Ų6593.3 Ų93.346%0.45547%0.468SS..  trans-80.5153.4177.161.90000112.9N310 V311S308-N310 PolarHBondContact O-N 3.07Å; S308-N310 VanDerWaalsContact O-N 3.1Å; S308-V311 WeakPolarHBondContact O-CG2 3.45Å; S308-V311 PolarHBondContact O-N 3.12Å; S308-V311 VanDerWaalsContact O-N 3.11Å
309N94.4Very high92Very high117 Ų11790 Ų9063%0.62646%0.457SS*.THydrogen-bonded Turntrans-56.8-27.1179.2-78.3-25.1000113.7V311 K312N309-V311 PolarHBondContact O-N 2.94Å; N309-K312 WeakPolarHBondContact O-CB 3.22Å; N309-K312 WeakPolarHBondContact O-CG 3.37Å; N309-K312 PolarHBondContact O-N 3Å
310N93.6Very high91.9Very high130 Ų13095.3 Ų95.370%0.69549%0.489SS*.Hα-helixtrans-60.5-18.4178.9-62.6-4.1000113.3S308 K312S308-N310 PolarHBondContact O-N 3.07Å; S308-N310 VanDerWaalsContact O-N 3.1Å; N310-K312 VanDerWaalsContact C-N 3.28Å
311V91.5Very high91.8Very high9 Ų998.3 Ų98.36%0.05550%0.501CS..Hα-helixtrans-66.4-32.1174-179.30000111.3N235 M307 S308 N309 M313 K314N235-V311 HydrophobicContact CB-CG1 3.75Å; M307-V311 HydrophobicContact CB-CG2 4.27Å; M307-V311 HydrophobicContact SD-CG2 4.37Å; S308-V311 WeakPolarHBondContact O-CG2 3.45Å; S308-V311 PolarHBondContact O-N 3.12Å; S308-V311 VanDerWaalsContact O-N 3.11Å; N309-V311 PolarHBondContact O-N 2.94Å; V311-M313 PolarHBondContact O-N 3.17Å; V311-K314 WeakPolarHBondContact O-CB 3.17Å; V311-K314 PolarHBondContact O-N 3.13Å
312K92.4Very high91.4Very high114 Ų114101.9 Ų101.950%0.49652%0.523SS..Hα-helixtrans-60.8-33.4180-60.7-175.7177.2175.40112.7N309 N310 K314 W315N309-K312 WeakPolarHBondContact O-CB 3.22Å; N309-K312 WeakPolarHBondContact O-CG 3.37Å; N309-K312 PolarHBondContact O-N 3Å; N310-K312 VanDerWaalsContact C-N 3.28Å; K312-K314 PolarHBondContact O-N 3.04Å; K312-W315 HydrophobicContact CB-CD2 4.26Å; K312-W315 HydrophobicContact CB-CE3 4.03Å; K312-W315 HydrophobicContact CB-CH2 4.5Å; K312-W315 HydrophobicContact CB-CZ3 4.15Å; K312-W315 HydrophobicContact CD-CH2 4.31Å; K312-W315 HydrophobicContact CD-CZ3 4.22Å; K312-W315 HydrophobicContact CG-CD2 4.47Å; K312-W315 HydrophobicContact CG-CE3 4.15Å; K312-W315 HydrophobicContact CG-CH2 3.74Å; K312-W315 HydrophobicContact CG-CZ2 4.06Å; K312-W315 HydrophobicContact CG-CZ3 3.78Å; K312-W315 VanDerWaalsContact O-CB 3.3Å; K312-W315 WeakPolarHBondContact O-CB 3.37Å; K312-W315 PolarHBondContact O-N 3.04Å; K312-W315 VanDerWaalsContact O-N 3.12Å
313M94.4Very high91Very high106 Ų10698.4 Ų98.452%0.52251%0.507SS..Hα-helixtrans-59.5-33.4175-171.167.1-164.700112V311 W315 Q316 F317V311-M313 PolarHBondContact O-N 3.17Å; M313-W315 PolarHBondContact O-N 3.14Å; M313-Q316 PolarHBondContact O-N 2.96Å; M313-F317 HydrophobicContact CE-CE2 3.69Å; M313-F317 HydrophobicContact CE-CZ 4.03Å; M313-F317 HydrophobicContact CG-CE2 4.43Å
