A0A077Z5D9_TRITR Loading...

DUF1751 domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z5D9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 345 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
1M61.7Low65.7Low191 Ų191124.6 Ų124.694%0.94162%0.618SS**  0-58.80-135.6-177.5-93.900113.3Q3 Q4 L5M1-Q3 PolarHBondContact O-N 2.97Å; M1-Q4 PolarHBondContact O-N 3.5Å; M1-L5 PolarHBondContact O-N 3.27Å; M1-L5 VanDerWaalsContact O-N 3.08Å
2R72.1Confident64.9Low222 Ų222122.2 Ų122.284%0.83861%0.608SS**Hα-helixtrans-57.5-45.9179.8-75-173.4-178.6-174.50.9114.5Q4 L5 V6R2-Q4 PolarHBondContact O-N 3.39Å; R2-L5 PolarHBondContact O-N 3.37Å; R2-V6 WeakPolarHBondContact O-CG2 3.38Å; R2-V6 PolarHBondContact O-N 3.4Å
3Q70.2Confident64.2Low160 Ų160128.5 Ų128.575%0.74862%0.62SS**Hα-helixtrans-64-38.2178.5-84.3173.3-22.300113.3M1 V6 N7M1-Q3 PolarHBondContact O-N 2.97Å; Q3-V6 PolarHBondContact O-N 3.49Å; Q3-N7 WeakPolarHBondContact O-CB 3.42Å; Q3-N7 PolarHBondContact O-N 3.47Å; Q3-N7 PolarHBondContact O-OD1 3.4Å
4Q72Confident63.7Low136 Ų136127.6 Ų127.664%0.63663%0.627SS**Hα-helixtrans-64.1-43.6174.3-74.6171.6-42.600110.8M1 R2 V6 N7 T8M1-Q4 PolarHBondContact O-N 3.5Å; R2-Q4 PolarHBondContact O-N 3.39Å; Q4-V6 PolarHBondContact O-N 3.19Å; Q4-N7 PolarHBondContact O-N 3.16Å; Q4-T8 WeakPolarHBondContact O-CB 3.32Å; Q4-T8 PolarHBondContact O-N 3.06Å; Q4-T8 PolarHBondContact O-OG1 3.19Å
5L65.4Low64Low104 Ų104123.9 Ų123.955%0.54563%0.625SS.*Hα-helixtrans-61.1-45.2176.4-125.7164.4000111.5M1 R2 T8 L9M1-L5 PolarHBondContact O-N 3.27Å; M1-L5 VanDerWaalsContact O-N 3.08Å; R2-L5 PolarHBondContact O-N 3.37Å; L5-T8 PolarHBondContact O-N 3.47Å; L5-L9 HydrophobicContact CD2-CD1 3.67Å; L5-L9 HydrophobicContact CD2-CG 4.04Å; L5-L9 VanDerWaalsContact O-CB 3.3Å; L5-L9 WeakPolarHBondContact O-CB 3.43Å; L5-L9 WeakPolarHBondContact O-CG 3.38Å; L5-L9 PolarHBondContact O-N 3.45Å
6V74.4Confident64.8Low92 Ų92118.8 Ų118.856%0.55860%0.6SS**Hα-helixtrans-63.2-42176.2172.90000111.7R2 Q3 Q4 L9 S10R2-V6 WeakPolarHBondContact O-CG2 3.38Å; R2-V6 PolarHBondContact O-N 3.4Å; Q3-V6 PolarHBondContact O-N 3.49Å; Q4-V6 PolarHBondContact O-N 3.19Å; V6-L9 PolarHBondContact O-N 3.48Å; V6-S10 VanDerWaalsContact O-CB 3.25Å; V6-S10 WeakPolarHBondContact O-CB 3.34Å; V6-S10 PolarHBondContact O-N 3.42Å; V6-S10 PolarHBondContact O-OG 2.99Å
7N69.8Low65.9Low92 Ų92112.7 Ų112.749%0.49257%0.571SS.*Hα-helixtrans-69.2-38.2178.6-70-4.7000112.2Q3 Q4 S10 H11Q3-N7 WeakPolarHBondContact O-CB 3.42Å; Q3-N7 PolarHBondContact O-N 3.47Å; Q3-N7 PolarHBondContact O-OD1 3.4Å; Q4-N7 PolarHBondContact O-N 3.16Å; N7-S10 WeakPolarHBondContact CA-OG 3.43Å; N7-S10 PolarHBondContact O-N 3.4Å; N7-S10 PolarHBondContact O-OG 3.46Å; N7-H11 WeakPolarHBondContact O-CB 3.37Å; N7-H11 PolarHBondContact O-CD2 3.33Å; N7-H11 VanDerWaalsContact O-CD2 3.29Å; N7-H11 PolarHBondContact O-N 3.39Å
8T65.3Low67.1Low85 Ų85110.9 Ų110.952%0.52157%0.568SS.*Hα-helixtrans-68.4-44.1177.2-370000109.6Q4 L5 S10 H11 L12Q4-T8 WeakPolarHBondContact O-CB 3.32Å; Q4-T8 PolarHBondContact O-N 3.06Å; Q4-T8 PolarHBondContact O-OG1 3.19Å; L5-T8 PolarHBondContact O-N 3.47Å; T8-S10 PolarHBondContact O-N 3.18Å; T8-H11 PolarHBondContact O-N 3.45Å; T8-L12 HydrophobicContact CG2-CD1 4.35Å; T8-L12 WeakPolarHBondContact O-CB 3.27Å; T8-L12 WeakPolarHBondContact O-CD1 3.27Å; T8-L12 WeakPolarHBondContact O-CG 3.37Å; T8-L12 PolarHBondContact O-N 3.11Å
9L55.8Low68.3Low99 Ų99106.9 Ų106.952%0.51855%0.546SS..Hα-helixtrans-65.8-36.2175.3-71.3172.1000112.6L5 V6 R13L5-L9 HydrophobicContact CD2-CD1 3.67Å; L5-L9 HydrophobicContact CD2-CG 4.04Å; L5-L9 VanDerWaalsContact O-CB 3.3Å; L5-L9 WeakPolarHBondContact O-CB 3.43Å; L5-L9 WeakPolarHBondContact O-CG 3.38Å; L5-L9 PolarHBondContact O-N 3.45Å; V6-L9 PolarHBondContact O-N 3.48Å; L9-R13 WeakPolarHBondContact O-CB 3.41Å; L9-R13 PolarHBondContact O-N 3.46Å
10S58.9Low69.4Low51 Ų51101.9 Ų101.936%0.35752%0.52SS..Hα-helixtrans-70.4-42.3177.6690000111.5V6 N7 T8 R13 T14V6-S10 VanDerWaalsContact O-CB 3.25Å; V6-S10 WeakPolarHBondContact O-CB 3.34Å; V6-S10 PolarHBondContact O-N 3.42Å; V6-S10 PolarHBondContact O-OG 2.99Å; N7-S10 WeakPolarHBondContact CA-OG 3.43Å; N7-S10 PolarHBondContact O-N 3.4Å; N7-S10 PolarHBondContact O-OG 3.46Å; T8-S10 PolarHBondContact O-N 3.18Å; S10-R13 PolarHBondContact O-N 3.24Å; S10-T14 PolarHBondContact O-N 3.45Å; S10-T14 PolarHBondContact O-OG1 3.02Å
11H56.9Low70.5Confident139 Ų139103.3 Ų103.364%0.64452%0.519SS*.Hα-helixtrans-61.6-42.7171.7-90.8-77.4000112N7 T8 R13 T14 A15N7-H11 WeakPolarHBondContact O-CB 3.37Å; N7-H11 PolarHBondContact O-CD2 3.33Å; N7-H11 VanDerWaalsContact O-CD2 3.29Å; N7-H11 PolarHBondContact O-N 3.39Å; T8-H11 PolarHBondContact O-N 3.45Å; H11-R13 VanDerWaalsContact C-N 3.34Å; H11-R13 PolarHBondContact O-N 3.38Å; H11-T14 PolarHBondContact O-OG1 3.21Å; H11-A15 WeakPolarHBondContact O-CB 3.5Å; H11-A15 PolarHBondContact O-N 3.33Å
12L56.2Low72Confident95 Ų9598.6 Ų98.650%0.49750%0.501SS..Hα-helixtrans-64.2-38.9174.2-70.4168.3000111.7T8 A15 L16T8-L12 HydrophobicContact CG2-CD1 4.35Å; T8-L12 WeakPolarHBondContact O-CB 3.27Å; T8-L12 WeakPolarHBondContact O-CD1 3.27Å; T8-L12 WeakPolarHBondContact O-CG 3.37Å; T8-L12 PolarHBondContact O-N 3.11Å; L12-A15 PolarHBondContact O-N 3.22Å; L12-L16 WeakPolarHBondContact O-CD1 3.45Å; L12-L16 PolarHBondContact O-N 3.32Å
13R55.8Low73.1Confident204 Ų20488 Ų8877%0.7746%0.461SS*.Hα-helixtrans-69.8-37.9-179.9-176.7177.4-178.8177.11.1112.9L9 S10 H11L9-R13 WeakPolarHBondContact O-CB 3.41Å; L9-R13 PolarHBondContact O-N 3.46Å; S10-R13 PolarHBondContact O-N 3.24Å; H11-R13 VanDerWaalsContact C-N 3.34Å; H11-R13 PolarHBondContact O-N 3.38Å
14T57.3Low74.2Confident117 Ų11782.4 Ų82.472%0.71843%0.434SS*.Hα-helixtrans-78.4-23.6174.4500000112.3S10 H11S10-T14 PolarHBondContact O-N 3.45Å; S10-T14 PolarHBondContact O-OG1 3.02Å; H11-T14 PolarHBondContact O-OG1 3.21Å
15A67.6Low75.4Confident72 Ų7281 Ų8160%0.59543%0.431SS*.Hα-helixtrans-76.8-27.1178.600000114.4H11 L12 S17H11-A15 WeakPolarHBondContact O-CB 3.5Å; H11-A15 PolarHBondContact O-N 3.33Å; L12-A15 PolarHBondContact O-N 3.22Å; A15-S17 PolarHBondContact O-N 3.3Å
16L77.5Confident76.8Confident42 Ų4276.6 Ų76.622%0.2241%0.409CS..SBendtrans-77.3121.1-178.8-101.872.9000112.3L12 H20 R21L12-L16 WeakPolarHBondContact O-CD1 3.45Å; L12-L16 PolarHBondContact O-N 3.32Å; L16-H20 HydrophobicContact CD2-CB 4.26Å; L16-H20 HydrophobicContact CG-CB 4.25Å; L16-R21 HydrophobicContact CB-CG 4.45Å; L16-R21 PolarHBondContact O-NE 3.14Å; L16-R21 PolarHBondContact O-NH2 3.03Å; L16-R21 VanDerWaalsContact O-NH2 3.16Å
17S82.9Confident77.8Confident15 Ų1572.2 Ų72.211%0.10538%0.383CS..  trans-63.8154179.798.30000112.4A15 F19 H20 R21 E87A15-S17 PolarHBondContact O-N 3.3Å; S17-F19 PolarHBondContact O-N 3.43Å; S17-H20 WeakPolarHBondContact O-CB 3.3Å; S17-H20 PolarHBondContact O-N 3.47Å; S17-H20 VanDerWaalsContact O-N 3.15Å; S17-H20 PolarHBondContact OG-CE1 3.38Å; S17-H20 PolarHBondContact OG-ND1 3.13Å; S17-R21 PolarHBondContact O-N 2.79Å; S17-E87 VanDerWaalsContact CB-CD 3.45Å; S17-E87 WeakPolarHBondContact CB-OE1 3.16Å; S17-E87 WeakPolarHBondContact CB-OE2 3.17Å; S17-E87 PolarHBondContact OG-OE1 2.9Å; S17-E87 PolarHBondContact OG-OE2 2.92Å
18P88.1Confident79.1Confident81 Ų8170.5 Ų70.553%0.52638%0.377SS..Hα-helixtrans-53.5-36.9-179.3-26.634.9000113R21 V22P18-R21 PolarHBondContact O-N 3.11Å; P18-V22 WeakPolarHBondContact O-CG2 3.26Å; P18-V22 PolarHBondContact O-N 3.33Å
19F89.7Confident80.5Confident35 Ų3570.5 Ų70.515%0.15437%0.373CS..Hα-helixtrans-70.3-36.8-179.7-176.6-112.1000113.5S17 R21 V22 T23 F83 V95 Y96 F99S17-F19 PolarHBondContact O-N 3.43Å; F19-R21 VanDerWaalsContact C-N 3.26Å; F19-R21 PolarHBondContact O-N 3.45Å; F19-V22 PolarHBondContact O-N 3.26Å; F19-T23 HydrophobicContact CD1-CG2 4.3Å; F19-T23 HydrophobicContact CD2-CG2 4.27Å; F19-T23 HydrophobicContact CE1-CG2 4.01Å; F19-T23 HydrophobicContact CE2-CG2 3.94Å; F19-T23 HydrophobicContact CG-CG2 4.44Å; F19-T23 HydrophobicContact CZ-CG2 3.8Å; F19-T23 WeakPolarHBondContact O-CB 3.26Å; F19-T23 WeakPolarHBondContact O-CG2 3.41Å; F19-T23 PolarHBondContact O-N 3.4Å; F19-T23 PolarHBondContact O-OG1 2.96Å; F19-F83 HydrophobicContact CD1-CE1 4.15Å; F19-F83 AromaticContact CD1-CE2 3.82Å; F19-F83 HydrophobicContact CD1-CE2 3.82Å; F19-F83 AromaticContact CD1-CZ 3.57Å; F19-F83 HydrophobicContact CD1-CZ 3.57Å; F19-F83 AromaticContact CE1-CE1 3.72Å; F19-F83 HydrophobicContact CE1-CE1 3.72Å; F19-F83 AromaticContact CE1-CE2 3.93Å; F19-F83 HydrophobicContact CE1-CE2 3.93Å; F19-F83 AromaticContact CE1-CZ 3.21Å; F19-F83 HydrophobicContact CE1-CZ 3.21Å; F19-F83 HydrophobicContact CZ-CZ 4.27Å; F19-V95 HydrophobicContact CE1-CG1 4.37Å; F19-Y96 HydrophobicContact CB-CD1 3.73Å; F19-Y96 HydrophobicContact CB-CE1 3.04Å; F19-Y96 HydrophobicContact CB-CE2 4.45Å; F19-Y96 VanDerWaalsContact CB-CZ 3.44Å; F19-Y96 WeakPolarHBondContact CB-OH 3.36Å; F19-Y96 AromaticContact CD1-CD1 3.26Å; F19-Y96 HydrophobicContact CD1-CD1 3.26Å; F19-Y96 AromaticContact CD1-CE1 3.41Å; F19-Y96 HydrophobicContact CD1-CE1 3.41Å; F19-Y96 VanDerWaalsContact CD1-CE1 3.41Å; F19-Y96 HydrophobicContact CD1-CG 4.39Å; F19-Y96 AromaticContact CD2-CD1 3.67Å; F19-Y96 HydrophobicContact CD2-CD1 3.67Å; F19-Y96 AromaticContact CD2-CE1 3.9Å; F19-Y96 HydrophobicContact CD2-CE1 3.9Å; F19-Y96 HydrophobicContact CD2-CG 4.15Å; F19-Y96 AromaticContact CE1-CD1 3.61Å; F19-Y96 HydrophobicContact CE1-CD1 3.61Å; F19-Y96 HydrophobicContact CE1-CE1 4.23Å; F19-Y96 HydrophobicContact CE2-CD1 4.02Å; F19-Y96 HydrophobicContact CE2-CG 4.32Å; F19-Y96 AromaticContact CG-CD1 3.27Å; F19-Y96 HydrophobicContact CG-CD1 3.27Å; F19-Y96 AromaticContact CG-CE1 3.18Å; F19-Y96 HydrophobicContact CG-CE1 3.18Å; F19-Y96 HydrophobicContact CG-CG 4.19Å; F19-Y96 AromaticContact CG-CZ 3.95Å; F19-Y96 AromaticContact CZ-CD1 3.99Å; F19-Y96 HydrophobicContact CZ-CD1 3.99Å; F19-Y96 HydrophobicContact CZ-CG 4.49Å; F19-F99 HydrophobicContact CE1-CB 4.1Å; F19-F99 HydrophobicContact CE1-CG 4.14Å; F19-F99 HydrophobicContact CZ-CB 3.9Å; F19-F99 AromaticContact CZ-CD1 3.72Å; F19-F99 HydrophobicContact CZ-CD1 3.72Å; F19-F99 HydrophobicContact CZ-CD2 4.44Å; F19-F99 HydrophobicContact CZ-CE1 4.37Å; F19-F99 AromaticContact CZ-CG 3.76Å; F19-F99 HydrophobicContact CZ-CG 3.76Å
20H90.3Very high82.4Confident6 Ų666 Ų663%0.02835%0.35CS..Hα-helixtrans-56.5-45.6170.5-68.866.3000110.5L16 S17 T23 F24 F83 E87L16-H20 HydrophobicContact CD2-CB 4.26Å; L16-H20 HydrophobicContact CG-CB 4.25Å; S17-H20 WeakPolarHBondContact O-CB 3.3Å; S17-H20 PolarHBondContact O-N 3.47Å; S17-H20 VanDerWaalsContact O-N 3.15Å; S17-H20 PolarHBondContact OG-CE1 3.38Å; S17-H20 PolarHBondContact OG-ND1 3.13Å; H20-T23 PolarHBondContact O-OG1 3.44Å; H20-F24 WeakPolarHBondContact O-CB 3.09Å; H20-F24 WeakPolarHBondContact O-CD2 3.25Å; H20-F24 WeakPolarHBondContact O-CG 3.43Å; H20-F24 PolarHBondContact O-N 3.49Å; H20-F83 HydrophobicContact CB-CD2 4.25Å; H20-F83 VanDerWaalsContact CD2-CB 3.48Å; H20-F83 WeakPolarHBondContact CD2-CB 3.23Å; H20-F83 AromaticContact CD2-CD2 3.54Å; H20-F83 WeakPolarHBondContact CE1-CB 3.21Å; H20-F83 AromaticContact CE1-CD2 3.93Å; H20-F83 AromaticContact CE1-CG 3.89Å; H20-F83 AromaticContact CG-CD2 3.52Å; H20-F83 AromaticContact ND1-CD2 3.75Å; H20-F83 WeakPolarHBondContact NE2-CB 3.45Å; H20-F83 AromaticContact NE2-CD2 3.84Å; H20-F83 AromaticContact NE2-CG 3.84Å; H20-E87 IonicContact CE1-OE2 3.69Å; H20-E87 PolarHBondContact CE1-OE2 2.96Å; H20-E87 IonicContact ND1-OE2 3.51Å
21R92.3Very high84.1Confident132 Ų13265.6 Ų65.650%0.49834%0.341SS..Hα-helixtrans-65-43-179.4-71.3179.1-89170.5-11.1112L16 S17 P18 F19 L25L16-R21 HydrophobicContact CB-CG 4.45Å; L16-R21 PolarHBondContact O-NE 3.14Å; L16-R21 PolarHBondContact O-NH2 3.03Å; L16-R21 VanDerWaalsContact O-NH2 3.16Å; S17-R21 PolarHBondContact O-N 2.79Å; P18-R21 PolarHBondContact O-N 3.11Å; F19-R21 VanDerWaalsContact C-N 3.26Å; F19-R21 PolarHBondContact O-N 3.45Å; R21-L25 VanDerWaalsContact O-CB 3.28Å; R21-L25 WeakPolarHBondContact O-CB 3.43Å; R21-L25 PolarHBondContact O-N 3.47Å
22V94.2Very high85.9Confident91 Ų9164.7 Ų64.755%0.55234%0.34SS*.Hα-helixtrans-64.8-46.1178.8172.50000111.3P18 F19 L25 A26P18-V22 WeakPolarHBondContact O-CG2 3.26Å; P18-V22 PolarHBondContact O-N 3.33Å; F19-V22 PolarHBondContact O-N 3.26Å; V22-L25 PolarHBondContact O-N 3.09Å; V22-A26 VanDerWaalsContact O-CB 3.29Å; V22-A26 WeakPolarHBondContact O-CB 3.46Å; V22-A26 PolarHBondContact O-N 3.28Å