314K89.9Confident90.6Very high94 Ų9499.8 Ų99.841%0.40952%0.517SS..THydrogen-bonded Turntrans-76.2-10.1-178.6-63-173.1178.4-177.60113.5V311 K312 Q316V311-K314 WeakPolarHBondContact O-CB 3.17Å; V311-K314 PolarHBondContact O-N 3.13Å; K312-K314 PolarHBondContact O-N 3.04Å; K314-Q316 VanDerWaalsContact C-N 3.27Å
315W90.8Very high90.7Very high144 Ų144101.4 Ų101.455%0.54552%0.52SS..THydrogen-bonded Turntrans-70.2-27.9176.1-60-20000112.3N235 K312 M313 F317N235-W315 VanDerWaalsContact O-CD1 3.3Å; N235-W315 PolarHBondContact O-NE1 3.03Å; K312-W315 HydrophobicContact CB-CD2 4.26Å; K312-W315 HydrophobicContact CB-CE3 4.03Å; K312-W315 HydrophobicContact CB-CH2 4.5Å; K312-W315 HydrophobicContact CB-CZ3 4.15Å; K312-W315 HydrophobicContact CD-CH2 4.31Å; K312-W315 HydrophobicContact CD-CZ3 4.22Å; K312-W315 HydrophobicContact CG-CD2 4.47Å; K312-W315 HydrophobicContact CG-CE3 4.15Å; K312-W315 HydrophobicContact CG-CH2 3.74Å; K312-W315 HydrophobicContact CG-CZ2 4.06Å; K312-W315 HydrophobicContact CG-CZ3 3.78Å; K312-W315 VanDerWaalsContact O-CB 3.3Å; K312-W315 WeakPolarHBondContact O-CB 3.37Å; K312-W315 PolarHBondContact O-N 3.04Å; K312-W315 VanDerWaalsContact O-N 3.12Å; M313-W315 PolarHBondContact O-N 3.14Å; W315-F317 VanDerWaalsContact C-N 3.29Å; W315-F317 PolarHBondContact O-N 3.18Å
316Q91.3Very high90.8Very high143 Ų14399.1 Ų99.167%0.66851%0.507SS*.SBendtrans-75.2-20.6-179.6-62.9176.3-14.800112.8M313 K314M313-Q316 PolarHBondContact O-N 2.96Å; K314-Q316 VanDerWaalsContact C-N 3.27Å
317F92.1Very high90.9Very high133 Ų13397.4 Ų97.458%0.58350%0.496SS*.SBendtrans-110.1126.7-174.8-60.2-70.1000111.6M313 W315M313-F317 HydrophobicContact CE-CE2 3.69Å; M313-F317 HydrophobicContact CE-CZ 4.03Å; M313-F317 HydrophobicContact CG-CE2 4.43Å; W315-F317 VanDerWaalsContact C-N 3.29Å; W315-F317 PolarHBondContact O-N 3.18Å
318E90.1Very high91.1Very high179 Ų17998.6 Ų98.684%0.83651%0.507SS*.  trans-77.4165.4172.7-64.1-171.117000112.7
319H87.8Confident91.3Very high52 Ų5297 Ų9724%0.24149%0.493CS..  trans-85.3122.5-179.7-80.1-111.3000111.8L221 K236 L237L221-H319 PolarHBondContact O-CE1 3.16Å; L221-H319 PolarHBondContact O-ND1 3.36Å; K236-H319 WeakPolarHBondContact CD-NE2 3.42Å; K236-H319 WeakPolarHBondContact CE-NE2 3.3Å; K236-H319 PolarHBondContact NZ-CE1 3.44Å; K236-H319 PolarHBondContact NZ-NE2 2.96Å; L237-H319 WeakPolarHBondContact CD1-CE1 3.32Å; L237-H319 VanDerWaalsContact CD1-NE2 3.27Å; L237-H319 WeakPolarHBondContact CD1-NE2 3.48Å; L237-H319 VanDerWaalsContact CG-NE2 3.34Å; L237-H319 WeakPolarHBondContact CG-NE2 3.47Å
320T90.6Very high91.3Very high139 Ų13992.6 Ų92.685%0.85347%0.469SS*.  trans-107.415.7176.855.30000113.6