23T94.1Very high87.6Confident1 Ų161.3 Ų61.31%0.00633%0.325CS..Hα-helixtrans-66.1-40.2179.548.90000112.2F19 H20 A26 L27 W63 F83 F99F19-T23 HydrophobicContact CD1-CG2 4.3Å; F19-T23 HydrophobicContact CD2-CG2 4.27Å; F19-T23 HydrophobicContact CE1-CG2 4.01Å; F19-T23 HydrophobicContact CE2-CG2 3.94Å; F19-T23 HydrophobicContact CG-CG2 4.44Å; F19-T23 HydrophobicContact CZ-CG2 3.8Å; F19-T23 WeakPolarHBondContact O-CB 3.26Å; F19-T23 WeakPolarHBondContact O-CG2 3.41Å; F19-T23 PolarHBondContact O-N 3.4Å; F19-T23 PolarHBondContact O-OG1 2.96Å; H20-T23 PolarHBondContact O-OG1 3.44Å; T23-A26 PolarHBondContact O-N 3.47Å; T23-L27 WeakPolarHBondContact O-CG 3.27Å; T23-L27 PolarHBondContact O-N 3.01Å; T23-W63 HydrophobicContact CG2-CH2 4.1Å; T23-W63 HydrophobicContact CG2-CZ3 4.39Å; T23-F83 HydrophobicContact CG2-CE2 4.34Å; T23-F83 HydrophobicContact CG2-CZ 4.34Å; T23-F83 WeakPolarHBondContact OG1-CE2 3.06Å; T23-F99 HydrophobicContact CG2-CE1 4.46Å; T23-F99 HydrophobicContact CG2-CE2 4.49Å; T23-F99 HydrophobicContact CG2-CZ 4.2Å
24F94.8Very high89.3Confident42 Ų4252.6 Ų52.618%0.18430%0.295CS..Hα-helixtrans-63-46.8174.2-88-125.5000112H20 A26 L27 C28 M76 L79 H80H20-F24 WeakPolarHBondContact O-CB 3.09Å; H20-F24 WeakPolarHBondContact O-CD2 3.25Å; H20-F24 WeakPolarHBondContact O-CG 3.43Å; H20-F24 PolarHBondContact O-N 3.49Å; F24-A26 VanDerWaalsContact C-N 3.28Å; F24-A26 PolarHBondContact O-N 3.38Å; F24-L27 PolarHBondContact O-N 2.88Å; F24-C28 PolarHBondContact O-N 3.5Å; F24-C28 PolarHBondContact O-SG 3.3Å; F24-C28 VanDerWaalsContact O-SG 3.34Å; F24-M76 HydrophobicContact CB-CE 4.26Å; F24-M76 HydrophobicContact CD1-CE 3.29Å; F24-M76 HydrophobicContact CD1-CG 4.42Å; F24-M76 HydrophobicContact CE1-CB 3.99Å; F24-M76 HydrophobicContact CE1-CE 3.75Å; F24-M76 HydrophobicContact CE1-CG 4.22Å; F24-M76 HydrophobicContact CG-CE 4.01Å; F24-M76 HydrophobicContact CZ-CB 4.06Å; F24-M76 HydrophobicContact CZ-CG 4.49Å; F24-M76 VanDerWaalsContact CZ-O 3.28Å; F24-M76 WeakPolarHBondContact CZ-O 3.13Å; F24-L79 HydrophobicContact CD2-CD2 3.94Å; F24-L79 HydrophobicContact CE2-CB 4.2Å; F24-L79 HydrophobicContact CE2-CD2 3.8Å; F24-L79 HydrophobicContact CE2-CG 4.07Å; F24-H80 HydrophobicContact CZ-CB 4.01Å
25L95.7Very high90.9Very high107 Ų10754.5 Ų54.556%0.5629%0.29SS*.Hα-helixtrans-61.6-40.3176.6-179.261.3000111.2R21 V22 C28 I29R21-L25 VanDerWaalsContact O-CB 3.28Å; R21-L25 WeakPolarHBondContact O-CB 3.43Å; R21-L25 PolarHBondContact O-N 3.47Å; V22-L25 PolarHBondContact O-N 3.09Å; L25-C28 PolarHBondContact O-N 3.45Å; L25-I29 HydrophobicContact CD1-CD1 4.02Å; L25-I29 HydrophobicContact CD1-CG1 4.26Å; L25-I29 HydrophobicContact CD2-CD1 4.5Å; L25-I29 HydrophobicContact CG-CD1 3.85Å; L25-I29 HydrophobicContact CG-CG1 4.46Å; L25-I29 WeakPolarHBondContact O-CG1 3.23Å; L25-I29 PolarHBondContact O-N 2.93Å
26A95.9Very high92.1Very high11 Ų1155.5 Ų55.59%0.09128%0.282CS..Hα-helixtrans-62.9-41.5176.700000112.6V22 T23 F24 I29 G30 W63 M64V22-A26 VanDerWaalsContact O-CB 3.29Å; V22-A26 WeakPolarHBondContact O-CB 3.46Å; V22-A26 PolarHBondContact O-N 3.28Å; T23-A26 PolarHBondContact O-N 3.47Å; F24-A26 VanDerWaalsContact C-N 3.28Å; F24-A26 PolarHBondContact O-N 3.38Å; A26-I29 PolarHBondContact O-N 3.39Å; A26-G30 PolarHBondContact O-N 3.04Å; A26-W63 HydrophobicContact CB-CH2 3.89Å; A26-W63 HydrophobicContact CB-CZ3 4.11Å; A26-M64 HydrophobicContact CB-CE 3.78Å; A26-M64 HydrophobicContact CB-CG 4.1Å; A26-M64 HydrophobicContact CB-SD 4.27Å
27L95.5Very high92.6Very high0 Ų063 Ų630%031%0.308CS..Hα-helixtrans-63.9-41.9174-71.1173.4000111.8T23 F24 G30 Y31 W63 M76 L79T23-L27 WeakPolarHBondContact O-CG 3.27Å; T23-L27 PolarHBondContact O-N 3.01Å; F24-L27 PolarHBondContact O-N 2.88Å; L27-G30 PolarHBondContact O-N 3.29Å; L27-Y31 WeakPolarHBondContact O-CB 3.33Å; L27-Y31 PolarHBondContact O-N 2.89Å; L27-W63 HydrophobicContact CD2-CE3 4.37Å; L27-W63 WeakPolarHBondContact CD2-O 2.67Å; L27-M76 HydrophobicContact CD1-CG 4.06Å; L27-L79 HydrophobicContact CD1-CD2 4.02Å
28C95.6Very high93Very high55 Ų5565.6 Ų65.637%0.37232%0.323SS..Hα-helixtrans-62.6-46.6176-68.60000111.9F24 L25 Y31 L32F24-C28 PolarHBondContact O-N 3.5Å; F24-C28 PolarHBondContact O-SG 3.3Å; F24-C28 VanDerWaalsContact O-SG 3.34Å; L25-C28 PolarHBondContact O-N 3.45Å; C28-Y31 PolarHBondContact O-N 3.48Å; C28-L32 WeakPolarHBondContact O-CG 3.45Å; C28-L32 PolarHBondContact O-N 2.92Å
29I96.2Very high93.2Very high86 Ų8665.1 Ų65.144%0.44132%0.316SS..Hα-helixtrans-65.1-44.7177.5-68.1170.3000110.1L25 A26 Y31 L32 C33L25-I29 HydrophobicContact CD1-CD1 4.02Å; L25-I29 HydrophobicContact CD1-CG1 4.26Å; L25-I29 HydrophobicContact CD2-CD1 4.5Å; L25-I29 HydrophobicContact CG-CD1 3.85Å; L25-I29 HydrophobicContact CG-CG1 4.46Å; L25-I29 WeakPolarHBondContact O-CG1 3.23Å; L25-I29 PolarHBondContact O-N 2.93Å; A26-I29 PolarHBondContact O-N 3.39Å; I29-Y31 VanDerWaalsContact C-N 3.29Å; I29-Y31 PolarHBondContact O-N 3.27Å; I29-L32 CarbonylContact O-C 3.57Å; I29-L32 WeakPolarHBondContact O-CA 3.38Å; I29-L32 WeakPolarHBondContact O-CB 3.34Å; I29-L32 PolarHBondContact O-N 3.44Å; I29-C33 PolarHBondContact O-N 3.3Å; I29-C33 PolarHBondContact O-SG 3.42Å
30G95Very high93.2Very high4 Ų463.7 Ų63.74%0.04131%0.31CS..Hα-helixtrans-65.4-31-179.800000113.3A26 L27 C33 S34 M64A26-G30 PolarHBondContact O-N 3.04Å; L27-G30 PolarHBondContact O-N 3.29Å; G30-C33 PolarHBondContact O-N 2.9Å; G30-S34 PolarHBondContact O-N 2.68Å; G30-M64 VanDerWaalsContact CA-O 3.29Å; G30-M64 WeakPolarHBondContact CA-O 3.38Å
31Y94.3Very high93.2Very high43 Ų4368.1 Ų68.117%0.16933%0.327CS..Hα-helixtrans-62.5-44.2168.3-179.7-104000112.2L27 C28 I29 C33 S34 Y35 E66 I69 V72L27-Y31 WeakPolarHBondContact O-CB 3.33Å; L27-Y31 PolarHBondContact O-N 2.89Å; C28-Y31 PolarHBondContact O-N 3.48Å; I29-Y31 VanDerWaalsContact C-N 3.29Å; I29-Y31 PolarHBondContact O-N 3.27Å; Y31-C33 VanDerWaalsContact C-N 3.34Å; Y31-C33 PolarHBondContact O-N 3.48Å; Y31-S34 WeakPolarHBondContact O-CB 3.46Å; Y31-S34 PolarHBondContact O-N 3.45Å; Y31-Y35 HydrophobicContact CD1-CE2 4.38Å; Y31-Y35 AromaticContact CE1-CE2 3.99Å; Y31-Y35 HydrophobicContact CE1-CE2 3.99Å; Y31-Y35 PolarHBondContact OH-OH 3.43Å; Y31-E66 WeakPolarHBondContact CA-O 3.18Å; Y31-E66 VanDerWaalsContact CD2-O 3.28Å; Y31-E66 WeakPolarHBondContact CD2-O 3.22Å; Y31-I69 HydrophobicContact CE1-CD1 4.35Å; Y31-I69 HydrophobicContact CE2-CB 3.98Å; Y31-V72 HydrophobicContact CD2-CG2 3.61Å; Y31-V72 HydrophobicContact CE2-CG2 4.4Å; Y31-V72 HydrophobicContact CG-CG2 4.09Å
32L94.8Very high93.2Very high119 Ų11964.7 Ų64.762%0.62332%0.316SS*.Hα-helixtrans-64.8-38.7174.1-62.3173.1000111.8C28 I29 S34 Y35C28-L32 WeakPolarHBondContact O-CG 3.45Å; C28-L32 PolarHBondContact O-N 2.92Å; I29-L32 CarbonylContact O-C 3.57Å; I29-L32 WeakPolarHBondContact O-CA 3.38Å; I29-L32 WeakPolarHBondContact O-CB 3.34Å; I29-L32 PolarHBondContact O-N 3.44Å; L32-S34 PolarHBondContact O-N 2.91Å; L32-Y35 WeakPolarHBondContact O-CD2 3.49Å; L32-Y35 PolarHBondContact O-N 2.88Å
33C93Very high93.2Very high25 Ų2562.5 Ų62.517%0.16930%0.301CS..Hα-helixtrans-66.3-24.3174.8-65.20000112.7I29 G30 Y31 Y35 E36 L39 L43I29-C33 PolarHBondContact O-N 3.3Å; I29-C33 PolarHBondContact O-SG 3.42Å; G30-C33 PolarHBondContact O-N 2.9Å; Y31-C33 VanDerWaalsContact C-N 3.34Å; Y31-C33 PolarHBondContact O-N 3.48Å; C33-Y35 PolarHBondContact O-N 2.65Å; C33-E36 PolarHBondContact O-N 3.39Å; C33-E36 VanDerWaalsContact O-N 3.16Å; C33-L39 HydrophobicContact CB-CB 4.22Å; C33-L39 HydrophobicContact CB-CD1 3.79Å; C33-L43 HydrophobicContact CB-CD1 4.41Å
34S91.4Very high93.1Very high20 Ų2062.6 Ų62.614%0.1430%0.302CS..THydrogen-bonded Turntrans-66.1-17.5-179.4-174.10000113.8G30 Y31 L32 E36 V40 E66 S67G30-S34 PolarHBondContact O-N 2.68Å; Y31-S34 WeakPolarHBondContact O-CB 3.46Å; Y31-S34 PolarHBondContact O-N 3.45Å; L32-S34 PolarHBondContact O-N 2.91Å; S34-E36 VanDerWaalsContact C-N 3.33Å; S34-V40 WeakPolarHBondContact O-CG2 3.32Å; S34-E66 VanDerWaalsContact CB-O 3.26Å; S34-E66 WeakPolarHBondContact CB-O 3.3Å; S34-S67 VanDerWaalsContact OG-CA 3.31Å; S34-S67 WeakPolarHBondContact OG-CA 3.33Å; S34-S67 VanDerWaalsContact OG-CB 3.24Å; S34-S67 WeakPolarHBondContact OG-CB 3.34Å
35Y91Very high93Very high158 Ų15860.6 Ų60.662%0.6229%0.293SS*.THydrogen-bonded Turntrans-74.2-26.3175.5-68.7-77.7000112.7Y31 L32 C33Y31-Y35 HydrophobicContact CD1-CE2 4.38Å; Y31-Y35 AromaticContact CE1-CE2 3.99Å; Y31-Y35 HydrophobicContact CE1-CE2 3.99Å; Y31-Y35 PolarHBondContact OH-OH 3.43Å; L32-Y35 WeakPolarHBondContact O-CD2 3.49Å; L32-Y35 PolarHBondContact O-N 2.88Å; C33-Y35 PolarHBondContact O-N 2.65Å
36E91.2Very high92.8Very high93 Ų9355.6 Ų55.644%0.43527%0.267SS..  trans-92.5114.9-179.3179.749.1-130.200110.3C33 S34 T38 L39 V40C33-E36 PolarHBondContact O-N 3.39Å; C33-E36 VanDerWaalsContact O-N 3.16Å; S34-E36 VanDerWaalsContact C-N 3.33Å; E36-T38 PolarHBondContact O-N 3.45Å; E36-T38 WeakPolarHBondContact OE1-CB 3.27Å; E36-T38 PolarHBondContact OE1-N 3.29Å; E36-T38 PolarHBondContact OE1-OG1 2.94Å; E36-L39 HydrophobicContact CB-CB 4.21Å; E36-L39 HydrophobicContact CB-CD1 3.97Å; E36-L39 HydrophobicContact CB-CG 4.05Å; E36-L39 HydrophobicContact CG-CB 4.3Å; E36-L39 HydrophobicContact CG-CD1 4.17Å; E36-L39 HydrophobicContact CG-CG 3.86Å; E36-L39 PolarHBondContact O-N 3.44Å; E36-L39 VanDerWaalsContact O-N 3.15Å; E36-V40 WeakPolarHBondContact O-CG2 3.45Å; E36-V40 PolarHBondContact O-N 3.43Å; E36-V40 VanDerWaalsContact O-N 3.09Å
37R88.4Confident92.4Very high198 Ų19855.1 Ų55.175%0.74726%0.263SS*.Hα-helixtrans-61-32.3-176.5-64.2-171.6-169.4-133.62.8112.2R41R37-R41 PolarHBondContact O-N 3.49Å; R37-R41 VanDerWaalsContact O-N 3.1Å
38T90.9Very high92Very high71 Ų7157 Ų5744%0.43627%0.271SS..Hα-helixtrans-64.1-48.2177.6-47.60000110.8E36 V40 R41 E42E36-T38 PolarHBondContact O-N 3.45Å; E36-T38 WeakPolarHBondContact OE1-CB 3.27Å; E36-T38 PolarHBondContact OE1-N 3.29Å; E36-T38 PolarHBondContact OE1-OG1 2.94Å; T38-V40 PolarHBondContact O-N 3.43Å; T38-R41 PolarHBondContact O-N 3.43Å; T38-E42 WeakPolarHBondContact O-CG 3.48Å; T38-E42 PolarHBondContact O-N 3.48Å; T38-E42 VanDerWaalsContact O-N 3.13Å
39L92.2Very high91.7Very high70 Ų7056.7 Ų56.737%0.36626%0.262SS..Hα-helixtrans-65.4-39.1179.4-66.8179.6000112C33 E36 R41 E42 L43C33-L39 HydrophobicContact CB-CB 4.22Å; C33-L39 HydrophobicContact CB-CD1 3.79Å; E36-L39 HydrophobicContact CB-CB 4.21Å; E36-L39 HydrophobicContact CB-CD1 3.97Å; E36-L39 HydrophobicContact CB-CG 4.05Å; E36-L39 HydrophobicContact CG-CB 4.3Å; E36-L39 HydrophobicContact CG-CD1 4.17Å; E36-L39 HydrophobicContact CG-CG 3.86Å; E36-L39 PolarHBondContact O-N 3.44Å; E36-L39 VanDerWaalsContact O-N 3.15Å; L39-R41 VanDerWaalsContact C-N 3.32Å; L39-R41 PolarHBondContact O-N 2.88Å; L39-E42 PolarHBondContact O-N 2.92Å; L39-L43 HydrophobicContact CB-CD1 4.41Å; L39-L43 VanDerWaalsContact O-CB 3.29Å; L39-L43 WeakPolarHBondContact O-CB 3.48Å; L39-L43 WeakPolarHBondContact O-CG 3.43Å; L39-L43 PolarHBondContact O-N 3.19Å
40V90.6Very high91.4Very high6 Ų653.6 Ų53.64%0.03625%0.246CC..Hα-helixtrans-57.7-47.7173.8175.30000110.2S34 E36 T38 E42 L43 T44 V65S34-V40 WeakPolarHBondContact O-CG2 3.32Å; E36-V40 WeakPolarHBondContact O-CG2 3.45Å; E36-V40 PolarHBondContact O-N 3.43Å; E36-V40 VanDerWaalsContact O-N 3.09Å; T38-V40 PolarHBondContact O-N 3.43Å; V40-E42 VanDerWaalsContact C-N 3.31Å; V40-E42 PolarHBondContact O-N 3.37Å; V40-L43 PolarHBondContact O-N 2.87Å; V40-T44 HydrophobicContact CG1-CG2 4.01Å; V40-T44 VanDerWaalsContact O-CB 3.3Å; V40-T44 WeakPolarHBondContact O-CB 3.33Å; V40-T44 WeakPolarHBondContact O-CG2 3.45Å; V40-T44 PolarHBondContact O-N 3.27Å; V40-T44 PolarHBondContact O-OG1 3.47Å; V40-V65 HydrophobicContact CG2-CG1 4.32Å
41R89.9Confident91Very high99 Ų9958.4 Ų58.437%0.37427%0.267SS..Hα-helixtrans-61.2-37.6179.9-172.9179.968.6-158.3-3.4113.2R37 T38 L39 I46 Y49R37-R41 PolarHBondContact O-N 3.49Å; R37-R41 VanDerWaalsContact O-N 3.1Å; T38-R41 PolarHBondContact O-N 3.43Å; L39-R41 VanDerWaalsContact C-N 3.32Å; L39-R41 PolarHBondContact O-N 2.88Å; R41-I46 HydrophobicContact CB-CD1 4.46Å; R41-I46 HydrophobicContact CG-CD1 3.94Å; R41-Y49 HydrophobicContact CG-CD2 4.34Å; R41-Y49 HydrophobicContact CG-CE2 3.87Å
42E92.2Very high90.7Very high59 Ų5964.8 Ų64.828%0.27629%0.29SS..Hα-helixtrans-81.7-33.3-177.4-62-51.4140.500113.6T38 L39 V40 H55 W57T38-E42 WeakPolarHBondContact O-CG 3.48Å; T38-E42 PolarHBondContact O-N 3.48Å; T38-E42 VanDerWaalsContact O-N 3.13Å; L39-E42 PolarHBondContact O-N 2.92Å; V40-E42 VanDerWaalsContact C-N 3.31Å; V40-E42 PolarHBondContact O-N 3.37Å; E42-H55 IonicContact OE2-CE1 2.94Å; E42-H55 PolarHBondContact OE2-CE1 3.33Å; E42-H55 IonicContact OE2-ND1 3.8Å; E42-W57 PolarHBondContact O-NE1 2.79Å
43L93.7Very high90.4Very high46 Ų4663.7 Ų63.724%0.24128%0.282CS..Hα-helixtrans-96.3-20.6-172.5-65.6175.6000114.2C33 L39 V40 T61 F62 V65C33-L43 HydrophobicContact CB-CD1 4.41Å; L39-L43 HydrophobicContact CB-CD1 4.41Å; L39-L43 VanDerWaalsContact O-CB 3.29Å; L39-L43 WeakPolarHBondContact O-CB 3.48Å; L39-L43 WeakPolarHBondContact O-CG 3.43Å; L39-L43 PolarHBondContact O-N 3.19Å; V40-L43 PolarHBondContact O-N 2.87Å; L43-T61 HydrophobicContact CD2-CG2 4.16Å; L43-T61 CarbonylContact O-C 3.57Å; L43-T61 VanDerWaalsContact O-C 3.29Å; L43-T61 WeakPolarHBondContact O-CB 3.4Å; L43-T61 PolarHBondContact O-OG1 2.83Å; L43-F62 VanDerWaalsContact O-CA 3.27Å; L43-F62 WeakPolarHBondContact O-CA 3.35Å; L43-F62 PolarHBondContact O-N 3.49Å; L43-F62 VanDerWaalsContact O-N 3.11Å; L43-V65 HydrophobicContact CB-CG2 3.65Å; L43-V65 HydrophobicContact CD1-CG2 3.89Å; L43-V65 HydrophobicContact CG-CG2 4.44Å
44T93.3Very high90.3Very high2 Ų271.5 Ų71.51%0.01231%0.308CS..SBendtrans-97158.5-178.865.60000111.8V40 I46 S58 V65 S134 R136V40-T44 HydrophobicContact CG1-CG2 4.01Å; V40-T44 VanDerWaalsContact O-CB 3.3Å; V40-T44 WeakPolarHBondContact O-CB 3.33Å; V40-T44 WeakPolarHBondContact O-CG2 3.45Å; V40-T44 PolarHBondContact O-N 3.27Å; V40-T44 PolarHBondContact O-OG1 3.47Å; T44-I46 PolarHBondContact O-N 2.81Å; T44-S58 VanDerWaalsContact O-CB 3.28Å; T44-S58 WeakPolarHBondContact O-CB 3.17Å; T44-V65 HydrophobicContact CG2-CB 3.89Å; T44-V65 HydrophobicContact CG2-CG1 3.89Å; T44-V65 HydrophobicContact CG2-CG2 4.31Å; T44-S134 WeakPolarHBondContact OG1-CB 3.41Å; T44-R136 HydrophobicContact CG2-CB 3.64Å
45I92.8Very high90.3Very high0 Ų071.4 Ų71.40%031%0.305CS..BIsolated β-bridgetrans-82.3114.9176.4-61.2157.3000108.1L50 V59 F62 G107 C111 I135I45-L50 HydrophobicContact CG2-CD2 4.15Å; I45-V59 HydrophobicContact CD1-CG2 4.42Å; I45-V59 HydrophobicContact CG1-CG2 4.46Å; I45-F62 HydrophobicContact CD1-CB 4.05Å; I45-F62 HydrophobicContact CD1-CD1 3.38Å; I45-F62 HydrophobicContact CD1-CD2 4.39Å; I45-F62 HydrophobicContact CD1-CE1 3.9Å; I45-F62 HydrophobicContact CD1-CG 3.65Å; I45-F62 HydrophobicContact CG1-CB 3.94Å; I45-F62 HydrophobicContact CG1-CD1 4.07Å; I45-F62 HydrophobicContact CG1-CG 4.12Å; I45-G107 VanDerWaalsContact CD1-CA 3.44Å; I45-C111 HydrophobicContact CG2-CB 4Å; I45-I135 HydrophobicContact CB-CB 4.13Å; I45-I135 HydrophobicContact CG2-CD1 4.2Å; I45-I135 PolarHBondContact N-O 2.9Å; I45-I135 PolarHBondContact O-N 3.37Å
46I90.4Very high90.4Very high2 Ų267.2 Ų67.21%0.0130%0.296CS..  trans-110.6121.3164.8-61.6166.4000106.2R41 T44 F48 Y49 L50R41-I46 HydrophobicContact CB-CD1 4.46Å; R41-I46 HydrophobicContact CG-CD1 3.94Å; T44-I46 PolarHBondContact O-N 2.81Å; I46-F48 VanDerWaalsContact C-N 3.25Å; I46-F48 HydrophobicContact CG2-CB 4.33Å; I46-F48 PolarHBondContact O-N 2.86Å; I46-F48 VanDerWaalsContact O-N 3.15Å; I46-Y49 HydrophobicContact CB-CD2 3.77Å; I46-Y49 HydrophobicContact CD1-CD2 3.75Å; I46-Y49 HydrophobicContact CD1-CE2 4.04Å; I46-Y49 HydrophobicContact CG1-CD2 4.37Å; I46-Y49 HydrophobicContact CG2-CD2 3.71Å; I46-Y49 HydrophobicContact CG2-CE2 4.38Å; I46-Y49 PolarHBondContact O-N 3.33Å; I46-L50 PolarHBondContact O-N 3.07Å
47P88.8Confident90.6Very high2 Ų268.4 Ų68.41%0.01330%0.297CS..Hα-helixtrans-50.9-43.1-175.5-3035000113.9Y49 L50 F51 L114 F128P47-Y49 PolarHBondContact O-N 3Å; P47-L50 PolarHBondContact O-N 3.48Å; P47-F51 HydrophobicContact CB-CE2 4.48Å; P47-F51 WeakPolarHBondContact O-CD2 3.44Å; P47-F51 PolarHBondContact O-N 3.45Å; P47-L114 HydrophobicContact CG-CB 4.42Å; P47-L114 HydrophobicContact CG-CD2 3.87Å; P47-L114 HydrophobicContact CG-CG 4.3Å; P47-F128 HydrophobicContact CB-CD2 4.25Å; P47-F128 HydrophobicContact CB-CE2 3.47Å; P47-F128 VanDerWaalsContact CB-CE2 3.47Å; P47-F128 HydrophobicContact CB-CZ 3.67Å; P47-F128 HydrophobicContact CG-CE2 4.29Å
48F86.6Confident90.9Very high39 Ų3959 Ų5917%0.17126%0.261CS..Hα-helixtrans-56.5-51.7175.8178.9-105.6000112.9I46 L50 F51 R52 H53 F128 F129I46-F48 VanDerWaalsContact C-N 3.25Å; I46-F48 HydrophobicContact CG2-CB 4.33Å; I46-F48 PolarHBondContact O-N 2.86Å; I46-F48 VanDerWaalsContact O-N 3.15Å; F48-L50 VanDerWaalsContact C-N 3.34Å; F48-L50 PolarHBondContact O-N 3.04Å; F48-F51 PolarHBondContact O-N 3.3Å; F48-R52 HydrophobicContact CD2-CB 4.25Å; F48-R52 HydrophobicContact CE2-CB 3.89Å; F48-R52 HydrophobicContact CE2-CG 4.02Å; F48-R52 HydrophobicContact CZ-CB 4.08Å; F48-R52 HydrophobicContact CZ-CG 3.89Å; F48-R52 WeakPolarHBondContact O-CB 3.11Å; F48-R52 PolarHBondContact O-N 2.97Å; F48-H53 AromaticContact CE1-CD2 3.61Å; F48-H53 AromaticContact CE1-NE2 3.45Å; F48-H53 WeakPolarHBondContact CE1-NE2 3.48Å; F48-H53 AromaticContact CZ-NE2 3.85Å; F48-F128 HydrophobicContact CB-CD1 3.72Å; F48-F128 HydrophobicContact CB-CE1 3.6Å; F48-F128 WeakPolarHBondContact CB-O 2.77Å; F48-F128 HydrophobicContact CD2-CD1 4.29Å; F48-F128 HydrophobicContact CD2-CE1 4.07Å; F48-F128 HydrophobicContact CG-CD1 4.43Å; F48-F128 HydrophobicContact CG-CE1 4.34Å; F48-F129 HydrophobicContact CB-CD1 4.45Å; F48-F129 AromaticContact CD1-CD1 3.97Å; F48-F129 HydrophobicContact CD1-CD1 3.97Å; F48-F129 HydrophobicContact CD1-CE1 4.38Å; F48-F129 AromaticContact CD2-CD1 3.8Å; F48-F129 HydrophobicContact CD2-CD1 3.8Å; F48-F129 AromaticContact CD2-CE1 3.46Å; F48-F129 HydrophobicContact CD2-CE1 3.46Å; F48-F129 VanDerWaalsContact CD2-CE1 3.46Å; F48-F129 HydrophobicContact CD2-CZ 4.5Å; F48-F129 HydrophobicContact CE1-CD1 4.15Å; F48-F129 HydrophobicContact CE1-CE1 4.33Å; F48-F129 HydrophobicContact CE2-CD1 4.01Å; F48-F129 AromaticContact CE2-CE1 3.43Å; F48-F129 HydrophobicContact CE2-CE1 3.43Å; F48-F129 VanDerWaalsContact CE2-CE1 3.43Å; F48-F129 HydrophobicContact CE2-CZ 4.5Å; F48-F129 AromaticContact CG-CD1 3.79Å; F48-F129 HydrophobicContact CG-CD1 3.79Å; F48-F129 AromaticContact CG-CE1 3.96Å; F48-F129 HydrophobicContact CG-CE1 3.96Å; F48-F129 HydrophobicContact CZ-CD1 4.17Å; F48-F129 AromaticContact CZ-CE1 3.88Å; F48-F129 HydrophobicContact CZ-CE1 3.88Å
49Y88.5Confident91.1Very high48 Ų4856 Ų5619%0.18824%0.243CC..Hα-helixtrans-68.9-32.2-178.8-73.1-74.8000112.7R41 I46 P47 H53 W54 H55R41-Y49 HydrophobicContact CG-CD2 4.34Å; R41-Y49 HydrophobicContact CG-CE2 3.87Å; I46-Y49 HydrophobicContact CB-CD2 3.77Å; I46-Y49 HydrophobicContact CD1-CD2 3.75Å; I46-Y49 HydrophobicContact CD1-CE2 4.04Å; I46-Y49 HydrophobicContact CG1-CD2 4.37Å; I46-Y49 HydrophobicContact CG2-CD2 3.71Å; I46-Y49 HydrophobicContact CG2-CE2 4.38Å; I46-Y49 PolarHBondContact O-N 3.33Å; P47-Y49 PolarHBondContact O-N 3Å; Y49-H53 HydrophobicContact CD1-CB 4.1Å; Y49-H53 AromaticContact CD1-CD2 3.41Å; Y49-H53 VanDerWaalsContact CD1-CD2 3.41Å; Y49-H53 WeakPolarHBondContact CD1-CD2 3.33Å; Y49-H53 AromaticContact CD1-CG 3.92Å; Y49-H53 AromaticContact CE1-CD2 3.75Å; Y49-H53 CarbonylContact O-C 3.37Å; Y49-H53 WeakPolarHBondContact O-CA 3.38Å; Y49-H53 WeakPolarHBondContact O-CB 3.23Å; Y49-H53 PolarHBondContact O-N 2.91Å; Y49-H53 VanDerWaalsContact O-N 3.14Å; Y49-W54 PolarHBondContact O-N 3.08Å; Y49-W54 VanDerWaalsContact O-N 3.08Å; Y49-H55 AromaticContact CD1-NE2 3.84Å; Y49-H55 PolarHBondContact O-N 3.49Å; Y49-H55 VanDerWaalsContact O-N 3.12Å
50L89.9Confident91.2Very high21 Ų2157.6 Ų57.611%0.1125%0.247CC..Hα-helixtrans-65-48.7175.2-173.867.4000111.5I45 I46 P47 F48 W54 H55 V59 C111I45-L50 HydrophobicContact CG2-CD2 4.15Å; I46-L50 PolarHBondContact O-N 3.07Å; P47-L50 PolarHBondContact O-N 3.48Å; F48-L50 VanDerWaalsContact C-N 3.34Å; F48-L50 PolarHBondContact O-N 3.04Å; L50-W54 WeakPolarHBondContact O-CA 3.39Å; L50-W54 PolarHBondContact O-N 3.21Å; L50-H55 WeakPolarHBondContact CD1-O 3.38Å; L50-V59 HydrophobicContact CD1-CG2 3.83Å; L50-V59 HydrophobicContact CD2-CG2 4.42Å; L50-C111 HydrophobicContact CD2-CB 4.27Å; L50-C111 VanDerWaalsContact CD2-SG 3.57Å
51F87.5Confident91.4Very high106 Ų10658.7 Ų58.747%0.46525%0.253SS..Hα-helixtrans-82.9-36.9-175.5-68.3-62.2000114P47 F48 L112 S115P47-F51 HydrophobicContact CB-CE2 4.48Å; P47-F51 WeakPolarHBondContact O-CD2 3.44Å; P47-F51 PolarHBondContact O-N 3.45Å; F48-F51 PolarHBondContact O-N 3.3Å; F51-L112 HydrophobicContact CZ-CD2 3.93Å; F51-S115 WeakPolarHBondContact CE2-OG 3.41Å
52R87.7Confident91.7Very high176 Ų17654 Ų5466%0.66424%0.235SC*.Hα-helixtrans-89.2-48.2-176.2179.762.173.3124.35.3112.6F48F48-R52 HydrophobicContact CD2-CB 4.25Å; F48-R52 HydrophobicContact CE2-CB 3.89Å; F48-R52 HydrophobicContact CE2-CG 4.02Å; F48-R52 HydrophobicContact CZ-CB 4.08Å; F48-R52 HydrophobicContact CZ-CG 3.89Å; F48-R52 WeakPolarHBondContact O-CB 3.11Å; F48-R52 PolarHBondContact O-N 2.97Å
53H88.8Confident91.8Very high97 Ų9752 Ų5245%0.44923%0.225SC..SBendtrans-99.40.8-172.9-66.8-77.7000113F48 Y49 H55F48-H53 AromaticContact CE1-CD2 3.61Å; F48-H53 AromaticContact CE1-NE2 3.45Å; F48-H53 WeakPolarHBondContact CE1-NE2 3.48Å; F48-H53 AromaticContact CZ-NE2 3.85Å; Y49-H53 HydrophobicContact CD1-CB 4.1Å; Y49-H53 AromaticContact CD1-CD2 3.41Å; Y49-H53 VanDerWaalsContact CD1-CD2 3.41Å; Y49-H53 WeakPolarHBondContact CD1-CD2 3.33Å; Y49-H53 AromaticContact CD1-CG 3.92Å; Y49-H53 AromaticContact CE1-CD2 3.75Å; Y49-H53 CarbonylContact O-C 3.37Å; Y49-H53 WeakPolarHBondContact O-CA 3.38Å; Y49-H53 WeakPolarHBondContact O-CB 3.23Å; Y49-H53 PolarHBondContact O-N 2.91Å; Y49-H53 VanDerWaalsContact O-N 3.14Å; H53-H55 VanDerWaalsContact C-N 3.31Å; H53-H55 WeakPolarHBondContact CB-CD2 3.48Å; H53-H55 PolarHBondContact O-N 3.42Å
54W90.7Very high91.8Very high189 Ų18952.7 Ų52.772%0.71623%0.228SC*.  trans56.142.4178.9-63.184.7000113.2Y49 L50 V56Y49-W54 PolarHBondContact O-N 3.08Å; Y49-W54 VanDerWaalsContact O-N 3.08Å; L50-W54 WeakPolarHBondContact O-CA 3.39Å; L50-W54 PolarHBondContact O-N 3.21Å; W54-V56 HydrophobicContact CE3-CG2 4.24Å; W54-V56 PolarHBondContact O-N 3.5Å
55H91.2Very high91.9Very high18 Ų1852.6 Ų52.68%0.08323%0.228CC..  trans-71.256.2172-73.6-135.1000110.9E42 Y49 L50 H53 W57 S58E42-H55 IonicContact OE2-CE1 2.94Å; E42-H55 PolarHBondContact OE2-CE1 3.33Å; E42-H55 IonicContact OE2-ND1 3.8Å; Y49-H55 AromaticContact CD1-NE2 3.84Å; Y49-H55 PolarHBondContact O-N 3.49Å; Y49-H55 VanDerWaalsContact O-N 3.12Å; L50-H55 WeakPolarHBondContact CD1-O 3.38Å; H53-H55 VanDerWaalsContact C-N 3.31Å; H53-H55 WeakPolarHBondContact CB-CD2 3.48Å; H53-H55 PolarHBondContact O-N 3.42Å; H55-W57 HydrophobicContact CB-CD2 4.5Å; H55-W57 HydrophobicContact CB-CH2 4.17Å; H55-W57 HydrophobicContact CB-CZ2 3.89Å; H55-W57 AromaticContact CD2-CH2 3.71Å; H55-W57 AromaticContact CD2-CZ2 3.82Å; H55-W57 AromaticContact CE1-CZ2 3.6Å; H55-W57 AromaticContact CG-CE2 3.98Å; H55-W57 AromaticContact CG-CH2 3.68Å; H55-W57 AromaticContact CG-CZ2 3.38Å; H55-W57 AromaticContact ND1-CE2 3.86Å; H55-W57 AromaticContact ND1-CH2 3.93Å; H55-W57 AromaticContact ND1-CZ2 3.23Å; H55-W57 WeakPolarHBondContact ND1-CZ2 3.46Å; H55-W57 AromaticContact NE2-CZ2 3.98Å; H55-W57 PolarHBondContact O-N 3.07Å; H55-S58 VanDerWaalsContact O-CB 3.26Å; H55-S58 WeakPolarHBondContact O-CB 3.45Å; H55-S58 PolarHBondContact O-N 2.98Å; H55-S58 PolarHBondContact O-OG 2.94Å
56V93.5Very high91.8Very high69 Ų6952.6 Ų52.642%0.41823%0.228SC..THydrogen-bonded Turntrans-64-29.2-175.4-178.10000111.2W54 S58 V59W54-V56 HydrophobicContact CE3-CG2 4.24Å; W54-V56 PolarHBondContact O-N 3.5Å; V56-S58 PolarHBondContact O-N 2.87Å; V56-V59 WeakPolarHBondContact O-CB 3.3Å; V56-V59 PolarHBondContact O-N 3.29Å; V56-V59 VanDerWaalsContact O-N 3.16Å
57W95.2Very high91.6Very high119 Ų11953.6 Ų53.645%0.45124%0.235SC..THydrogen-bonded Turntrans-59.9-27.9174.762.384.2000112.7E42 H55 V59 F60 T61E42-W57 PolarHBondContact O-NE1 2.79Å; H55-W57 HydrophobicContact CB-CD2 4.5Å; H55-W57 HydrophobicContact CB-CH2 4.17Å; H55-W57 HydrophobicContact CB-CZ2 3.89Å; H55-W57 AromaticContact CD2-CH2 3.71Å; H55-W57 AromaticContact CD2-CZ2 3.82Å; H55-W57 AromaticContact CE1-CZ2 3.6Å; H55-W57 AromaticContact CG-CE2 3.98Å; H55-W57 AromaticContact CG-CH2 3.68Å; H55-W57 AromaticContact CG-CZ2 3.38Å; H55-W57 AromaticContact ND1-CE2 3.86Å; H55-W57 AromaticContact ND1-CH2 3.93Å; H55-W57 AromaticContact ND1-CZ2 3.23Å; H55-W57 WeakPolarHBondContact ND1-CZ2 3.46Å; H55-W57 AromaticContact NE2-CZ2 3.98Å; H55-W57 PolarHBondContact O-N 3.07Å; W57-V59 PolarHBondContact O-N 2.85Å; W57-V59 VanDerWaalsContact O-N 3.14Å; W57-F60 WeakPolarHBondContact O-CA 3.46Å; W57-F60 WeakPolarHBondContact O-CB 3.3Å; W57-F60 PolarHBondContact O-N 3.42Å; W57-T61 PolarHBondContact O-N 2.94Å; W57-T61 PolarHBondContact O-OG1 2.88Å
58S94.2Very high91.5Very high0 Ų054.4 Ų54.40%024%0.239CC..Hα-helixtrans-57-30.8177.566.90000112.4T44 H55 V56 F60 T61 F62T44-S58 VanDerWaalsContact O-CB 3.28Å; T44-S58 WeakPolarHBondContact O-CB 3.17Å; H55-S58 VanDerWaalsContact O-CB 3.26Å; H55-S58 WeakPolarHBondContact O-CB 3.45Å; H55-S58 PolarHBondContact O-N 2.98Å; H55-S58 PolarHBondContact O-OG 2.94Å; V56-S58 PolarHBondContact O-N 2.87Å; S58-F60 PolarHBondContact O-N 2.99Å; S58-T61 WeakPolarHBondContact CA-OG1 3.3Å; S58-T61 PolarHBondContact O-N 3.44Å; S58-F62 WeakPolarHBondContact O-CB 3.43Å; S58-F62 WeakPolarHBondContact O-CD1 3.47Å; S58-F62 PolarHBondContact O-N 2.93Å