321K86.9Confident91.5Very high68 Ų6888.5 Ų88.530%0.29645%0.453SS..  trans-74137.2-175.3-71.6-177.9-177.8166.10111.1N220 L221 S223 T323N220-K321 WeakPolarHBondContact O-CD 3.49Å; N220-K321 WeakPolarHBondContact O-CE 3.16Å; N220-K321 PolarHBondContact O-NZ 2.92Å; L221-K321 HydrophobicContact CD2-CB 4.31Å; L221-K321 PolarHBondContact O-NZ 3.2Å; S223-K321 PolarHBondContact OG-NZ 3.05Å; K321-T323 PolarHBondContact O-N 3.08Å
322P81.4Confident91.7Very high115 Ų11591.6 Ų91.675%0.74747%0.469SS*.  trans-72.4115.2177.729.2-32.9000109.9
323T85.8Confident91.9Very high34 Ų3486.1 Ų86.121%0.20945%0.445CS..  trans-134.667.9171.6540000110.8L217 L221 K321 L326L217-T323 HydrophobicContact CD2-CG2 4.5Å; L221-T323 HydrophobicContact CD1-CG2 4.43Å; L221-T323 HydrophobicContact CD2-CG2 3.45Å; L221-T323 VanDerWaalsContact CD2-CG2 3.45Å; L221-T323 HydrophobicContact CG-CG2 3.75Å; K321-T323 PolarHBondContact O-N 3.08Å; T323-L326 HydrophobicContact CG2-CD1 4.39Å
324P85.3Confident91.9Very high89 Ų8982.8 Ų82.858%0.57843%0.431SS*.THydrogen-bonded Turntrans-60.3145.7172.129.5-34.6000109.4L326P324-L326 PolarHBondContact O-N 3.18Å
325F94.9Very high92.1Very high157 Ų15784.3 Ų84.369%0.68944%0.443SS*.THydrogen-bonded Turntrans63.70.5177.7-51.2-73.6000117.6T328 L329F325-T328 PolarHBondContact O-N 3.11Å; F325-T328 PolarHBondContact O-OG1 3.49Å; F325-L329 WeakPolarHBondContact O-CB 3.41Å; F325-L329 VanDerWaalsContact O-CG 3.28Å; F325-L329 WeakPolarHBondContact O-CG 2.96Å; F325-L329 PolarHBondContact O-N 2.97Å
326L95.1Very high92.3Very high13 Ų1378.1 Ų78.17%0.06842%0.42CS..Hα-helixtrans-59-44.9178.6173.9140.4000113.4L217 L218 L221 T323 P324 T328 L329 I330L217-L326 HydrophobicContact CB-CD1 3.56Å; L217-L326 HydrophobicContact CD1-CB 4.38Å; L218-L326 HydrophobicContact CD2-CD1 4.16Å; L218-L326 HydrophobicContact CG-CD1 4.29Å; L221-L326 HydrophobicContact CD1-CD1 3.64Å; L221-L326 HydrophobicContact CD1-CD2 4.12Å; L221-L326 HydrophobicContact CG-CD1 4.35Å; T323-L326 HydrophobicContact CG2-CD1 4.39Å; P324-L326 PolarHBondContact O-N 3.18Å; L326-T328 PolarHBondContact O-N 3.45Å; L326-L329 PolarHBondContact O-N 2.59Å; L326-I330 HydrophobicContact CD2-CD1 3.44Å; L326-I330 VanDerWaalsContact CD2-CD1 3.44Å; L326-I330 HydrophobicContact CG-CD1 3.87Å; L326-I330 VanDerWaalsContact O-CG1 3.32Å; L326-I330 WeakPolarHBondContact O-CG1 3.49Å; L326-I330 PolarHBondContact O-N 3.02Å
327P94.9Very high92.4Very high90 Ų9073.3 Ų73.358%0.58440%0.399SS*.Hα-helixtrans-62.5-42.1179-24.235.1000113.3I330 A331P327-I330 PolarHBondContact O-N 3.38Å; P327-A331 PolarHBondContact O-N 2.68Å; P327-A331 VanDerWaalsContact O-N 3.08Å
328T96.3Very high92.6Very high80 Ų8072.3 Ų72.349%0.49141%0.406SS..Hα-helixtrans-65.8-41.8178.450.30000111.1F325 L326 I330 A331 L332F325-T328 PolarHBondContact O-N 3.11Å; F325-T328 PolarHBondContact O-OG1 3.49Å; L326-T328 PolarHBondContact O-N 3.45Å; T328-I330 VanDerWaalsContact C-N 3.34Å; T328-I330 PolarHBondContact O-N 3.24Å; T328-A331 WeakPolarHBondContact O-CB 3.18Å; T328-A331 PolarHBondContact O-N 3.19Å; T328-L332 WeakPolarHBondContact O-CG 3.39Å; T328-L332 PolarHBondContact O-N 3.36Å; T328-L332 VanDerWaalsContact O-N 3.13Å