59V95.2Very high91.5Very high8 Ų856.4 Ų56.45%0.04825%0.251CS..Hα-helixtrans-64.1-25.2176.1-177.30000112.3I45 L50 V56 W57 F62 I104 I108I45-V59 HydrophobicContact CD1-CG2 4.42Å; I45-V59 HydrophobicContact CG1-CG2 4.46Å; L50-V59 HydrophobicContact CD1-CG2 3.83Å; L50-V59 HydrophobicContact CD2-CG2 4.42Å; V56-V59 WeakPolarHBondContact O-CB 3.3Å; V56-V59 PolarHBondContact O-N 3.29Å; V56-V59 VanDerWaalsContact O-N 3.16Å; W57-V59 PolarHBondContact O-N 2.85Å; W57-V59 VanDerWaalsContact O-N 3.14Å; V59-F62 WeakPolarHBondContact O-CD1 3.07Å; V59-F62 VanDerWaalsContact O-CE1 3.32Å; V59-F62 WeakPolarHBondContact O-CE1 3.28Å; V59-I104 HydrophobicContact CG1-CB 4.18Å; V59-I104 HydrophobicContact CG1-CG1 4.2Å; V59-I104 HydrophobicContact CG1-CG2 3.98Å; V59-I108 HydrophobicContact CG1-CG1 4.2Å
60F94.9Very high91.4Very high104 Ų10462 Ų6246%0.45627%0.272SS..Hα-helixtrans-96.7-17.7178.3-60.4-85.6000113.4W57 S58 W63 I104W57-F60 WeakPolarHBondContact O-CA 3.46Å; W57-F60 WeakPolarHBondContact O-CB 3.3Å; W57-F60 PolarHBondContact O-N 3.42Å; S58-F60 PolarHBondContact O-N 2.99Å; F60-W63 VanDerWaalsContact O-CD1 3.3Å; F60-W63 PolarHBondContact O-NE1 2.87Å; F60-I104 HydrophobicContact CD1-CD1 4.13Å; F60-I104 HydrophobicContact CD1-CG1 4.22Å; F60-I104 HydrophobicContact CE1-CD1 3.51Å; F60-I104 HydrophobicContact CE1-CG1 3.96Å; F60-I104 HydrophobicContact CZ-CD1 4.23Å
61T95.3Very high91.3Very high28 Ų2861.2 Ų61.217%0.17227%0.268CS..Hα-helixtrans-111.9-19-172.754.70000114.4L43 W57 S58 W63 M64L43-T61 HydrophobicContact CD2-CG2 4.16Å; L43-T61 CarbonylContact O-C 3.57Å; L43-T61 VanDerWaalsContact O-C 3.29Å; L43-T61 WeakPolarHBondContact O-CB 3.4Å; L43-T61 PolarHBondContact O-OG1 2.83Å; W57-T61 PolarHBondContact O-N 2.94Å; W57-T61 PolarHBondContact O-OG1 2.88Å; S58-T61 WeakPolarHBondContact CA-OG1 3.3Å; S58-T61 PolarHBondContact O-N 3.44Å; T61-W63 PolarHBondContact O-N 2.96Å; T61-W63 VanDerWaalsContact O-N 3.12Å; T61-M64 WeakPolarHBondContact O-CB 3.44Å; T61-M64 PolarHBondContact O-N 3.37Å
62F95.1Very high91.5Very high0 Ų056.7 Ų56.70%025%0.249CC..G310 helixtrans-58.5-33.2-172.778-85.6000113.9L43 I45 S58 V59 M64 V65 N103 I135 G137 M203L43-F62 VanDerWaalsContact O-CA 3.27Å; L43-F62 WeakPolarHBondContact O-CA 3.35Å; L43-F62 PolarHBondContact O-N 3.49Å; L43-F62 VanDerWaalsContact O-N 3.11Å; I45-F62 HydrophobicContact CD1-CB 4.05Å; I45-F62 HydrophobicContact CD1-CD1 3.38Å; I45-F62 HydrophobicContact CD1-CD2 4.39Å; I45-F62 HydrophobicContact CD1-CE1 3.9Å; I45-F62 HydrophobicContact CD1-CG 3.65Å; I45-F62 HydrophobicContact CG1-CB 3.94Å; I45-F62 HydrophobicContact CG1-CD1 4.07Å; I45-F62 HydrophobicContact CG1-CG 4.12Å; S58-F62 WeakPolarHBondContact O-CB 3.43Å; S58-F62 WeakPolarHBondContact O-CD1 3.47Å; S58-F62 PolarHBondContact O-N 2.93Å; V59-F62 WeakPolarHBondContact O-CD1 3.07Å; V59-F62 VanDerWaalsContact O-CE1 3.32Å; V59-F62 WeakPolarHBondContact O-CE1 3.28Å; F62-M64 PolarHBondContact O-N 3.28Å; F62-V65 PolarHBondContact O-N 3.42Å; F62-N103 HydrophobicContact CE1-CB 4.35Å; F62-N103 WeakPolarHBondContact CE1-O 3.47Å; F62-N103 HydrophobicContact CZ-CB 4.23Å; F62-N103 WeakPolarHBondContact CZ-O 3.39Å; F62-I135 HydrophobicContact CD2-CG2 4.29Å; F62-G137 PolarHBondContact O-N 2.8Å; F62-G137 VanDerWaalsContact O-N 3.13Å; F62-M203 HydrophobicContact CD2-CE 3.92Å; F62-M203 HydrophobicContact CE2-CE 3.45Å; F62-M203 VanDerWaalsContact CE2-CE 3.45Å
63W94.9Very high91.7Very high17 Ų1752.6 Ų52.66%0.06424%0.239CC..G310 helixtrans-69.3-20.5-178.866.2-94.2000112.5T23 A26 L27 F60 T61 F99 L138T23-W63 HydrophobicContact CG2-CH2 4.1Å; T23-W63 HydrophobicContact CG2-CZ3 4.39Å; A26-W63 HydrophobicContact CB-CH2 3.89Å; A26-W63 HydrophobicContact CB-CZ3 4.11Å; L27-W63 HydrophobicContact CD2-CE3 4.37Å; L27-W63 WeakPolarHBondContact CD2-O 2.67Å; F60-W63 VanDerWaalsContact O-CD1 3.3Å; F60-W63 PolarHBondContact O-NE1 2.87Å; T61-W63 PolarHBondContact O-N 2.96Å; T61-W63 VanDerWaalsContact O-N 3.12Å; W63-F99 AromaticContact CD2-CE1 3.96Å; W63-F99 HydrophobicContact CD2-CE1 3.96Å; W63-F99 AromaticContact CD2-CZ 3.66Å; W63-F99 HydrophobicContact CD2-CZ 3.66Å; W63-F99 AromaticContact CE2-CE1 3.66Å; W63-F99 AromaticContact CE2-CZ 3.85Å; W63-F99 HydrophobicContact CE3-CE1 4.26Å; W63-F99 AromaticContact CE3-CZ 3.6Å; W63-F99 HydrophobicContact CE3-CZ 3.6Å; W63-F99 HydrophobicContact CG-CZ 4.35Å; W63-F99 HydrophobicContact CH2-CE1 4.01Å; W63-F99 AromaticContact CH2-CZ 3.91Å; W63-F99 HydrophobicContact CH2-CZ 3.91Å; W63-F99 AromaticContact CZ2-CE1 3.69Å; W63-F99 HydrophobicContact CZ2-CE1 3.69Å; W63-F99 AromaticContact CZ2-CZ 3.98Å; W63-F99 HydrophobicContact CZ2-CZ 3.98Å; W63-F99 HydrophobicContact CZ3-CE1 4.29Å; W63-F99 AromaticContact CZ3-CZ 3.73Å; W63-F99 HydrophobicContact CZ3-CZ 3.73Å; W63-L138 HydrophobicContact CB-CD1 3.88Å; W63-L138 HydrophobicContact CE3-CD1 4.24Å; W63-L138 HydrophobicContact CG-CD1 4.45Å
64M94.4Very high91.8Very high62 Ų6251.5 Ų51.531%0.30523%0.233SC..G310 helixtrans-74.4-35.2178.5-62.1179.8155.900111.4A26 G30 T61 F62A26-M64 HydrophobicContact CB-CE 3.78Å; A26-M64 HydrophobicContact CB-CG 4.1Å; A26-M64 HydrophobicContact CB-SD 4.27Å; G30-M64 VanDerWaalsContact CA-O 3.29Å; G30-M64 WeakPolarHBondContact CA-O 3.38Å; T61-M64 WeakPolarHBondContact O-CB 3.44Å; T61-M64 PolarHBondContact O-N 3.37Å; F62-M64 PolarHBondContact O-N 3.28Å
65V93.5Very high91.9Very high0 Ų042.5 Ų42.50%020%0.199CC..  trans-86.9120-173.8-179.20000109.6V40 L43 T44 F62 R136 G137V40-V65 HydrophobicContact CG2-CG1 4.32Å; L43-V65 HydrophobicContact CB-CG2 3.65Å; L43-V65 HydrophobicContact CD1-CG2 3.89Å; L43-V65 HydrophobicContact CG-CG2 4.44Å; T44-V65 HydrophobicContact CG2-CB 3.89Å; T44-V65 HydrophobicContact CG2-CG1 3.89Å; T44-V65 HydrophobicContact CG2-CG2 4.31Å; F62-V65 PolarHBondContact O-N 3.42Å; V65-R136 WeakPolarHBondContact O-CB 3.49Å; V65-G137 WeakPolarHBondContact O-CA 3.28Å; V65-G137 PolarHBondContact O-N 2.97Å
66E91.5Very high92Very high0 Ų043.7 Ų43.70%021%0.205CC..  trans-135.8137.8175.5-17853.7-94.900108.9Y31 S34 N68 A71 V72 G137 Y200Y31-E66 WeakPolarHBondContact CA-O 3.18Å; Y31-E66 VanDerWaalsContact CD2-O 3.28Å; Y31-E66 WeakPolarHBondContact CD2-O 3.22Å; S34-E66 VanDerWaalsContact CB-O 3.26Å; S34-E66 WeakPolarHBondContact CB-O 3.3Å; E66-N68 PolarHBondContact OE1-N 2.96Å; E66-A71 HydrophobicContact CG-CB 3.89Å; E66-V72 HydrophobicContact CB-CG2 3.65Å; E66-V72 HydrophobicContact CG-CB 4.44Å; E66-V72 HydrophobicContact CG-CG2 3.41Å; E66-V72 VanDerWaalsContact CG-CG2 3.41Å; E66-G137 VanDerWaalsContact OE2-CA 3.28Å; E66-G137 WeakPolarHBondContact OE2-CA 3.28Å; E66-Y200 PolarHBondContact OE1-OH 3.45Å; E66-Y200 VanDerWaalsContact OE2-CE1 3.28Å; E66-Y200 WeakPolarHBondContact OE2-CE1 3.29Å
67S86.6Confident91.9Very high22 Ų2243.2 Ų43.215%0.15421%0.209CC..  trans-101.6-26.2-174.164.90000113.3S34 R136S34-S67 VanDerWaalsContact OG-CA 3.31Å; S34-S67 WeakPolarHBondContact OG-CA 3.33Å; S34-S67 VanDerWaalsContact OG-CB 3.24Å; S34-S67 WeakPolarHBondContact OG-CB 3.34Å; S67-R136 PolarHBondContact OG-NH2 3.41Å
68N86.1Confident91.7Very high19 Ų1938.5 Ų38.510%0.10219%0.193CC..  trans-98.8118-177-175.8-15.2000109.3E66 W70 A71 V72E66-N68 PolarHBondContact OE1-N 2.96Å; N68-W70 PolarHBondContact O-N 3.19Å; N68-W70 WeakPolarHBondContact OD1-CB 3.14Å; N68-W70 PolarHBondContact OD1-N 3.29Å; N68-A71 HydrophobicContact CB-CB 3.85Å; N68-A71 WeakPolarHBondContact O-CA 3.29Å; N68-A71 WeakPolarHBondContact O-CB 3.39Å; N68-A71 PolarHBondContact O-N 3.05Å; N68-V72 PolarHBondContact O-N 2.68Å
69I86.9Confident91.7Very high81 Ų8138.5 Ų38.542%0.41519%0.193SC..Hα-helixtrans-58.9-32.8178.9-166.5155.4000112.7Y31 A71 V72 I73Y31-I69 HydrophobicContact CE1-CD1 4.35Å; Y31-I69 HydrophobicContact CE2-CB 3.98Å; I69-A71 VanDerWaalsContact C-N 3.35Å; I69-V72 PolarHBondContact O-N 3.11Å; I69-I73 HydrophobicContact CG1-CD1 4.23Å; I69-I73 VanDerWaalsContact O-CG1 3.29Å; I69-I73 WeakPolarHBondContact O-CG1 2.99Å; I69-I73 PolarHBondContact O-N 3.16Å
70W87.3Confident91.5Very high167 Ų16741.4 Ų41.463%0.63321%0.205SC*.Hα-helixtrans-68.7-36.6175.3-60.3112.1000111.7N68 I73 F74N68-W70 PolarHBondContact O-N 3.19Å; N68-W70 WeakPolarHBondContact OD1-CB 3.14Å; N68-W70 PolarHBondContact OD1-N 3.29Å; W70-I73 HydrophobicContact CE3-CD1 4.21Å; W70-I73 HydrophobicContact CZ3-CD1 4.39Å; W70-I73 PolarHBondContact O-N 3.15Å; W70-F74 VanDerWaalsContact O-CB 3.27Å; W70-F74 WeakPolarHBondContact O-CB 3.31Å; W70-F74 PolarHBondContact O-N 3.49Å
71A87.8Confident91.1Very high4 Ų438 Ų383%0.03320%0.196CC..Hα-helixtrans-66.4-42.4172.900000110.8E66 N68 I69 I73 F74 D75 Y200E66-A71 HydrophobicContact CG-CB 3.89Å; N68-A71 HydrophobicContact CB-CB 3.85Å; N68-A71 WeakPolarHBondContact O-CA 3.29Å; N68-A71 WeakPolarHBondContact O-CB 3.39Å; N68-A71 PolarHBondContact O-N 3.05Å; I69-A71 VanDerWaalsContact C-N 3.35Å; A71-I73 PolarHBondContact O-N 2.87Å; A71-F74 PolarHBondContact O-N 3.24Å; A71-D75 VanDerWaalsContact O-CB 3.27Å; A71-D75 WeakPolarHBondContact O-CB 3.48Å; A71-D75 PolarHBondContact O-N 2.93Å; A71-Y200 HydrophobicContact CB-CE1 4.42Å
72V91.8Very high90.7Very high10 Ų1036.6 Ų36.66%0.06119%0.188CC..Hα-helixtrans-57.4-49173.8177.90000111.4Y31 E66 N68 I69 F74 D75 M76Y31-V72 HydrophobicContact CD2-CG2 3.61Å; Y31-V72 HydrophobicContact CE2-CG2 4.4Å; Y31-V72 HydrophobicContact CG-CG2 4.09Å; E66-V72 HydrophobicContact CB-CG2 3.65Å; E66-V72 HydrophobicContact CG-CB 4.44Å; E66-V72 HydrophobicContact CG-CG2 3.41Å; E66-V72 VanDerWaalsContact CG-CG2 3.41Å; N68-V72 PolarHBondContact O-N 2.68Å; I69-V72 PolarHBondContact O-N 3.11Å; V72-F74 VanDerWaalsContact C-N 3.3Å; V72-F74 PolarHBondContact O-N 3.03Å; V72-D75 PolarHBondContact O-N 3.47Å; V72-M76 HydrophobicContact CG1-CG 4.27Å; V72-M76 HydrophobicContact CG1-SD 3.77Å; V72-M76 WeakPolarHBondContact O-CB 3.42Å; V72-M76 WeakPolarHBondContact O-CG 3.21Å; V72-M76 PolarHBondContact O-N 3.43Å
73I91.5Very high90.4Very high91 Ų9136.6 Ų36.647%0.46719%0.188SC..Hα-helixtrans-61.4-43.3179.7-69.1166.4000110.4I69 W70 A71 M76 A77I69-I73 HydrophobicContact CG1-CD1 4.23Å; I69-I73 VanDerWaalsContact O-CG1 3.29Å; I69-I73 WeakPolarHBondContact O-CG1 2.99Å; I69-I73 PolarHBondContact O-N 3.16Å; W70-I73 HydrophobicContact CE3-CD1 4.21Å; W70-I73 HydrophobicContact CZ3-CD1 4.39Å; W70-I73 PolarHBondContact O-N 3.15Å; A71-I73 PolarHBondContact O-N 2.87Å; I73-M76 PolarHBondContact O-N 3.49Å; I73-A77 WeakPolarHBondContact O-CB 3.42Å; I73-A77 PolarHBondContact O-N 3.38Å
74F89.9Confident90Very high73 Ų7339.8 Ų39.832%0.3220%0.2SC..Hα-helixtrans-64.7-45.4178.4-170.2-113.3000111.9W70 A71 V72 A77 L78 V175 Y179W70-F74 VanDerWaalsContact O-CB 3.27Å; W70-F74 WeakPolarHBondContact O-CB 3.31Å; W70-F74 PolarHBondContact O-N 3.49Å; A71-F74 PolarHBondContact O-N 3.24Å; V72-F74 VanDerWaalsContact C-N 3.3Å; V72-F74 PolarHBondContact O-N 3.03Å; F74-A77 PolarHBondContact O-N 2.86Å; F74-L78 HydrophobicContact CD1-CD1 3.5Å; F74-L78 HydrophobicContact CD2-CD1 4.06Å; F74-L78 HydrophobicContact CE1-CD1 3.14Å; F74-L78 HydrophobicContact CE2-CD1 3.74Å; F74-L78 HydrophobicContact CG-CD1 3.96Å; F74-L78 HydrophobicContact CZ-CD1 3.28Å; F74-L78 WeakPolarHBondContact O-CB 3.43Å; F74-L78 PolarHBondContact O-N 2.81Å; F74-V175 HydrophobicContact CE1-CG1 3.92Å; F74-V175 HydrophobicContact CZ-CG1 3.75Å; F74-V175 HydrophobicContact CZ-CG2 4.44Å; F74-Y179 HydrophobicContact CD1-CE1 4.4Å; F74-Y179 AromaticContact CD1-CZ 3.89Å; F74-Y179 WeakPolarHBondContact CD1-OH 3.42Å; F74-Y179 HydrophobicContact CE1-CE1 4.34Å; F74-Y179 AromaticContact CE1-CE2 3.76Å; F74-Y179 HydrophobicContact CE1-CE2 3.76Å; F74-Y179 AromaticContact CE1-CZ 3.59Å; F74-Y179 WeakPolarHBondContact CE1-OH 3.39Å
75D93.2Very high89.4Confident1 Ų137 Ų371%0.00519%0.186CC..Hα-helixtrans-60.8-45.2176-71.9-7.7000110.9A71 V72 A77 L78 L79 L138 N142A71-D75 VanDerWaalsContact O-CB 3.27Å; A71-D75 WeakPolarHBondContact O-CB 3.48Å; A71-D75 PolarHBondContact O-N 2.93Å; V72-D75 PolarHBondContact O-N 3.47Å; D75-A77 PolarHBondContact O-N 3.41Å; D75-L78 PolarHBondContact O-N 2.8Å; D75-L79 WeakPolarHBondContact O-CB 3.5Å; D75-L79 PolarHBondContact O-N 3.26Å; D75-L138 HydrophobicContact CB-CB 4.07Å; D75-L138 HydrophobicContact CB-CD2 4.28Å; D75-L138 VanDerWaalsContact OD2-CB 3.28Å; D75-L138 WeakPolarHBondContact OD2-CB 3.45Å; D75-L138 PolarHBondContact OD2-N 3.07Å; D75-N142 PolarHBondContact OD1-ND2 3.13Å
76M94Very high89Confident42 Ų4237 Ų3721%0.20719%0.186CC..Hα-helixtrans-61.9-42.4175.8-71.5175100.300111.8F24 L27 V72 I73 H80F24-M76 HydrophobicContact CB-CE 4.26Å; F24-M76 HydrophobicContact CD1-CE 3.29Å; F24-M76 HydrophobicContact CD1-CG 4.42Å; F24-M76 HydrophobicContact CE1-CB 3.99Å; F24-M76 HydrophobicContact CE1-CE 3.75Å; F24-M76 HydrophobicContact CE1-CG 4.22Å; F24-M76 HydrophobicContact CG-CE 4.01Å; F24-M76 HydrophobicContact CZ-CB 4.06Å; F24-M76 HydrophobicContact CZ-CG 4.49Å; F24-M76 VanDerWaalsContact CZ-O 3.28Å; F24-M76 WeakPolarHBondContact CZ-O 3.13Å; L27-M76 HydrophobicContact CD1-CG 4.06Å; V72-M76 HydrophobicContact CG1-CG 4.27Å; V72-M76 HydrophobicContact CG1-SD 3.77Å; V72-M76 WeakPolarHBondContact O-CB 3.42Å; V72-M76 WeakPolarHBondContact O-CG 3.21Å; V72-M76 PolarHBondContact O-N 3.43Å; I73-M76 PolarHBondContact O-N 3.49Å; M76-H80 VanDerWaalsContact O-CB 3.28Å; M76-H80 WeakPolarHBondContact O-CB 3.27Å; M76-H80 PolarHBondContact O-N 3.01Å
77A91.6Very high88.6Confident60 Ų6038.6 Ų38.650%0.49619%0.194SC..Hα-helixtrans-64.7-45.2178.500000112.1I73 F74 D75 H80 A81I73-A77 WeakPolarHBondContact O-CB 3.42Å; I73-A77 PolarHBondContact O-N 3.38Å; F74-A77 PolarHBondContact O-N 2.86Å; D75-A77 PolarHBondContact O-N 3.41Å; A77-H80 PolarHBondContact O-N 2.84Å; A77-A81 PolarHBondContact O-N 3Å
78L91Very high88.4Confident20 Ų2041.4 Ų41.411%0.10521%0.211CC..Hα-helixtrans-67.2-42.2176.9-91.7141000112.3F74 D75 H80 A81 A82 N142 I146F74-L78 HydrophobicContact CD1-CD1 3.5Å; F74-L78 HydrophobicContact CD2-CD1 4.06Å; F74-L78 HydrophobicContact CE1-CD1 3.14Å; F74-L78 HydrophobicContact CE2-CD1 3.74Å; F74-L78 HydrophobicContact CG-CD1 3.96Å; F74-L78 HydrophobicContact CZ-CD1 3.28Å; F74-L78 WeakPolarHBondContact O-CB 3.43Å; F74-L78 PolarHBondContact O-N 2.81Å; D75-L78 PolarHBondContact O-N 2.8Å; L78-H80 VanDerWaalsContact C-N 3.34Å; L78-A81 PolarHBondContact O-N 2.85Å; L78-A82 WeakPolarHBondContact O-CB 3.26Å; L78-A82 PolarHBondContact O-N 3.08Å; L78-N142 HydrophobicContact CD1-CB 4.27Å; L78-I146 HydrophobicContact CD2-CD1 3.59Å; L78-I146 HydrophobicContact CD2-CG1 3.61Å
79L92.9Very high88Confident0 Ų041.1 Ų41.10%021%0.21CC..Hα-helixtrans-63.3-41.3176.4-170.564.4000111.4F24 L27 D75 A82 F83 F99 L138 F141F24-L79 HydrophobicContact CD2-CD2 3.94Å; F24-L79 HydrophobicContact CE2-CB 4.2Å; F24-L79 HydrophobicContact CE2-CD2 3.8Å; F24-L79 HydrophobicContact CE2-CG 4.07Å; L27-L79 HydrophobicContact CD1-CD2 4.02Å; D75-L79 WeakPolarHBondContact O-CB 3.5Å; D75-L79 PolarHBondContact O-N 3.26Å; L79-A82 PolarHBondContact O-N 3.49Å; L79-F83 HydrophobicContact CD1-CD1 4.27Å; L79-F83 HydrophobicContact CD1-CD2 4.01Å; L79-F83 HydrophobicContact CD1-CE1 3.7Å; L79-F83 HydrophobicContact CD1-CE2 3.41Å; L79-F83 VanDerWaalsContact CD1-CE2 3.41Å; L79-F83 HydrophobicContact CD1-CG 4.41Å; L79-F83 HydrophobicContact CD1-CZ 3.23Å; L79-F83 HydrophobicContact CD2-CE2 3.98Å; L79-F83 HydrophobicContact CD2-CZ 4.45Å; L79-F83 HydrophobicContact CG-CD2 3.9Å; L79-F83 HydrophobicContact CG-CE2 3.52Å; L79-F83 HydrophobicContact CG-CZ 3.92Å; L79-F83 WeakPolarHBondContact O-CB 3.23Å; L79-F83 WeakPolarHBondContact O-CG 3.27Å; L79-F83 PolarHBondContact O-N 2.91Å; L79-F99 HydrophobicContact CD1-CD2 4.35Å; L79-F99 HydrophobicContact CD1-CE2 4.09Å; L79-L138 HydrophobicContact CB-CD2 4.33Å; L79-L138 HydrophobicContact CD1-CD2 4.06Å; L79-L138 HydrophobicContact CD2-CD2 4.21Å; L79-L138 HydrophobicContact CG-CD2 4.45Å; L79-F141 HydrophobicContact CD1-CD1 4.24Å; L79-F141 HydrophobicContact CD1-CE1 3.45Å; L79-F141 VanDerWaalsContact CD1-CE1 3.45Å; L79-F141 HydrophobicContact CD1-CZ 4.06Å
80H91.3Very high87.7Confident68 Ų6837.6 Ų37.632%0.31519%0.191SC..Hα-helixtrans-59.8-51173.6-174.665.5000111.4F24 M76 A77 L78 A82 R84F24-H80 HydrophobicContact CZ-CB 4.01Å; M76-H80 VanDerWaalsContact O-CB 3.28Å; M76-H80 WeakPolarHBondContact O-CB 3.27Å; M76-H80 PolarHBondContact O-N 3.01Å; A77-H80 PolarHBondContact O-N 2.84Å; L78-H80 VanDerWaalsContact C-N 3.34Å; H80-A82 VanDerWaalsContact C-N 3.32Å; H80-A82 PolarHBondContact O-N 3.42Å; H80-R84 WeakPolarHBondContact O-CB 3.4Å; H80-R84 PolarHBondContact O-N 2.94Å
81A86.6Confident87.4Confident32 Ų3230.9 Ų30.926%0.26417%0.173SC..Hα-helixtrans-61.6-42.2177.800000111.7A77 L78 V85A77-A81 PolarHBondContact O-N 3Å; L78-A81 PolarHBondContact O-N 2.85Å; A81-V85 WeakPolarHBondContact O-CB 3.42Å; A81-V85 VanDerWaalsContact O-CG2 3.3Å; A81-V85 WeakPolarHBondContact O-CG2 3.5Å; A81-V85 PolarHBondContact O-N 2.86Å; A81-V85 VanDerWaalsContact O-N 3.07Å
82A87.4Confident87.3Confident0 Ų033.6 Ų33.60%019%0.191CC..Hα-helixtrans-58.5-57.1179.400000110.4L78 L79 H80 V85 L86 F141 V145L78-A82 WeakPolarHBondContact O-CB 3.26Å; L78-A82 PolarHBondContact O-N 3.08Å; L79-A82 PolarHBondContact O-N 3.49Å; H80-A82 VanDerWaalsContact C-N 3.32Å; H80-A82 PolarHBondContact O-N 3.42Å; A82-V85 PolarHBondContact O-N 3.22Å; A82-L86 HydrophobicContact CB-CD1 4.45Å; A82-L86 WeakPolarHBondContact O-CB 3.39Å; A82-L86 WeakPolarHBondContact O-CG 3.41Å; A82-L86 PolarHBondContact O-N 3.27Å; A82-F141 HydrophobicContact CB-CE1 4.5Å; A82-V145 HydrophobicContact CB-CB 4.28Å; A82-V145 HydrophobicContact CB-CG1 3.47Å; A82-V145 VanDerWaalsContact CB-CG1 3.47Å; A82-V145 HydrophobicContact CB-CG2 3.74Å
83F88.9Confident87.1Confident0 Ų040.9 Ų40.90%022%0.222CC..Hα-helixtrans-73.2-33.2-174.2-65.5-25.5000112.5F19 H20 T23 L79 V85 E87 V95 F99 F141F19-F83 HydrophobicContact CD1-CE1 4.15Å; F19-F83 AromaticContact CD1-CE2 3.82Å; F19-F83 HydrophobicContact CD1-CE2 3.82Å; F19-F83 AromaticContact CD1-CZ 3.57Å; F19-F83 HydrophobicContact CD1-CZ 3.57Å; F19-F83 AromaticContact CE1-CE1 3.72Å; F19-F83 HydrophobicContact CE1-CE1 3.72Å; F19-F83 AromaticContact CE1-CE2 3.93Å; F19-F83 HydrophobicContact CE1-CE2 3.93Å; F19-F83 AromaticContact CE1-CZ 3.21Å; F19-F83 HydrophobicContact CE1-CZ 3.21Å; F19-F83 HydrophobicContact CZ-CZ 4.27Å; H20-F83 HydrophobicContact CB-CD2 4.25Å; H20-F83 VanDerWaalsContact CD2-CB 3.48Å; H20-F83 WeakPolarHBondContact CD2-CB 3.23Å; H20-F83 AromaticContact CD2-CD2 3.54Å; H20-F83 WeakPolarHBondContact CE1-CB 3.21Å; H20-F83 AromaticContact CE1-CD2 3.93Å; H20-F83 AromaticContact CE1-CG 3.89Å; H20-F83 AromaticContact CG-CD2 3.52Å; H20-F83 AromaticContact ND1-CD2 3.75Å; H20-F83 WeakPolarHBondContact NE2-CB 3.45Å; H20-F83 AromaticContact NE2-CD2 3.84Å; H20-F83 AromaticContact NE2-CG 3.84Å; T23-F83 HydrophobicContact CG2-CE2 4.34Å; T23-F83 HydrophobicContact CG2-CZ 4.34Å; T23-F83 WeakPolarHBondContact OG1-CE2 3.06Å; L79-F83 HydrophobicContact CD1-CD1 4.27Å; L79-F83 HydrophobicContact CD1-CD2 4.01Å; L79-F83 HydrophobicContact CD1-CE1 3.7Å; L79-F83 HydrophobicContact CD1-CE2 3.41Å; L79-F83 VanDerWaalsContact CD1-CE2 3.41Å; L79-F83 HydrophobicContact CD1-CG 4.41Å; L79-F83 HydrophobicContact CD1-CZ 3.23Å; L79-F83 HydrophobicContact CD2-CE2 3.98Å; L79-F83 HydrophobicContact CD2-CZ 4.45Å; L79-F83 HydrophobicContact CG-CD2 3.9Å; L79-F83 HydrophobicContact CG-CE2 3.52Å; L79-F83 HydrophobicContact CG-CZ 3.92Å; L79-F83 WeakPolarHBondContact O-CB 3.23Å; L79-F83 WeakPolarHBondContact O-CG 3.27Å; L79-F83 PolarHBondContact O-N 2.91Å; F83-V85 VanDerWaalsContact C-N 3.25Å; F83-V85 PolarHBondContact O-N 2.88Å; F83-E87 WeakPolarHBondContact O-CA 3.35Å; F83-E87 WeakPolarHBondContact O-CB 3.42Å; F83-E87 PolarHBondContact O-N 3.03Å; F83-V95 HydrophobicContact CD1-CG1 3.24Å; F83-V95 HydrophobicContact CE1-CG1 3.34Å; F83-V95 HydrophobicContact CG-CG1 4.23Å; F83-V95 HydrophobicContact CZ-CG1 4.38Å; F83-F99 HydrophobicContact CE1-CD2 4.23Å; F83-F99 AromaticContact CZ-CD2 3.99Å; F83-F99 HydrophobicContact CZ-CD2 3.99Å; F83-F99 HydrophobicContact CZ-CE2 4.43Å; F83-F141 HydrophobicContact CE1-CZ 4.21Å
84R85.1Confident86.8Confident84 Ų8437.1 Ų37.132%0.31721%0.205SC..Hα-helixtrans-58.3-41.2172.3-172.5-170.3-178.1174.4-1.5111.7H80 P88 L252 L253 D254H80-R84 WeakPolarHBondContact O-CB 3.4Å; H80-R84 PolarHBondContact O-N 2.94Å; R84-P88 WeakPolarHBondContact O-CD 3.47Å; R84-P88 WeakPolarHBondContact O-CG 3.39Å; R84-L252 WeakPolarHBondContact CD-O 3.48Å; R84-L252 WeakPolarHBondContact CG-O 3.48Å; R84-L252 VanDerWaalsContact CZ-O 3.25Å; R84-L252 PolarHBondContact NE-O 3.29Å; R84-L252 PolarHBondContact NH2-O 3.09Å; R84-L252 WeakPolarHBondContact O-CD2 3.32Å; R84-L253 VanDerWaalsContact NH1-C 3.34Å; R84-L253 PolarHBondContact NH1-O 3.18Å; R84-L253 PolarHBondContact NH2-O 3.18Å; R84-D254 VanDerWaalsContact NH2-N 3.17Å
85V83.2Confident86.7Confident2 Ų233.7 Ų33.71%0.01219%0.19CC..Hα-helixtrans-80.2-46.7179.9175.70000111.3A81 A82 F83 I89 L149 F153 F249 L252 L253A81-V85 WeakPolarHBondContact O-CB 3.42Å; A81-V85 VanDerWaalsContact O-CG2 3.3Å; A81-V85 WeakPolarHBondContact O-CG2 3.5Å; A81-V85 PolarHBondContact O-N 2.86Å; A81-V85 VanDerWaalsContact O-N 3.07Å; A82-V85 PolarHBondContact O-N 3.22Å; F83-V85 VanDerWaalsContact C-N 3.25Å; F83-V85 PolarHBondContact O-N 2.88Å; V85-I89 HydrophobicContact CG1-CD1 3.9Å; V85-I89 WeakPolarHBondContact O-CD1 3.3Å; V85-I89 WeakPolarHBondContact O-CG1 3.34Å; V85-L149 HydrophobicContact CB-CD2 4.1Å; V85-L149 HydrophobicContact CG1-CD2 3.68Å; V85-L149 HydrophobicContact CG2-CD2 4.49Å; V85-F153 HydrophobicContact CG1-CD2 4.47Å; V85-F153 HydrophobicContact CG1-CE2 3.77Å; V85-F249 HydrophobicContact CG1-CE2 4.4Å; V85-L252 WeakPolarHBondContact O-CD2 3.37Å; V85-L253 HydrophobicContact CG2-CD1 3.89Å; V85-L253 HydrophobicContact CG2-CD2 4.07Å; V85-L253 HydrophobicContact CG2-CG 3.84Å
86L84.4Confident86.6Confident2 Ų236.8 Ų36.81%0.0120%0.202CC..Hα-helixtrans-84.1-28.4-169.6-59.9175.2000113.3A82 I89 W90 V95 Y98 T148A82-L86 HydrophobicContact CB-CD1 4.45Å; A82-L86 WeakPolarHBondContact O-CB 3.39Å; A82-L86 WeakPolarHBondContact O-CG 3.41Å; A82-L86 PolarHBondContact O-N 3.27Å; L86-I89 PolarHBondContact O-N 2.94Å; L86-W90 HydrophobicContact CB-CD2 4.17Å; L86-W90 HydrophobicContact CB-CE3 3.97Å; L86-W90 HydrophobicContact CB-CZ3 4.19Å; L86-W90 HydrophobicContact CD1-CE3 4.4Å; L86-W90 HydrophobicContact CD1-CH2 3.88Å; L86-W90 HydrophobicContact CD1-CZ3 3.78Å; L86-W90 HydrophobicContact CD2-CD2 4.36Å; L86-W90 HydrophobicContact CD2-CH2 3.9Å; L86-W90 HydrophobicContact CD2-CZ2 3.68Å; L86-W90 HydrophobicContact CD2-CZ3 4.27Å; L86-W90 HydrophobicContact CG-CH2 4.36Å; L86-W90 HydrophobicContact CG-CZ3 4.29Å; L86-W90 WeakPolarHBondContact O-CB 3.26Å; L86-W90 PolarHBondContact O-N 3.12Å; L86-V95 HydrophobicContact CB-CG2 4.05Å; L86-Y98 HydrophobicContact CD1-CE1 4.4Å; L86-T148 HydrophobicContact CD2-CG2 3.97Å
87E83.7Confident86.4Confident32 Ų3237.4 Ų37.415%0.1521%0.209CC..Hα-helixtrans-67.2-42.5-178.9-172.7176.9-131.800113.5S17 H20 F83 I89 G91 V95S17-E87 VanDerWaalsContact CB-CD 3.45Å; S17-E87 WeakPolarHBondContact CB-OE1 3.16Å; S17-E87 WeakPolarHBondContact CB-OE2 3.17Å; S17-E87 PolarHBondContact OG-OE1 2.9Å; S17-E87 PolarHBondContact OG-OE2 2.92Å; H20-E87 IonicContact CE1-OE2 3.69Å; H20-E87 PolarHBondContact CE1-OE2 2.96Å; H20-E87 IonicContact ND1-OE2 3.51Å; F83-E87 WeakPolarHBondContact O-CA 3.35Å; F83-E87 WeakPolarHBondContact O-CB 3.42Å; F83-E87 PolarHBondContact O-N 3.03Å; E87-I89 PolarHBondContact O-N 3.05Å; E87-G91 CarbonylContact O-C 3.29Å; E87-G91 WeakPolarHBondContact O-CA 3.37Å; E87-G91 PolarHBondContact O-N 2.93Å; E87-V95 HydrophobicContact CB-CG2 4.05Å
88P82.1Confident86.4Confident81 Ų8135.3 Ų35.353%0.52619%0.188SC..Hα-helixtrans-68.9-27.1175.6-19.933.9000112.7R84 L252R84-P88 WeakPolarHBondContact O-CD 3.47Å; R84-P88 WeakPolarHBondContact O-CG 3.39Å; P88-L252 HydrophobicContact CB-CD2 3.91Å; P88-L252 HydrophobicContact CG-CD2 3.66Å
89I78.7Confident86.5Confident13 Ų1334.4 Ų34.47%0.06718%0.183CC..Hα-helixtrans-78.5-47.7-178.2-67174.9000110.4V85 L86 E87 F153 P243 L252V85-I89 HydrophobicContact CG1-CD1 3.9Å; V85-I89 WeakPolarHBondContact O-CD1 3.3Å; V85-I89 WeakPolarHBondContact O-CG1 3.34Å; L86-I89 PolarHBondContact O-N 2.94Å; E87-I89 PolarHBondContact O-N 3.05Å; I89-F153 HydrophobicContact CD1-CE2 3.86Å; I89-F153 HydrophobicContact CD1-CZ 3.65Å; I89-P243 HydrophobicContact CB-CB 4.41Å; I89-P243 HydrophobicContact CD1-CB 4.04Å; I89-P243 HydrophobicContact CG1-CB 3.94Å; I89-P243 HydrophobicContact CG2-CB 3.74Å; I89-P243 HydrophobicContact CG2-CG 4.37Å; I89-P243 VanDerWaalsContact CG2-N 3.32Å; I89-L252 HydrophobicContact CD1-CD2 4.47Å; I89-L252 HydrophobicContact CG1-CD2 4.34Å
90W79.3Confident86.6Confident8 Ų838.2 Ų38.23%0.0320%0.203CC..Hα-helixtrans-102-11.2-171.9-58.2-8.9000113.4L86 V95 Y98 T148 F240 L241L86-W90 HydrophobicContact CB-CD2 4.17Å; L86-W90 HydrophobicContact CB-CE3 3.97Å; L86-W90 HydrophobicContact CB-CZ3 4.19Å; L86-W90 HydrophobicContact CD1-CE3 4.4Å; L86-W90 HydrophobicContact CD1-CH2 3.88Å; L86-W90 HydrophobicContact CD1-CZ3 3.78Å; L86-W90 HydrophobicContact CD2-CD2 4.36Å; L86-W90 HydrophobicContact CD2-CH2 3.9Å; L86-W90 HydrophobicContact CD2-CZ2 3.68Å; L86-W90 HydrophobicContact CD2-CZ3 4.27Å; L86-W90 HydrophobicContact CG-CH2 4.36Å; L86-W90 HydrophobicContact CG-CZ3 4.29Å; L86-W90 WeakPolarHBondContact O-CB 3.26Å; L86-W90 PolarHBondContact O-N 3.12Å; W90-V95 HydrophobicContact CB-CG2 4.28Å; W90-V95 HydrophobicContact CE3-CG2 4.09Å; W90-Y98 HydrophobicContact CE3-CG 4.31Å; W90-Y98 HydrophobicContact CH2-CD1 4.36Å; W90-Y98 AromaticContact CH2-CD2 3.67Å; W90-Y98 HydrophobicContact CH2-CD2 3.67Å; W90-Y98 HydrophobicContact CH2-CE1 4.43Å; W90-Y98 AromaticContact CH2-CE2 3.74Å; W90-Y98 HydrophobicContact CH2-CE2 3.74Å; W90-Y98 HydrophobicContact CH2-CG 4Å; W90-Y98 AromaticContact CZ3-CD1 3.69Å; W90-Y98 HydrophobicContact CZ3-CD1 3.69Å; W90-Y98 AromaticContact CZ3-CD2 3.51Å; W90-Y98 HydrophobicContact CZ3-CD2 3.51Å; W90-Y98 HydrophobicContact CZ3-CE1 4.14Å; W90-Y98 AromaticContact CZ3-CE2 3.97Å; W90-Y98 HydrophobicContact CZ3-CE2 3.97Å; W90-Y98 AromaticContact CZ3-CG 3.35Å; W90-Y98 HydrophobicContact CZ3-CG 3.35Å; W90-T148 HydrophobicContact CH2-CG2 3.63Å; W90-T148 HydrophobicContact CZ2-CG2 3.61Å; W90-F240 WeakPolarHBondContact CA-O 3.43Å; W90-F240 VanDerWaalsContact CG-O 3.26Å; W90-F240 PolarHBondContact NE1-O 2.97Å; W90-F240 VanDerWaalsContact O-CD1 3.27Å; W90-F240 WeakPolarHBondContact O-CD1 3.49Å; W90-L241 HydrophobicContact CD2-CD2 4.29Å; W90-L241 HydrophobicContact CH2-CD2 3.6Å; W90-L241 HydrophobicContact CZ2-CD2 3.28Å; W90-L241 HydrophobicContact CZ2-CG 4.49Å; W90-L241 HydrophobicContact CZ3-CD2 4.26Å; W90-L241 VanDerWaalsContact NE1-C 3.25Å; W90-L241 VanDerWaalsContact NE1-CA 3.28Å; W90-L241 PolarHBondContact NE1-O 2.9Å