329L97.1Very high92.8Very high32 Ų3268.1 Ų68.117%0.16839%0.388CS..Hα-helixtrans-63.8-39.7176.3-69.3169.8000111.6I210 T214 L217 F325 L326 A331 L332 T333I210-L329 HydrophobicContact CG2-CD2 4.15Å; T214-L329 HydrophobicContact CG2-CB 3.29Å; T214-L329 HydrophobicContact CG2-CD1 4.4Å; T214-L329 HydrophobicContact CG2-CG 4.41Å; L217-L329 HydrophobicContact CD1-CD1 4.06Å; F325-L329 WeakPolarHBondContact O-CB 3.41Å; F325-L329 VanDerWaalsContact O-CG 3.28Å; F325-L329 WeakPolarHBondContact O-CG 2.96Å; F325-L329 PolarHBondContact O-N 2.97Å; L326-L329 PolarHBondContact O-N 2.59Å; L329-A331 VanDerWaalsContact C-N 3.35Å; L329-A331 PolarHBondContact O-N 2.86Å; L329-L332 CarbonylContact O-C 3.55Å; L329-L332 WeakPolarHBondContact O-CB 3.44Å; L329-L332 PolarHBondContact O-N 3.06Å; L329-L332 VanDerWaalsContact O-N 3.14Å; L329-T333 VanDerWaalsContact O-CG2 3.28Å; L329-T333 WeakPolarHBondContact O-CG2 3.49Å; L329-T333 PolarHBondContact O-N 2.98Å
330I96Very high93.1Very high24 Ų2466.9 Ų66.912%0.12339%0.386CS..Hα-helixtrans-59.2-46.2174.9-72.4162000110.9T214 L218 L243 L326 P327 T328 L332 T333T214-I330 HydrophobicContact CG2-CG1 4.44Å; L218-I330 HydrophobicContact CD2-CD1 4.49Å; L243-I330 HydrophobicContact CD1-CD1 3.84Å; L243-I330 HydrophobicContact CD2-CD1 4.16Å; L243-I330 HydrophobicContact CD2-CG2 3.67Å; L243-I330 HydrophobicContact CG-CD1 4.5Å; L326-I330 HydrophobicContact CD2-CD1 3.44Å; L326-I330 VanDerWaalsContact CD2-CD1 3.44Å; L326-I330 HydrophobicContact CG-CD1 3.87Å; L326-I330 VanDerWaalsContact O-CG1 3.32Å; L326-I330 WeakPolarHBondContact O-CG1 3.49Å; L326-I330 PolarHBondContact O-N 3.02Å; P327-I330 PolarHBondContact O-N 3.38Å; T328-I330 VanDerWaalsContact C-N 3.34Å; T328-I330 PolarHBondContact O-N 3.24Å; I330-L332 PolarHBondContact O-N 3.3Å; I330-T333 PolarHBondContact O-N 3.38Å; I330-T333 PolarHBondContact O-OG1 3.08Å
331A96.1Very high93.2Very high44 Ų4464.5 Ų64.536%0.36437%0.372SS..Hα-helixtrans-55.9-41.7176.200000111.3P327 T328 L329 T333 T334 L335P327-A331 PolarHBondContact O-N 2.68Å; P327-A331 VanDerWaalsContact O-N 3.08Å; T328-A331 WeakPolarHBondContact O-CB 3.18Å; T328-A331 PolarHBondContact O-N 3.19Å; L329-A331 VanDerWaalsContact C-N 3.35Å; L329-A331 PolarHBondContact O-N 2.86Å; A331-T333 VanDerWaalsContact C-N 3.31Å; A331-T333 PolarHBondContact O-N 3.49Å; A331-T334 PolarHBondContact O-N 3.16Å; A331-L335 WeakPolarHBondContact O-CB 3.39Å; A331-L335 PolarHBondContact O-N 3.45Å