91G81.6Confident86.7Confident25 Ų2539.3 Ų39.326%0.25821%0.211SC..Hα-helixtrans70.9169.6-165.600000113E87 K93 G94 V95E87-G91 CarbonylContact O-C 3.29Å; E87-G91 WeakPolarHBondContact O-CA 3.37Å; E87-G91 PolarHBondContact O-N 2.93Å; G91-K93 PolarHBondContact O-N 3.35Å; G91-G94 PolarHBondContact O-N 3.38Å; G91-V95 PolarHBondContact O-N 2.65Å
92P85.9Confident87.1Confident62 Ų6238 Ų3840%0.40320%0.2SC..Hα-helixtrans-62.4-47.3-174.621.7-32.3000112.3G94 V95 Y96P92-G94 VanDerWaalsContact C-N 3.29Å; P92-G94 PolarHBondContact O-N 2.88Å; P92-V95 PolarHBondContact O-N 3.21Å; P92-Y96 HydrophobicContact CB-CE1 4.12Å; P92-Y96 HydrophobicContact CB-CE2 4.13Å; P92-Y96 WeakPolarHBondContact O-CD1 3.09Å; P92-Y96 WeakPolarHBondContact O-CD2 3.3Å; P92-Y96 WeakPolarHBondContact O-CE1 3.33Å; P92-Y96 PolarHBondContact O-N 2.87Å
93K87.2Confident87.6Confident163 Ų16338.2 Ų38.271%0.70920%0.201SC*.Hα-helixtrans-62.1-35.9-178.3-64.3-176.9-178.2178.70112.8G91 Y96 T97G91-K93 PolarHBondContact O-N 3.35Å; K93-Y96 PolarHBondContact O-N 2.97Å; K93-T97 PolarHBondContact O-N 3.37Å; K93-T97 VanDerWaalsContact O-N 3.09Å; K93-T97 PolarHBondContact O-OG1 3.27Å
94G84.7Confident87.9Confident11 Ų1140.6 Ų40.611%0.11321%0.213CC..Hα-helixtrans-64.8-47.9178.400000111.3G91 P92 Y96 T97 Y98G91-G94 PolarHBondContact O-N 3.38Å; P92-G94 VanDerWaalsContact C-N 3.29Å; P92-G94 PolarHBondContact O-N 2.88Å; G94-Y96 VanDerWaalsContact C-N 3.34Å; G94-Y96 PolarHBondContact O-N 2.82Å; G94-T97 PolarHBondContact O-N 3.22Å; G94-Y98 WeakPolarHBondContact O-CB 3.45Å; G94-Y98 PolarHBondContact O-N 3.44Å
95V87.8Confident88.5Confident1 Ų137.4 Ų37.41%0.00621%0.205CC..Hα-helixtrans-61.8-39.6176.6174.70000112.2F19 F83 L86 E87 W90 G91 P92 Y98 F99F19-V95 HydrophobicContact CE1-CG1 4.37Å; F83-V95 HydrophobicContact CD1-CG1 3.24Å; F83-V95 HydrophobicContact CE1-CG1 3.34Å; F83-V95 HydrophobicContact CG-CG1 4.23Å; F83-V95 HydrophobicContact CZ-CG1 4.38Å; L86-V95 HydrophobicContact CB-CG2 4.05Å; E87-V95 HydrophobicContact CB-CG2 4.05Å; W90-V95 HydrophobicContact CB-CG2 4.28Å; W90-V95 HydrophobicContact CE3-CG2 4.09Å; G91-V95 PolarHBondContact O-N 2.65Å; P92-V95 PolarHBondContact O-N 3.21Å; V95-Y98 PolarHBondContact O-N 3.26Å; V95-F99 WeakPolarHBondContact O-CB 3.44Å; V95-F99 PolarHBondContact O-N 3.15Å
96Y90.7Very high89.1Confident67 Ų6737.3 Ų37.326%0.26320%0.204SC..Hα-helixtrans-66.1-44.2180-54-11.3000111.1F19 P92 K93 G94 F99 L100F19-Y96 HydrophobicContact CB-CD1 3.73Å; F19-Y96 HydrophobicContact CB-CE1 3.04Å; F19-Y96 HydrophobicContact CB-CE2 4.45Å; F19-Y96 VanDerWaalsContact CB-CZ 3.44Å; F19-Y96 WeakPolarHBondContact CB-OH 3.36Å; F19-Y96 AromaticContact CD1-CD1 3.26Å; F19-Y96 HydrophobicContact CD1-CD1 3.26Å; F19-Y96 AromaticContact CD1-CE1 3.41Å; F19-Y96 HydrophobicContact CD1-CE1 3.41Å; F19-Y96 VanDerWaalsContact CD1-CE1 3.41Å; F19-Y96 HydrophobicContact CD1-CG 4.39Å; F19-Y96 AromaticContact CD2-CD1 3.67Å; F19-Y96 HydrophobicContact CD2-CD1 3.67Å; F19-Y96 AromaticContact CD2-CE1 3.9Å; F19-Y96 HydrophobicContact CD2-CE1 3.9Å; F19-Y96 HydrophobicContact CD2-CG 4.15Å; F19-Y96 AromaticContact CE1-CD1 3.61Å; F19-Y96 HydrophobicContact CE1-CD1 3.61Å; F19-Y96 HydrophobicContact CE1-CE1 4.23Å; F19-Y96 HydrophobicContact CE2-CD1 4.02Å; F19-Y96 HydrophobicContact CE2-CG 4.32Å; F19-Y96 AromaticContact CG-CD1 3.27Å; F19-Y96 HydrophobicContact CG-CD1 3.27Å; F19-Y96 AromaticContact CG-CE1 3.18Å; F19-Y96 HydrophobicContact CG-CE1 3.18Å; F19-Y96 HydrophobicContact CG-CG 4.19Å; F19-Y96 AromaticContact CG-CZ 3.95Å; F19-Y96 AromaticContact CZ-CD1 3.99Å; F19-Y96 HydrophobicContact CZ-CD1 3.99Å; F19-Y96 HydrophobicContact CZ-CG 4.49Å; P92-Y96 HydrophobicContact CB-CE1 4.12Å; P92-Y96 HydrophobicContact CB-CE2 4.13Å; P92-Y96 WeakPolarHBondContact O-CD1 3.09Å; P92-Y96 WeakPolarHBondContact O-CD2 3.3Å; P92-Y96 WeakPolarHBondContact O-CE1 3.33Å; P92-Y96 PolarHBondContact O-N 2.87Å; K93-Y96 PolarHBondContact O-N 2.97Å; G94-Y96 VanDerWaalsContact C-N 3.34Å; G94-Y96 PolarHBondContact O-N 2.82Å; Y96-F99 PolarHBondContact O-N 3Å; Y96-L100 WeakPolarHBondContact O-CG 3.46Å; Y96-L100 PolarHBondContact O-N 3.13Å
97T89.8Confident89.6Confident55 Ų5537.2 Ų37.234%0.33720%0.203SC..Hα-helixtrans-64.3-43.5177.8-530000110.5K93 G94 L100 L101K93-T97 PolarHBondContact O-N 3.37Å; K93-T97 VanDerWaalsContact O-N 3.09Å; K93-T97 PolarHBondContact O-OG1 3.27Å; G94-T97 PolarHBondContact O-N 3.22Å; T97-L100 PolarHBondContact O-N 2.98Å; T97-L101 WeakPolarHBondContact O-CB 3.5Å; T97-L101 PolarHBondContact O-N 3.09Å
98Y91.6Very high90.2Very high16 Ų1639.2 Ų39.26%0.06321%0.214CC..Hα-helixtrans-58.9-49.6175.2173-97.6000111.8L86 W90 G94 V95 L100 L101 V102 F141 A144 V145 T148 I211L86-Y98 HydrophobicContact CD1-CE1 4.4Å; W90-Y98 HydrophobicContact CE3-CG 4.31Å; W90-Y98 HydrophobicContact CH2-CD1 4.36Å; W90-Y98 AromaticContact CH2-CD2 3.67Å; W90-Y98 HydrophobicContact CH2-CD2 3.67Å; W90-Y98 HydrophobicContact CH2-CE1 4.43Å; W90-Y98 AromaticContact CH2-CE2 3.74Å; W90-Y98 HydrophobicContact CH2-CE2 3.74Å; W90-Y98 HydrophobicContact CH2-CG 4Å; W90-Y98 AromaticContact CZ3-CD1 3.69Å; W90-Y98 HydrophobicContact CZ3-CD1 3.69Å; W90-Y98 AromaticContact CZ3-CD2 3.51Å; W90-Y98 HydrophobicContact CZ3-CD2 3.51Å; W90-Y98 HydrophobicContact CZ3-CE1 4.14Å; W90-Y98 AromaticContact CZ3-CE2 3.97Å; W90-Y98 HydrophobicContact CZ3-CE2 3.97Å; W90-Y98 AromaticContact CZ3-CG 3.35Å; W90-Y98 HydrophobicContact CZ3-CG 3.35Å; G94-Y98 WeakPolarHBondContact O-CB 3.45Å; G94-Y98 PolarHBondContact O-N 3.44Å; V95-Y98 PolarHBondContact O-N 3.26Å; Y98-L100 PolarHBondContact O-N 3.49Å; Y98-L101 PolarHBondContact O-N 3.48Å; Y98-V102 HydrophobicContact CD1-CG2 4.5Å; Y98-V102 HydrophobicContact CD2-CG2 3.97Å; Y98-V102 HydrophobicContact CE1-CG2 4.27Å; Y98-V102 HydrophobicContact CE2-CG2 3.72Å; Y98-V102 HydrophobicContact CG-CG2 4.35Å; Y98-V102 WeakPolarHBondContact O-CB 3.16Å; Y98-V102 VanDerWaalsContact O-CG2 3.27Å; Y98-V102 WeakPolarHBondContact O-CG2 3.23Å; Y98-V102 PolarHBondContact O-N 2.72Å; Y98-F141 AromaticContact CD1-CE2 3.72Å; Y98-F141 HydrophobicContact CD1-CE2 3.72Å; Y98-F141 HydrophobicContact CD1-CZ 4.37Å; Y98-F141 HydrophobicContact CE1-CD2 4.25Å; Y98-F141 AromaticContact CE1-CE2 3.43Å; Y98-F141 HydrophobicContact CE1-CE2 3.43Å; Y98-F141 VanDerWaalsContact CE1-CE2 3.43Å; Y98-F141 HydrophobicContact CE1-CZ 4.01Å; Y98-A144 PolarHBondContact OH-O 3.2Å; Y98-A144 VanDerWaalsContact OH-O 3.12Å; Y98-V145 HydrophobicContact CE1-CG2 4.11Å; Y98-V145 PolarHBondContact OH-N 3.42Å; Y98-T148 PolarHBondContact OH-OG1 3.1Å; Y98-T148 VanDerWaalsContact OH-OG1 3.06Å; Y98-I211 HydrophobicContact CE2-CD1 3.68Å; Y98-I211 HydrophobicContact CE2-CG1 4.37Å
99F94.2Very high90.8Very high1 Ų140.7 Ų40.70%0.00421%0.213CC..Hα-helixtrans-57.4-48179.2-179.2-89000112.1F19 T23 W63 L79 F83 V95 Y96 N103 L138 F141F19-F99 HydrophobicContact CE1-CB 4.1Å; F19-F99 HydrophobicContact CE1-CG 4.14Å; F19-F99 HydrophobicContact CZ-CB 3.9Å; F19-F99 AromaticContact CZ-CD1 3.72Å; F19-F99 HydrophobicContact CZ-CD1 3.72Å; F19-F99 HydrophobicContact CZ-CD2 4.44Å; F19-F99 HydrophobicContact CZ-CE1 4.37Å; F19-F99 AromaticContact CZ-CG 3.76Å; F19-F99 HydrophobicContact CZ-CG 3.76Å; T23-F99 HydrophobicContact CG2-CE1 4.46Å; T23-F99 HydrophobicContact CG2-CE2 4.49Å; T23-F99 HydrophobicContact CG2-CZ 4.2Å; W63-F99 AromaticContact CD2-CE1 3.96Å; W63-F99 HydrophobicContact CD2-CE1 3.96Å; W63-F99 AromaticContact CD2-CZ 3.66Å; W63-F99 HydrophobicContact CD2-CZ 3.66Å; W63-F99 AromaticContact CE2-CE1 3.66Å; W63-F99 AromaticContact CE2-CZ 3.85Å; W63-F99 HydrophobicContact CE3-CE1 4.26Å; W63-F99 AromaticContact CE3-CZ 3.6Å; W63-F99 HydrophobicContact CE3-CZ 3.6Å; W63-F99 HydrophobicContact CG-CZ 4.35Å; W63-F99 HydrophobicContact CH2-CE1 4.01Å; W63-F99 AromaticContact CH2-CZ 3.91Å; W63-F99 HydrophobicContact CH2-CZ 3.91Å; W63-F99 AromaticContact CZ2-CE1 3.69Å; W63-F99 HydrophobicContact CZ2-CE1 3.69Å; W63-F99 AromaticContact CZ2-CZ 3.98Å; W63-F99 HydrophobicContact CZ2-CZ 3.98Å; W63-F99 HydrophobicContact CZ3-CE1 4.29Å; W63-F99 AromaticContact CZ3-CZ 3.73Å; W63-F99 HydrophobicContact CZ3-CZ 3.73Å; L79-F99 HydrophobicContact CD1-CD2 4.35Å; L79-F99 HydrophobicContact CD1-CE2 4.09Å; F83-F99 HydrophobicContact CE1-CD2 4.23Å; F83-F99 AromaticContact CZ-CD2 3.99Å; F83-F99 HydrophobicContact CZ-CD2 3.99Å; F83-F99 HydrophobicContact CZ-CE2 4.43Å; V95-F99 WeakPolarHBondContact O-CB 3.44Å; V95-F99 PolarHBondContact O-N 3.15Å; Y96-F99 PolarHBondContact O-N 3Å; F99-N103 WeakPolarHBondContact CE1-ND2 2.75Å; F99-N103 VanDerWaalsContact CZ-ND2 3.35Å; F99-N103 WeakPolarHBondContact CZ-ND2 3.25Å; F99-N103 WeakPolarHBondContact O-CB 3.35Å; F99-N103 PolarHBondContact O-N 2.86Å; F99-N103 VanDerWaalsContact O-N 3.15Å; F99-N103 PolarHBondContact O-ND2 3.31Å; F99-L138 HydrophobicContact CE2-CD1 3.81Å; F99-L138 HydrophobicContact CZ-CD1 4.01Å; F99-F141 HydrophobicContact CB-CE2 4.13Å; F99-F141 HydrophobicContact CD2-CD1 4.44Å; F99-F141 AromaticContact CD2-CD2 3.87Å; F99-F141 HydrophobicContact CD2-CD2 3.87Å; F99-F141 HydrophobicContact CD2-CE1 4.12Å; F99-F141 AromaticContact CD2-CE2 3.52Å; F99-F141 HydrophobicContact CD2-CE2 3.52Å; F99-F141 HydrophobicContact CD2-CG 4.32Å; F99-F141 AromaticContact CD2-CZ 3.66Å; F99-F141 HydrophobicContact CD2-CZ 3.66Å; F99-F141 HydrophobicContact CE2-CD1 4.41Å; F99-F141 HydrophobicContact CE2-CD2 4.38Å; F99-F141 HydrophobicContact CE2-CE1 4.36Å; F99-F141 HydrophobicContact CE2-CE2 4.35Å; F99-F141 HydrophobicContact CE2-CG 4.41Å; F99-F141 HydrophobicContact CE2-CZ 4.34Å; F99-F141 HydrophobicContact CG-CE2 4.21Å
100L93.9Very high91.5Very high80 Ų8040 Ų4042%0.41921%0.209SC..Hα-helixtrans-67.6-47179.1-70.6174000111.9Y96 T97 Y98 V102 N103 I104Y96-L100 WeakPolarHBondContact O-CG 3.46Å; Y96-L100 PolarHBondContact O-N 3.13Å; T97-L100 PolarHBondContact O-N 2.98Å; Y98-L100 PolarHBondContact O-N 3.49Å; L100-V102 PolarHBondContact O-N 2.92Å; L100-N103 PolarHBondContact O-N 3.5Å; L100-I104 WeakPolarHBondContact O-CB 3.27Å; L100-I104 WeakPolarHBondContact O-CD1 3.23Å; L100-I104 WeakPolarHBondContact O-CG1 3.27Å; L100-I104 PolarHBondContact O-N 2.76Å
101L94.2Very high92.1Very high91 Ų9139.7 Ų39.748%0.47621%0.208SC..Hα-helixtrans-60.9-46.9-177.4-176.471000111.5T97 Y98 A105T97-L101 WeakPolarHBondContact O-CB 3.5Å; T97-L101 PolarHBondContact O-N 3.09Å; Y98-L101 PolarHBondContact O-N 3.48Å; L101-A105 VanDerWaalsContact O-CB 3.27Å; L101-A105 WeakPolarHBondContact O-CB 3.39Å; L101-A105 PolarHBondContact O-N 2.86Å
102V95.5Very high92.6Very high5 Ų542.2 Ų42.23%0.0322%0.215CC..Hα-helixtrans-63.3-49.1178.9169.10000110.4Y98 L100 I104 A105 V106 F141 A144Y98-V102 HydrophobicContact CD1-CG2 4.5Å; Y98-V102 HydrophobicContact CD2-CG2 3.97Å; Y98-V102 HydrophobicContact CE1-CG2 4.27Å; Y98-V102 HydrophobicContact CE2-CG2 3.72Å; Y98-V102 HydrophobicContact CG-CG2 4.35Å; Y98-V102 WeakPolarHBondContact O-CB 3.16Å; Y98-V102 VanDerWaalsContact O-CG2 3.27Å; Y98-V102 WeakPolarHBondContact O-CG2 3.23Å; Y98-V102 PolarHBondContact O-N 2.72Å; L100-V102 PolarHBondContact O-N 2.92Å; V102-I104 PolarHBondContact O-N 3.44Å; V102-A105 PolarHBondContact O-N 3.26Å; V102-V106 HydrophobicContact CG1-CG2 4.11Å; V102-V106 VanDerWaalsContact O-CB 3.3Å; V102-V106 WeakPolarHBondContact O-CB 3.41Å; V102-V106 WeakPolarHBondContact O-CG2 3.31Å; V102-V106 PolarHBondContact O-N 2.92Å; V102-F141 HydrophobicContact CB-CD2 4.29Å; V102-F141 HydrophobicContact CG1-CB 4.37Å; V102-F141 HydrophobicContact CG1-CD2 4.02Å; V102-A144 HydrophobicContact CB-CB 4.5Å; V102-A144 HydrophobicContact CG1-CB 3.46Å; V102-A144 VanDerWaalsContact CG1-CB 3.46Å; V102-A144 HydrophobicContact CG2-CB 4.2Å
103N96.4Very high92.8Very high4 Ų443.3 Ų43.32%0.02122%0.217CC..Hα-helixtrans-64.1-41.8-178.5-79.8-53.4000112.4F62 F99 L100 V106 G107F62-N103 HydrophobicContact CE1-CB 4.35Å; F62-N103 WeakPolarHBondContact CE1-O 3.47Å; F62-N103 HydrophobicContact CZ-CB 4.23Å; F62-N103 WeakPolarHBondContact CZ-O 3.39Å; F99-N103 WeakPolarHBondContact CE1-ND2 2.75Å; F99-N103 VanDerWaalsContact CZ-ND2 3.35Å; F99-N103 WeakPolarHBondContact CZ-ND2 3.25Å; F99-N103 WeakPolarHBondContact O-CB 3.35Å; F99-N103 PolarHBondContact O-N 2.86Å; F99-N103 VanDerWaalsContact O-N 3.15Å; F99-N103 PolarHBondContact O-ND2 3.31Å; L100-N103 PolarHBondContact O-N 3.5Å; N103-V106 PolarHBondContact O-N 3.4Å; N103-G107 PolarHBondContact O-N 3.33Å
104I96.7Very high92.7Very high50 Ų5037.5 Ų37.526%0.25619%0.194SC..Hα-helixtrans-60.9-49176-68.8164.7000110.4V59 F60 L100 V102 G107 I108V59-I104 HydrophobicContact CG1-CB 4.18Å; V59-I104 HydrophobicContact CG1-CG1 4.2Å; V59-I104 HydrophobicContact CG1-CG2 3.98Å; F60-I104 HydrophobicContact CD1-CD1 4.13Å; F60-I104 HydrophobicContact CD1-CG1 4.22Å; F60-I104 HydrophobicContact CE1-CD1 3.51Å; F60-I104 HydrophobicContact CE1-CG1 3.96Å; F60-I104 HydrophobicContact CZ-CD1 4.23Å; L100-I104 WeakPolarHBondContact O-CB 3.27Å; L100-I104 WeakPolarHBondContact O-CD1 3.23Å; L100-I104 WeakPolarHBondContact O-CG1 3.27Å; L100-I104 PolarHBondContact O-N 2.76Å; V102-I104 PolarHBondContact O-N 3.44Å; I104-G107 PolarHBondContact O-N 3.5Å; I104-I108 HydrophobicContact CG2-CD1 3.78Å; I104-I108 VanDerWaalsContact O-CG1 3.31Å; I104-I108 WeakPolarHBondContact O-CG1 3.35Å; I104-I108 PolarHBondContact O-N 2.86Å
105A96.6Very high92.8Very high17 Ų1738.1 Ų38.114%0.1420%0.196CC..Hα-helixtrans-62.2-48.5179.400000111.4L101 V102 G107 I108 F109 V210L101-A105 VanDerWaalsContact O-CB 3.27Å; L101-A105 WeakPolarHBondContact O-CB 3.39Å; L101-A105 PolarHBondContact O-N 2.86Å; V102-A105 PolarHBondContact O-N 3.26Å; A105-G107 VanDerWaalsContact C-N 3.33Å; A105-G107 PolarHBondContact O-N 3.5Å; A105-I108 PolarHBondContact O-N 3.15Å; A105-F109 HydrophobicContact CB-CD2 4.2Å; A105-F109 HydrophobicContact CB-CE2 4.27Å; A105-F109 WeakPolarHBondContact O-CB 3.33Å; A105-F109 WeakPolarHBondContact O-CD2 3.4Å; A105-F109 PolarHBondContact O-N 3.41Å; A105-V210 HydrophobicContact CB-CG1 3.64Å; A105-V210 HydrophobicContact CB-CG2 4.18Å
106V97.1Very high92.7Very high0 Ų041.7 Ų41.70%022%0.218CC..Hα-helixtrans-57-46.9176.6166.40000111V102 N103 I108 T110 M203V102-V106 HydrophobicContact CG1-CG2 4.11Å; V102-V106 VanDerWaalsContact O-CB 3.3Å; V102-V106 WeakPolarHBondContact O-CB 3.41Å; V102-V106 WeakPolarHBondContact O-CG2 3.31Å; V102-V106 PolarHBondContact O-N 2.92Å; N103-V106 PolarHBondContact O-N 3.4Å; V106-I108 PolarHBondContact O-N 2.96Å; V106-T110 WeakPolarHBondContact O-CB 3.4Å; V106-T110 PolarHBondContact O-N 2.9Å; V106-T110 PolarHBondContact O-OG1 2.89Å; V106-M203 HydrophobicContact CG1-CE 4.47Å
107G95.1Very high92.4Very high0 Ų040.2 Ų40.20%022%0.22CC..Hα-helixtrans-58.7-48.717900000112I45 N103 I104 A105 C111I45-G107 VanDerWaalsContact CD1-CA 3.44Å; N103-G107 PolarHBondContact O-N 3.33Å; I104-G107 PolarHBondContact O-N 3.5Å; A105-G107 VanDerWaalsContact C-N 3.33Å; A105-G107 PolarHBondContact O-N 3.5Å; G107-C111 WeakPolarHBondContact O-CB 3.27Å; G107-C111 PolarHBondContact O-N 3.24Å
108I94.8Very high91.8Very high74 Ų7440.5 Ų40.538%0.37922%0.215SC..Hα-helixtrans-65.9-50.9179.8-65.8168.5000111.2V59 I104 A105 V106 C111 L112V59-I108 HydrophobicContact CG1-CG1 4.2Å; I104-I108 HydrophobicContact CG2-CD1 3.78Å; I104-I108 VanDerWaalsContact O-CG1 3.31Å; I104-I108 WeakPolarHBondContact O-CG1 3.35Å; I104-I108 PolarHBondContact O-N 2.86Å; A105-I108 PolarHBondContact O-N 3.15Å; V106-I108 PolarHBondContact O-N 2.96Å; I108-C111 PolarHBondContact O-N 3.16Å; I108-L112 HydrophobicContact CG2-CD1 3.97Å; I108-L112 HydrophobicContact CG2-CG 4.47Å; I108-L112 WeakPolarHBondContact O-CG 3.48Å; I108-L112 PolarHBondContact O-N 3.36Å
109F95.4Very high91.4Very high111 Ų11143 Ų4349%0.48724%0.239SC..Hα-helixtrans-66.9-40.5-176.7-76.8-65.3000112.4A105 C111 L112 L113 V210A105-F109 HydrophobicContact CB-CD2 4.2Å; A105-F109 HydrophobicContact CB-CE2 4.27Å; A105-F109 WeakPolarHBondContact O-CB 3.33Å; A105-F109 WeakPolarHBondContact O-CD2 3.4Å; A105-F109 PolarHBondContact O-N 3.41Å; F109-C111 VanDerWaalsContact C-N 3.33Å; F109-L112 PolarHBondContact O-N 2.7Å; F109-L113 WeakPolarHBondContact O-CB 3.47Å; F109-L113 VanDerWaalsContact O-CG 3.31Å; F109-L113 WeakPolarHBondContact O-CG 3.06Å; F109-L113 PolarHBondContact O-N 3.34Å; F109-V210 HydrophobicContact CD2-CG2 3.56Å; F109-V210 HydrophobicContact CE2-CG2 4.1Å; F109-V210 HydrophobicContact CG-CG2 4.37Å
110T93.2Very high91Very high0 Ų050.7 Ų50.70%027%0.272CS..Hα-helixtrans-64.6-41.6176.2-52.10000110.6V106 L113 L114 I135 L202 M203 T206V106-T110 WeakPolarHBondContact O-CB 3.4Å; V106-T110 PolarHBondContact O-N 2.9Å; V106-T110 PolarHBondContact O-OG1 2.89Å; T110-L113 PolarHBondContact O-N 2.92Å; T110-L114 WeakPolarHBondContact O-CB 3.17Å; T110-L114 PolarHBondContact O-N 3.32Å; T110-I135 HydrophobicContact CG2-CD1 3.72Å; T110-I135 HydrophobicContact CG2-CG1 4.03Å; T110-I135 HydrophobicContact CG2-CG2 4.16Å; T110-L202 HydrophobicContact CG2-CD2 3.88Å; T110-L202 HydrophobicContact CG2-CG 4.07Å; T110-M203 HydrophobicContact CG2-CG 3.77Å; T110-T206 PolarHBondContact OG1-OG1 3.41Å
111C91.9Very high90.3Very high1 Ų154.4 Ų54.41%0.00729%0.286CS..Hα-helixtrans-61.2-45175.1-176.60000112I45 L50 G107 I108 F109 L114 S115 I135I45-C111 HydrophobicContact CG2-CB 4Å; L50-C111 HydrophobicContact CD2-CB 4.27Å; L50-C111 VanDerWaalsContact CD2-SG 3.57Å; G107-C111 WeakPolarHBondContact O-CB 3.27Å; G107-C111 PolarHBondContact O-N 3.24Å; I108-C111 PolarHBondContact O-N 3.16Å; F109-C111 VanDerWaalsContact C-N 3.33Å; C111-L114 PolarHBondContact O-N 3.26Å; C111-S115 WeakPolarHBondContact O-CB 3.45Å; C111-S115 PolarHBondContact O-N 3.3Å; C111-S115 PolarHBondContact O-OG 3.09Å; C111-S115 VanDerWaalsContact O-OG 3.11Å; C111-I135 HydrophobicContact CB-CD1 4Å
112L91.4Very high89.2Confident77 Ų7760.5 Ų60.540%0.40330%0.302SS..Hα-helixtrans-62.3-45.1176-72.5172.1000112.1F51 I108 F109 L114 S115 V116F51-L112 HydrophobicContact CZ-CD2 3.93Å; I108-L112 HydrophobicContact CG2-CD1 3.97Å; I108-L112 HydrophobicContact CG2-CG 4.47Å; I108-L112 WeakPolarHBondContact O-CG 3.48Å; I108-L112 PolarHBondContact O-N 3.36Å; F109-L112 PolarHBondContact O-N 2.7Å; L112-L114 VanDerWaalsContact C-N 3.32Å; L112-L114 PolarHBondContact O-N 2.74Å; L112-S115 PolarHBondContact O-N 2.89Å; L112-V116 WeakPolarHBondContact O-CB 3.5Å; L112-V116 VanDerWaalsContact O-CG2 3.28Å; L112-V116 WeakPolarHBondContact O-CG2 3Å; L112-V116 PolarHBondContact O-N 2.91Å
113L90Very high87.6Confident85 Ų8563.3 Ų63.345%0.44532%0.319SS..Hα-helixtrans-61.7-41.2177.4-73.1175.1000111.9F109 T110 V116 A117 L202 T206F109-L113 WeakPolarHBondContact O-CB 3.47Å; F109-L113 VanDerWaalsContact O-CG 3.31Å; F109-L113 WeakPolarHBondContact O-CG 3.06Å; F109-L113 PolarHBondContact O-N 3.34Å; T110-L113 PolarHBondContact O-N 2.92Å; L113-V116 PolarHBondContact O-N 3.44Å; L113-A117 WeakPolarHBondContact O-CB 2.89Å; L113-A117 PolarHBondContact O-N 3.29Å; L113-L202 HydrophobicContact CD1-CD1 4.33Å; L113-T206 HydrophobicContact CD1-CG2 3.39Å
114L86.1Confident85.9Confident41 Ų4169.3 Ų69.322%0.21535%0.347CS..Hα-helixtrans-66.9-40.6177.7-170.758.8000111.7P47 T110 C111 L112 A117 Y118 A133 I135P47-L114 HydrophobicContact CG-CB 4.42Å; P47-L114 HydrophobicContact CG-CD2 3.87Å; P47-L114 HydrophobicContact CG-CG 4.3Å; T110-L114 WeakPolarHBondContact O-CB 3.17Å; T110-L114 PolarHBondContact O-N 3.32Å; C111-L114 PolarHBondContact O-N 3.26Å; L112-L114 VanDerWaalsContact C-N 3.32Å; L112-L114 PolarHBondContact O-N 2.74Å; L114-A117 PolarHBondContact O-N 3.4Å; L114-Y118 WeakPolarHBondContact O-CB 3.29Å; L114-Y118 PolarHBondContact O-N 2.8Å; L114-A133 HydrophobicContact CD2-CB 4.42Å; L114-I135 HydrophobicContact CD2-CD1 4.42Å; L114-I135 HydrophobicContact CD2-CG1 4.39Å
115S86.1Confident84Confident24 Ų2473.6 Ų73.617%0.16837%0.366CS..Hα-helixtrans-62.4-41.4173.7-67.30000112.8F51 C111 L112 Y118 A119F51-S115 WeakPolarHBondContact CE2-OG 3.41Å; C111-S115 WeakPolarHBondContact O-CB 3.45Å; C111-S115 PolarHBondContact O-N 3.3Å; C111-S115 PolarHBondContact O-OG 3.09Å; C111-S115 VanDerWaalsContact O-OG 3.11Å; L112-S115 PolarHBondContact O-N 2.89Å; S115-Y118 PolarHBondContact O-N 2.97Å; S115-A119 WeakPolarHBondContact O-CB 3.19Å; S115-A119 PolarHBondContact O-N 3.19Å
116V87.2Confident82Confident76 Ų7678.3 Ų78.346%0.46138%0.38SS..Hα-helixtrans-66.7-45.6176.4171.30000110.5L112 L113 Y118 A119 F120L112-V116 WeakPolarHBondContact O-CB 3.5Å; L112-V116 VanDerWaalsContact O-CG2 3.28Å; L112-V116 WeakPolarHBondContact O-CG2 3Å; L112-V116 PolarHBondContact O-N 2.91Å; L113-V116 PolarHBondContact O-N 3.44Å; V116-Y118 VanDerWaalsContact C-N 3.31Å; V116-Y118 PolarHBondContact O-N 3.31Å; V116-A119 PolarHBondContact O-N 3.04Å; V116-F120 HydrophobicContact CG1-CD2 3.65Å; V116-F120 HydrophobicContact CG1-CE2 3.51Å; V116-F120 WeakPolarHBondContact O-CD2 3.48Å; V116-F120 PolarHBondContact O-N 2.96Å; V116-F120 VanDerWaalsContact O-N 3.09Å
117A83.2Confident80.1Confident36 Ų3680 Ų8030%0.29839%0.389SS..Hα-helixtrans-57.4-45.2175.400000111.2L113 L114 A119 F120 F121L113-A117 WeakPolarHBondContact O-CB 2.89Å; L113-A117 PolarHBondContact O-N 3.29Å; L114-A117 PolarHBondContact O-N 3.4Å; A117-A119 PolarHBondContact O-N 3.2Å; A117-F120 PolarHBondContact O-N 3.49Å; A117-F121 HydrophobicContact CB-CD2 4.34Å; A117-F121 WeakPolarHBondContact O-CD2 3.21Å; A117-F121 PolarHBondContact O-N 3.16Å
118Y77.8Confident78.4Confident62 Ų6281.6 Ų81.624%0.24340%0.396CS..Hα-helixtrans-59.1-45.8175.2177.9-98.8000112.4L114 S115 V116 F120 R122 V123 F128L114-Y118 WeakPolarHBondContact O-CB 3.29Å; L114-Y118 PolarHBondContact O-N 2.8Å; S115-Y118 PolarHBondContact O-N 2.97Å; V116-Y118 VanDerWaalsContact C-N 3.31Å; V116-Y118 PolarHBondContact O-N 3.31Å; Y118-F120 VanDerWaalsContact C-N 3.27Å; Y118-F120 PolarHBondContact O-N 2.81Å; Y118-R122 WeakPolarHBondContact O-CA 3.19Å; Y118-R122 PolarHBondContact O-N 3.08Å; Y118-V123 WeakPolarHBondContact CE2-O 3.17Å; Y118-F128 AromaticContact CD1-CD2 3.87Å; Y118-F128 HydrophobicContact CD1-CD2 3.87Å; Y118-F128 HydrophobicContact CD1-CE2 4.27Å; Y118-F128 HydrophobicContact CD1-CG 4.2Å; Y118-F128 HydrophobicContact CD2-CB 3.85Å; Y118-F128 HydrophobicContact CD2-CD2 4.11Å; Y118-F128 HydrophobicContact CD2-CG 4.29Å; Y118-F128 HydrophobicContact CE1-CB 4.33Å; Y118-F128 HydrophobicContact CE1-CD2 4.36Å; Y118-F128 HydrophobicContact CE1-CG 4.22Å; Y118-F128 HydrophobicContact CE2-CB 3.62Å; Y118-F128 HydrophobicContact CE2-CG 4.3Å; Y118-F128 HydrophobicContact CG-CB 4.29Å; Y118-F128 AromaticContact CG-CD2 3.73Å; Y118-F128 HydrophobicContact CG-CD2 3.73Å; Y118-F128 HydrophobicContact CG-CE2 4.4Å; Y118-F128 HydrophobicContact CG-CG 4.23Å
119A83.5Confident76.6Confident68 Ų6882.4 Ų82.456%0.56240%0.396SS*.Hα-helixtrans-60.5-35.7179.400000113S115 V116 A117S115-A119 WeakPolarHBondContact O-CB 3.19Å; S115-A119 PolarHBondContact O-N 3.19Å; V116-A119 PolarHBondContact O-N 3.04Å; A117-A119 PolarHBondContact O-N 3.2Å
120F84.1Confident75.2Confident162 Ų16279.8 Ų79.871%0.71139%0.39SS*.Hα-helixtrans-80.3-50.3179.1-80.2-67.5000113.5V116 A117 Y118 R122V116-F120 HydrophobicContact CG1-CD2 3.65Å; V116-F120 HydrophobicContact CG1-CE2 3.51Å; V116-F120 WeakPolarHBondContact O-CD2 3.48Å; V116-F120 PolarHBondContact O-N 2.96Å; V116-F120 VanDerWaalsContact O-N 3.09Å; A117-F120 PolarHBondContact O-N 3.49Å; Y118-F120 VanDerWaalsContact C-N 3.27Å; Y118-F120 PolarHBondContact O-N 2.81Å; F120-R122 VanDerWaalsContact C-N 3.33Å
121F80.7Confident73.7Confident159 Ų15981.6 Ų81.670%0.69740%0.402SS*.Hα-helixtrans-81.5-15.2-172.7-66.4-73.4000113A117 V123A117-F121 HydrophobicContact CB-CD2 4.34Å; A117-F121 WeakPolarHBondContact O-CD2 3.21Å; A117-F121 PolarHBondContact O-N 3.16Å; F121-V123 HydrophobicContact CB-CG2 3.67Å; F121-V123 PolarHBondContact O-N 3.45Å
122R71.3Confident72.5Confident219 Ų21983.3 Ų83.383%0.82642%0.417SS*.  trans44.635.1-173.4-63.3-171.5174.9-179.8-1112Y118 F120 E124Y118-R122 WeakPolarHBondContact O-CA 3.19Å; Y118-R122 PolarHBondContact O-N 3.08Å; F120-R122 VanDerWaalsContact C-N 3.33Å; R122-E124 PolarHBondContact O-N 2.89Å
123V62.2Low71.7Confident63 Ų6380 Ų8038%0.38240%0.4SS..  trans-60.1141.7176.5173.40000107.3Y118 F121 E125 M127Y118-V123 WeakPolarHBondContact CE2-O 3.17Å; F121-V123 HydrophobicContact CB-CG2 3.67Å; F121-V123 PolarHBondContact O-N 3.45Å; V123-E125 PolarHBondContact O-N 3.06Å; V123-M127 HydrophobicContact CG1-SD 4.02Å
124E59.4Low71.5Confident130 Ų13076 Ų7661%0.60738%0.38SS*.  trans-33.7130.8-172-62177.6-141.800113.4R122 W126 M127R122-E124 PolarHBondContact O-N 2.89Å; E124-W126 HydrophobicContact CB-CG 4.22Å; E124-W126 VanDerWaalsContact CD-NE1 3.27Å; E124-W126 PolarHBondContact O-N 3.07Å; E124-W126 PolarHBondContact OE2-NE1 2.86Å; E124-M127 PolarHBondContact O-N 3.47Å