332L96.6Very high93.7Very high73 Ų7367.7 Ų67.738%0.38239%0.386SS..Hα-helixtrans-70.8-18.2176.5-62.6169.8000114.2I210 T258 T328 L329 I330 L336I210-L332 HydrophobicContact CG2-CB 4.01Å; T258-L332 WeakPolarHBondContact CG2-O 3.26Å; T328-L332 WeakPolarHBondContact O-CG 3.39Å; T328-L332 PolarHBondContact O-N 3.36Å; T328-L332 VanDerWaalsContact O-N 3.13Å; L329-L332 CarbonylContact O-C 3.55Å; L329-L332 WeakPolarHBondContact O-CB 3.44Å; L329-L332 PolarHBondContact O-N 3.06Å; L329-L332 VanDerWaalsContact O-N 3.14Å; I330-L332 PolarHBondContact O-N 3.3Å; L332-L336 HydrophobicContact CB-CD1 4.3Å; L332-L336 HydrophobicContact CD2-CD1 3.83Å
333T95.9Very high94.3Very high0 Ų063.2 Ų63.20%036%0.356CS..Hα-helixtrans-81.1-14.9176.963.20000114.7I210 L211 T214 T247 T258 L329 I330 A331I210-T333 HydrophobicContact CG2-CG2 4.09Å; L211-T333 HydrophobicContact CD2-CG2 3.68Å; T214-T333 HydrophobicContact CG2-CG2 3.65Å; T214-T333 WeakPolarHBondContact OG1-CG2 3.45Å; T247-T333 HydrophobicContact CG2-CG2 4.33Å; T258-T333 WeakPolarHBondContact CG2-O 3.43Å; T258-T333 VanDerWaalsContact OG1-C 3.28Å; T258-T333 PolarHBondContact OG1-O 2.86Å; L329-T333 VanDerWaalsContact O-CG2 3.28Å; L329-T333 WeakPolarHBondContact O-CG2 3.49Å; L329-T333 PolarHBondContact O-N 2.98Å; I330-T333 PolarHBondContact O-N 3.38Å; I330-T333 PolarHBondContact O-OG1 3.08Å; A331-T333 VanDerWaalsContact C-N 3.31Å; A331-T333 PolarHBondContact O-N 3.49Å
334T93.9Very high94.6Very high35 Ų3564.3 Ų64.322%0.21536%0.36CS..Hα-helixtrans-127.6-48.5-174.358.40000112.5L257 T258 A331 L336L257-T334 HydrophobicContact CD2-CG2 3.91Å; T258-T334 WeakPolarHBondContact CG2-O 3.49Å; A331-T334 PolarHBondContact O-N 3.16Å; T334-L336 VanDerWaalsContact C-N 3.35Å; T334-L336 PolarHBondContact O-N 3.4Å
335L95.4Very high95Very high126 Ų12667.2 Ų67.266%0.6637%0.368SS*.THydrogen-bonded Turntrans-87.10.4-168.3-60.9173.4000114.5A331 P338A331-L335 WeakPolarHBondContact O-CB 3.39Å; A331-L335 PolarHBondContact O-N 3.45Å; L335-P338 WeakPolarHBondContact O-CD 3.4Å
336L94.8Very high94.8Very high14 Ų1464.5 Ų64.57%0.07336%0.359CS..THydrogen-bonded Turntrans-83.3-16.9-173-178.3158.6000113.4T258 L261 L332 T334 I339 M343T258-L336 HydrophobicContact CG2-CB 3.57Å; L261-L336 HydrophobicContact CD1-CD2 4.25Å; L332-L336 HydrophobicContact CB-CD1 4.3Å; L332-L336 HydrophobicContact CD2-CD1 3.83Å; T334-L336 VanDerWaalsContact C-N 3.35Å; T334-L336 PolarHBondContact O-N 3.4Å; L336-I339 PolarHBondContact O-N 3.48Å; L336-I339 VanDerWaalsContact O-N 3.08Å; L336-M343 HydrophobicContact CD1-CE 4.15Å; L336-M343 HydrophobicContact CD1-SD 3.86Å; L336-M343 HydrophobicContact CD2-CE 4.03Å; L336-M343 HydrophobicContact CD2-CG 3.51Å; L336-M343 HydrophobicContact CD2-SD 3.75Å; L336-M343 HydrophobicContact CG-CG 4.16Å; L336-M343 HydrophobicContact CG-SD 3.95Å
337L94.3Very high93.7Very high43 Ų4368.8 Ų68.823%0.22538%0.382CS..G310 helixtrans-56.6-43.4-176-176.974.1000114.7P255 F260 L261 I339 S340P255-L337 WeakPolarHBondContact O-CD2 3.33Å; F260-L337 HydrophobicContact CD1-CD1 4.37Å; L261-L337 HydrophobicContact CB-CD1 4.19Å; L337-I339 PolarHBondContact O-N 2.96Å; L337-I339 VanDerWaalsContact O-N 3.09Å; L337-S340 WeakPolarHBondContact O-CB 3.13Å; L337-S340 PolarHBondContact O-N 3.25Å
338P95.4Very high93.6Very high111 Ų11167.8 Ų67.872%0.72137%0.372SS*.G310 helixtrans-63.7-15.3179.4-22.435.4000114.2L335 S340L335-P338 WeakPolarHBondContact O-CD 3.4Å; P338-S340 VanDerWaalsContact C-N 3.28Å
339I95.3Very high93.5Very high91 Ų9167.1 Ų67.147%0.46737%0.366SS..G310 helixtrans-9825.4-177.8-54.2163.5000109.7L336 L337 F342 M343L336-I339 PolarHBondContact O-N 3.48Å; L336-I339 VanDerWaalsContact O-N 3.08Å; L337-I339 PolarHBondContact O-N 2.96Å; L337-I339 VanDerWaalsContact O-N 3.09Å; I339-F342 HydrophobicContact CG2-CB 3.54Å; I339-F342 HydrophobicContact CG2-CD1 3.71Å; I339-F342 HydrophobicContact CG2-CG 3.93Å; I339-F342 PolarHBondContact O-N 2.7Å; I339-M343 PolarHBondContact O-N 3.06Å; I339-M343 VanDerWaalsContact O-N 3.15Å
340S93.2Very high93.3Very high27 Ų2769.1 Ų69.119%0.18938%0.377CS..Hα-helixtrans-58.4-40.8-17464.80000115.3L337 P338 F342 M343 L344L337-S340 WeakPolarHBondContact O-CB 3.13Å; L337-S340 PolarHBondContact O-N 3.25Å; P338-S340 VanDerWaalsContact C-N 3.28Å; S340-F342 VanDerWaalsContact C-N 3.3Å; S340-F342 PolarHBondContact O-N 3.27Å; S340-M343 PolarHBondContact O-N 3.36Å; S340-L344 WeakPolarHBondContact O-CG 3.3Å; S340-L344 PolarHBondContact O-N 3.34Å
341P93.4Very high93.1Very high88 Ų8871.7 Ų71.757%0.57139%0.392SS*.Hα-helixtrans-65.7-36.4-179.9-2034.8000111.9L344 M345P341-L344 PolarHBondContact O-N 3.11Å; P341-M345 WeakPolarHBondContact O-CG 3.49Å; P341-M345 PolarHBondContact O-N 2.9Å
342F95.9Very high92.9Very high135 Ų13573.4 Ų73.459%0.59239%0.393SS*.Hα-helixtrans-64.8-43.9176174.3-98.8000111I339 S340 L344 M345 I346I339-F342 HydrophobicContact CG2-CB 3.54Å; I339-F342 HydrophobicContact CG2-CD1 3.71Å; I339-F342 HydrophobicContact CG2-CG 3.93Å; I339-F342 PolarHBondContact O-N 2.7Å; S340-F342 VanDerWaalsContact C-N 3.3Å; S340-F342 PolarHBondContact O-N 3.27Å; F342-L344 VanDerWaalsContact C-N 3.29Å; F342-L344 PolarHBondContact O-N 2.94Å; F342-M345 PolarHBondContact O-N 3.03Å; F342-I346 HydrophobicContact CD1-CD1 3.96Å; F342-I346 HydrophobicContact CD1-CG1 4.23Å; F342-I346 HydrophobicContact CE1-CD1 3.63Å; F342-I346 HydrophobicContact CE1-CG1 3.92Å; F342-I346 HydrophobicContact CZ-CD1 4.35Å; F342-I346 HydrophobicContact CZ-CG1 4.21Å; F342-I346 WeakPolarHBondContact O-CG1 3.46Å; F342-I346 PolarHBondContact O-N 3.11Å
343M95Very high92.7Very high22 Ų2273.5 Ų73.511%0.10839%0.394CS..Hα-helixtrans-60.5-36.5179.5-70.5-64.4-55.200113.7L203 L261 L336 I339 S340 M345 I346L203-M343 HydrophobicContact CD1-CB 4.31Å; L203-M343 HydrophobicContact CD1-CE 4.47Å; L261-M343 HydrophobicContact CD1-CB 4.22Å; L261-M343 HydrophobicContact CD1-CG 4.37Å; L336-M343 HydrophobicContact CD1-CE 4.15Å; L336-M343 HydrophobicContact CD1-SD 3.86Å; L336-M343 HydrophobicContact CD2-CE 4.03Å; L336-M343 HydrophobicContact CD2-CG 3.51Å; L336-M343 HydrophobicContact CD2-SD 3.75Å; L336-M343 HydrophobicContact CG-CG 4.16Å; L336-M343 HydrophobicContact CG-SD 3.95Å; I339-M343 PolarHBondContact O-N 3.06Å; I339-M343 VanDerWaalsContact O-N 3.15Å; S340-M343 PolarHBondContact O-N 3.36Å; M343-M345 PolarHBondContact O-N 3.34Å; M343-I346 HydrophobicContact CE-CD1 4.18Å; M343-I346 HydrophobicContact SD-CD1 3.64Å
344L92.9Very high92.4Very high57 Ų5778.7 Ų78.730%0.29842%0.422SS..Hα-helixtrans-67.5-25.5177.4-65.9170.2000112.6M200 L203 A265 S340 P341 F342M200-L344 HydrophobicContact CE-CD2 3.9Å; M200-L344 HydrophobicContact SD-CD2 3.74Å; L203-L344 HydrophobicContact CD2-CD2 3.59Å; A265-L344 HydrophobicContact CB-CD2 4.19Å; S340-L344 WeakPolarHBondContact O-CG 3.3Å; S340-L344 PolarHBondContact O-N 3.34Å; P341-L344 PolarHBondContact O-N 3.11Å; F342-L344 VanDerWaalsContact C-N 3.29Å; F342-L344 PolarHBondContact O-N 2.94Å
345M93Very high92.3Very high149 Ų14982.1 Ų82.173%0.73444%0.438SS*.THydrogen-bonded Turntrans-100.7-0.2-175.4-61.9-62.3-64.500114.2P341 F342 M343 L347P341-M345 WeakPolarHBondContact O-CG 3.49Å; P341-M345 PolarHBondContact O-N 2.9Å; F342-M345 PolarHBondContact O-N 3.03Å; M343-M345 PolarHBondContact O-N 3.34Å; M345-L347 PolarHBondContact O-N 3.1Å
346I90.6Very high92.1Very high100 Ų10078.4 Ų78.451%0.51342%0.42SS..  trans-66.2-24.8175.1-71170.4000111.2F342 M343F342-I346 HydrophobicContact CD1-CD1 3.96Å; F342-I346 HydrophobicContact CD1-CG1 4.23Å; F342-I346 HydrophobicContact CE1-CD1 3.63Å; F342-I346 HydrophobicContact CE1-CG1 3.92Å; F342-I346 HydrophobicContact CZ-CD1 4.35Å; F342-I346 HydrophobicContact CZ-CG1 4.21Å; F342-I346 WeakPolarHBondContact O-CG1 3.46Å; F342-I346 PolarHBondContact O-N 3.11Å; M343-I346 HydrophobicContact CE-CD1 4.18Å; M343-I346 HydrophobicContact SD-CD1 3.64Å
347L71.1Confident91.8Very high104 Ų10484.3 Ų84.355%0.54545%0.451SS..  trans-99.60170.8-61.1167.2000108.8N199 I202 M345N199-L347 WeakPolarHBondContact O-CD1 3.47Å; I202-L347 HydrophobicContact CB-CD1 3.59Å; I202-L347 HydrophobicContact CB-CD2 4.42Å; I202-L347 HydrophobicContact CD1-CD2 4.45Å; I202-L347 HydrophobicContact CG2-CD1 3.57Å; I202-L347 HydrophobicContact CG2-CD2 3.66Å; I202-L347 HydrophobicContact CG2-CG 4.23Å; M345-L347 PolarHBondContact O-N 3.1Å

Retrieved 347 of 347 residues in 680.3 ms (Link to these results)

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