125E57.5Low71.7Confident140 Ų14074.1 Ų74.165%0.65437%0.37SS*.THydrogen-bonded Turntrans-43.6-35.3-175.4-71.2-174.2171.500113.3V123 M127 F128 F129V123-E125 PolarHBondContact O-N 3.06Å; E125-M127 PolarHBondContact O-N 3.43Å; E125-M127 VanDerWaalsContact O-N 3.14Å; E125-F128 PolarHBondContact O-N 2.95Å; E125-F128 VanDerWaalsContact O-N 3.07Å; E125-F129 HydrophobicContact CB-CD2 3.99Å; E125-F129 HydrophobicContact CB-CE2 3.87Å; E125-F129 HydrophobicContact CG-CE2 4.38Å; E125-F129 WeakPolarHBondContact O-CD2 2.94Å; E125-F129 PolarHBondContact O-N 3.39Å
126W53.5Low71.9Confident117 Ų11774.8 Ų74.844%0.44337%0.369SS..Hα-helixtrans-57.3-30.4-178.965.7-99.7000114.2E124 F128 F129 T130 I196E124-W126 HydrophobicContact CB-CG 4.22Å; E124-W126 VanDerWaalsContact CD-NE1 3.27Å; E124-W126 PolarHBondContact O-N 3.07Å; E124-W126 PolarHBondContact OE2-NE1 2.86Å; W126-F128 VanDerWaalsContact C-N 3.29Å; W126-F128 PolarHBondContact O-N 2.82Å; W126-F129 PolarHBondContact O-N 3.09Å; W126-T130 WeakPolarHBondContact O-CB 3.45Å; W126-T130 PolarHBondContact O-N 2.91Å; W126-T130 PolarHBondContact O-OG1 3.4Å; W126-I196 HydrophobicContact CH2-CD1 4.27Å; W126-I196 HydrophobicContact CZ3-CD1 4.28Å
127M57.7Low72.2Confident35 Ų3571.2 Ų71.217%0.17235%0.347CS..Hα-helixtrans-66.7-34.5179.8-160.5-177.7-155.400111.1V123 E124 E125 A133 I196 E198V123-M127 HydrophobicContact CG1-SD 4.02Å; E124-M127 PolarHBondContact O-N 3.47Å; E125-M127 PolarHBondContact O-N 3.43Å; E125-M127 VanDerWaalsContact O-N 3.14Å; M127-A133 HydrophobicContact CG-CB 3.91Å; M127-A133 WeakPolarHBondContact O-CB 3.39Å; M127-I196 HydrophobicContact CE-CD1 3.61Å; M127-I196 HydrophobicContact CE-CG1 4.19Å; M127-I196 HydrophobicContact CE-CG2 4.3Å; M127-E198 WeakPolarHBondContact CE-OE1 3.4Å
128F59Low72.7Confident34 Ų3469.5 Ų69.515%0.14933%0.332CS..Hα-helixtrans-81.9-30.4-179.6-162.6-100.3000113P47 F48 Y118 E125 W126P47-F128 HydrophobicContact CB-CD2 4.25Å; P47-F128 HydrophobicContact CB-CE2 3.47Å; P47-F128 VanDerWaalsContact CB-CE2 3.47Å; P47-F128 HydrophobicContact CB-CZ 3.67Å; P47-F128 HydrophobicContact CG-CE2 4.29Å; F48-F128 HydrophobicContact CB-CD1 3.72Å; F48-F128 HydrophobicContact CB-CE1 3.6Å; F48-F128 WeakPolarHBondContact CB-O 2.77Å; F48-F128 HydrophobicContact CD2-CD1 4.29Å; F48-F128 HydrophobicContact CD2-CE1 4.07Å; F48-F128 HydrophobicContact CG-CD1 4.43Å; F48-F128 HydrophobicContact CG-CE1 4.34Å; Y118-F128 AromaticContact CD1-CD2 3.87Å; Y118-F128 HydrophobicContact CD1-CD2 3.87Å; Y118-F128 HydrophobicContact CD1-CE2 4.27Å; Y118-F128 HydrophobicContact CD1-CG 4.2Å; Y118-F128 HydrophobicContact CD2-CB 3.85Å; Y118-F128 HydrophobicContact CD2-CD2 4.11Å; Y118-F128 HydrophobicContact CD2-CG 4.29Å; Y118-F128 HydrophobicContact CE1-CB 4.33Å; Y118-F128 HydrophobicContact CE1-CD2 4.36Å; Y118-F128 HydrophobicContact CE1-CG 4.22Å; Y118-F128 HydrophobicContact CE2-CB 3.62Å; Y118-F128 HydrophobicContact CE2-CG 4.3Å; Y118-F128 HydrophobicContact CG-CB 4.29Å; Y118-F128 AromaticContact CG-CD2 3.73Å; Y118-F128 HydrophobicContact CG-CD2 3.73Å; Y118-F128 HydrophobicContact CG-CE2 4.4Å; Y118-F128 HydrophobicContact CG-CG 4.23Å; E125-F128 PolarHBondContact O-N 2.95Å; E125-F128 VanDerWaalsContact O-N 3.07Å; W126-F128 VanDerWaalsContact C-N 3.29Å; W126-F128 PolarHBondContact O-N 2.82Å
129F58.5Low73.5Confident90 Ų9066.6 Ų66.640%0.39532%0.321SS..Hα-helixtrans-90.4-19.8-178.1-65.5-69.9000114.3F48 E125 W126F48-F129 HydrophobicContact CB-CD1 4.45Å; F48-F129 AromaticContact CD1-CD1 3.97Å; F48-F129 HydrophobicContact CD1-CD1 3.97Å; F48-F129 HydrophobicContact CD1-CE1 4.38Å; F48-F129 AromaticContact CD2-CD1 3.8Å; F48-F129 HydrophobicContact CD2-CD1 3.8Å; F48-F129 AromaticContact CD2-CE1 3.46Å; F48-F129 HydrophobicContact CD2-CE1 3.46Å; F48-F129 VanDerWaalsContact CD2-CE1 3.46Å; F48-F129 HydrophobicContact CD2-CZ 4.5Å; F48-F129 HydrophobicContact CE1-CD1 4.15Å; F48-F129 HydrophobicContact CE1-CE1 4.33Å; F48-F129 HydrophobicContact CE2-CD1 4.01Å; F48-F129 AromaticContact CE2-CE1 3.43Å; F48-F129 HydrophobicContact CE2-CE1 3.43Å; F48-F129 VanDerWaalsContact CE2-CE1 3.43Å; F48-F129 HydrophobicContact CE2-CZ 4.5Å; F48-F129 AromaticContact CG-CD1 3.79Å; F48-F129 HydrophobicContact CG-CD1 3.79Å; F48-F129 AromaticContact CG-CE1 3.96Å; F48-F129 HydrophobicContact CG-CE1 3.96Å; F48-F129 HydrophobicContact CZ-CD1 4.17Å; F48-F129 AromaticContact CZ-CE1 3.88Å; F48-F129 HydrophobicContact CZ-CE1 3.88Å; E125-F129 HydrophobicContact CB-CD2 3.99Å; E125-F129 HydrophobicContact CB-CE2 3.87Å; E125-F129 HydrophobicContact CG-CE2 4.38Å; E125-F129 WeakPolarHBondContact O-CD2 2.94Å; E125-F129 PolarHBondContact O-N 3.39Å; W126-F129 PolarHBondContact O-N 3.09Å
130T65.5Low74Confident57 Ų5763.3 Ų63.335%0.3529%0.294SS..SBendtrans-97.9149.6-172.3-49.20000112.1W126 A132 A133W126-T130 WeakPolarHBondContact O-CB 3.45Å; W126-T130 PolarHBondContact O-N 2.91Å; W126-T130 PolarHBondContact O-OG1 3.4Å; T130-A132 HydrophobicContact CG2-CB 4.06Å; T130-A132 PolarHBondContact O-N 3.12Å; T130-A133 PolarHBondContact O-N 2.84Å
131S61.9Low74.6Confident37 Ų3755.7 Ų55.726%0.25926%0.261SS..G310 helixtrans-58.3-8.3169.5540000114.4A133 S134S131-A133 VanDerWaalsContact C-N 3.32Å; S131-A133 PolarHBondContact O-N 3.34Å; S131-S134 VanDerWaalsContact O-CB 3.31Å; S131-S134 WeakPolarHBondContact O-CB 3.43Å; S131-S134 PolarHBondContact O-N 3.39Å; S131-S134 PolarHBondContact O-OG 2.88Å
132A67.1Low75.3Confident38 Ų3848.1 Ų48.131%0.31423%0.228SC..G310 helixtrans-62.7-35.9175.600000112.7T130 S134T130-A132 HydrophobicContact CG2-CB 4.06Å; T130-A132 PolarHBondContact O-N 3.12Å; A132-S134 VanDerWaalsContact C-N 3.34Å
133A73.5Confident76.4Confident7 Ų737.7 Ų37.76%0.05819%0.188CC..G310 helixtrans-98.725.7176.300000112.7L114 M127 T130 S131 I135L114-A133 HydrophobicContact CD2-CB 4.42Å; M127-A133 HydrophobicContact CG-CB 3.91Å; M127-A133 WeakPolarHBondContact O-CB 3.39Å; T130-A133 PolarHBondContact O-N 2.84Å; S131-A133 VanDerWaalsContact C-N 3.32Å; S131-A133 PolarHBondContact O-N 3.34Å; A133-I135 PolarHBondContact O-N 3.39Å
134S85.2Confident78Confident1 Ų134.7 Ų34.71%0.00717%0.17CC..  trans-67.2130175.353.30000111T44 S131 A132T44-S134 WeakPolarHBondContact OG1-CB 3.41Å; S131-S134 VanDerWaalsContact O-CB 3.31Å; S131-S134 WeakPolarHBondContact O-CB 3.43Å; S131-S134 PolarHBondContact O-N 3.39Å; S131-S134 PolarHBondContact O-OG 2.88Å; A132-S134 VanDerWaalsContact C-N 3.34Å
135I90.2Very high79.6Confident1 Ų128.5 Ų28.51%0.00514%0.141CC..BIsolated β-bridgetrans-79.6120.5171.2-60.8164.3000106.6I45 F62 T110 C111 L114 A133 M203I45-I135 HydrophobicContact CB-CB 4.13Å; I45-I135 HydrophobicContact CG2-CD1 4.2Å; I45-I135 PolarHBondContact N-O 2.9Å; I45-I135 PolarHBondContact O-N 3.37Å; F62-I135 HydrophobicContact CD2-CG2 4.29Å; T110-I135 HydrophobicContact CG2-CD1 3.72Å; T110-I135 HydrophobicContact CG2-CG1 4.03Å; T110-I135 HydrophobicContact CG2-CG2 4.16Å; C111-I135 HydrophobicContact CB-CD1 4Å; L114-I135 HydrophobicContact CD2-CD1 4.42Å; L114-I135 HydrophobicContact CD2-CG1 4.39Å; A133-I135 PolarHBondContact O-N 3.39Å; I135-M203 HydrophobicContact CG2-CE 3.81Å; I135-M203 HydrophobicContact CG2-CG 3.94Å; I135-M203 HydrophobicContact CG2-SD 3.5Å; I135-M203 WeakPolarHBondContact CG2-SD 3.33Å
136R91.4Very high81.2Confident39 Ų3921.9 Ų21.915%0.14711%0.11CC..  trans-152160.9-173.864.8-175-178.6-175-2.4111.7T44 V65 S67 M203T44-R136 HydrophobicContact CG2-CB 3.64Å; V65-R136 WeakPolarHBondContact O-CB 3.49Å; S67-R136 PolarHBondContact OG-NH2 3.41Å; R136-M203 WeakPolarHBondContact O-CE 3.21Å
137G93Very high83Confident0 Ų018.3 Ų18.30%010%0.097CC..SBendtrans85.7177.1178.100000114.9F62 V65 E66 M203F62-G137 PolarHBondContact O-N 2.8Å; F62-G137 VanDerWaalsContact O-N 3.13Å; V65-G137 WeakPolarHBondContact O-CA 3.28Å; V65-G137 PolarHBondContact O-N 2.97Å; E66-G137 VanDerWaalsContact OE2-CA 3.28Å; E66-G137 WeakPolarHBondContact OE2-CA 3.28Å; G137-M203 VanDerWaalsContact O-CE 3.31Å; G137-M203 WeakPolarHBondContact O-CE 3.28Å
138L94.7Very high84.6Confident0 Ų016.6 Ų16.60%09%0.089CC..SBendtrans-99.75.9-171.9-159.166.9000113.5W63 D75 L79 F99 G140 F141 N142W63-L138 HydrophobicContact CB-CD1 3.88Å; W63-L138 HydrophobicContact CE3-CD1 4.24Å; W63-L138 HydrophobicContact CG-CD1 4.45Å; D75-L138 HydrophobicContact CB-CB 4.07Å; D75-L138 HydrophobicContact CB-CD2 4.28Å; D75-L138 VanDerWaalsContact OD2-CB 3.28Å; D75-L138 WeakPolarHBondContact OD2-CB 3.45Å; D75-L138 PolarHBondContact OD2-N 3.07Å; L79-L138 HydrophobicContact CB-CD2 4.33Å; L79-L138 HydrophobicContact CD1-CD2 4.06Å; L79-L138 HydrophobicContact CD2-CD2 4.21Å; L79-L138 HydrophobicContact CG-CD2 4.45Å; F99-L138 HydrophobicContact CE2-CD1 3.81Å; F99-L138 HydrophobicContact CZ-CD1 4.01Å; L138-G140 VanDerWaalsContact C-N 3.27Å; L138-G140 PolarHBondContact O-N 2.76Å; L138-G140 VanDerWaalsContact O-N 3.11Å; L138-F141 HydrophobicContact CD1-CB 3.69Å; L138-F141 HydrophobicContact CD1-CD1 4.02Å; L138-F141 HydrophobicContact CD1-CG 4.01Å; L138-F141 HydrophobicContact CD2-CD1 3.85Å; L138-F141 HydrophobicContact CD2-CE1 4.47Å; L138-F141 HydrophobicContact CG-CB 3.84Å; L138-F141 HydrophobicContact CG-CD1 3.78Å; L138-F141 HydrophobicContact CG-CG 4.16Å; L138-F141 WeakPolarHBondContact O-CB 3.08Å; L138-F141 PolarHBondContact O-N 3.29Å; L138-N142 PolarHBondContact O-N 2.83Å
139S93.4Very high85.9Confident1 Ų115.9 Ų15.91%0.0079%0.086CC..Hα-helixtrans-51.4-38.7-174.957.90000114.8N142 G143 M203S139-N142 WeakPolarHBondContact O-CB 3.38Å; S139-N142 PolarHBondContact O-N 3.25Å; S139-G143 PolarHBondContact O-N 2.9Å; S139-M203 WeakPolarHBondContact OG-CB 3.22Å
140G95.3Very high87.2Confident0 Ų012.3 Ų12.30%07%0.073CC..Hα-helixtrans-72.3-37.2176.800000114L138 N142 G143 A144 M203 G207L138-G140 VanDerWaalsContact C-N 3.27Å; L138-G140 PolarHBondContact O-N 2.76Å; L138-G140 VanDerWaalsContact O-N 3.11Å; G140-N142 VanDerWaalsContact C-N 3.29Å; G140-N142 PolarHBondContact O-N 3.35Å; G140-G143 PolarHBondContact O-N 3.35Å; G140-A144 PolarHBondContact O-N 3.19Å; G140-M203 VanDerWaalsContact CA-C 3.47Å; G140-M203 WeakPolarHBondContact CA-O 3.15Å; G140-G207 VanDerWaalsContact O-CA 3.31Å; G140-G207 WeakPolarHBondContact O-CA 3.41Å
141F95.8Very high88.1Confident1 Ų113.7 Ų13.70%0.0048%0.075CC..Hα-helixtrans-63.8-37.7170.2172.2-92.7000111.3L79 A82 F83 Y98 F99 V102 L138 G143 A144 V145L79-F141 HydrophobicContact CD1-CD1 4.24Å; L79-F141 HydrophobicContact CD1-CE1 3.45Å; L79-F141 VanDerWaalsContact CD1-CE1 3.45Å; L79-F141 HydrophobicContact CD1-CZ 4.06Å; A82-F141 HydrophobicContact CB-CE1 4.5Å; F83-F141 HydrophobicContact CE1-CZ 4.21Å; Y98-F141 AromaticContact CD1-CE2 3.72Å; Y98-F141 HydrophobicContact CD1-CE2 3.72Å; Y98-F141 HydrophobicContact CD1-CZ 4.37Å; Y98-F141 HydrophobicContact CE1-CD2 4.25Å; Y98-F141 AromaticContact CE1-CE2 3.43Å; Y98-F141 HydrophobicContact CE1-CE2 3.43Å; Y98-F141 VanDerWaalsContact CE1-CE2 3.43Å; Y98-F141 HydrophobicContact CE1-CZ 4.01Å; F99-F141 HydrophobicContact CB-CE2 4.13Å; F99-F141 HydrophobicContact CD2-CD1 4.44Å; F99-F141 AromaticContact CD2-CD2 3.87Å; F99-F141 HydrophobicContact CD2-CD2 3.87Å; F99-F141 HydrophobicContact CD2-CE1 4.12Å; F99-F141 AromaticContact CD2-CE2 3.52Å; F99-F141 HydrophobicContact CD2-CE2 3.52Å; F99-F141 HydrophobicContact CD2-CG 4.32Å; F99-F141 AromaticContact CD2-CZ 3.66Å; F99-F141 HydrophobicContact CD2-CZ 3.66Å; F99-F141 HydrophobicContact CE2-CD1 4.41Å; F99-F141 HydrophobicContact CE2-CD2 4.38Å; F99-F141 HydrophobicContact CE2-CE1 4.36Å; F99-F141 HydrophobicContact CE2-CE2 4.35Å; F99-F141 HydrophobicContact CE2-CG 4.41Å; F99-F141 HydrophobicContact CE2-CZ 4.34Å; F99-F141 HydrophobicContact CG-CE2 4.21Å; V102-F141 HydrophobicContact CB-CD2 4.29Å; V102-F141 HydrophobicContact CG1-CB 4.37Å; V102-F141 HydrophobicContact CG1-CD2 4.02Å; L138-F141 HydrophobicContact CD1-CB 3.69Å; L138-F141 HydrophobicContact CD1-CD1 4.02Å; L138-F141 HydrophobicContact CD1-CG 4.01Å; L138-F141 HydrophobicContact CD2-CD1 3.85Å; L138-F141 HydrophobicContact CD2-CE1 4.47Å; L138-F141 HydrophobicContact CG-CB 3.84Å; L138-F141 HydrophobicContact CG-CD1 3.78Å; L138-F141 HydrophobicContact CG-CG 4.16Å; L138-F141 WeakPolarHBondContact O-CB 3.08Å; L138-F141 PolarHBondContact O-N 3.29Å; F141-G143 VanDerWaalsContact C-N 3.35Å; F141-G143 PolarHBondContact O-N 2.67Å; F141-A144 WeakPolarHBondContact O-CB 3.2Å; F141-A144 PolarHBondContact O-N 2.6Å; F141-A144 VanDerWaalsContact O-N 3.15Å; F141-V145 HydrophobicContact CD1-CG2 3.85Å; F141-V145 HydrophobicContact CD2-CG2 4.39Å; F141-V145 HydrophobicContact CE1-CG2 3.3Å; F141-V145 HydrophobicContact CE2-CG2 3.9Å; F141-V145 HydrophobicContact CG-CG2 4.37Å; F141-V145 HydrophobicContact CZ-CG2 3.33Å; F141-V145 WeakPolarHBondContact O-CG2 3.27Å; F141-V145 PolarHBondContact O-N 3.21Å
142N94.9Very high89Confident0 Ų013.5 Ų13.50%07%0.073CC..Hα-helixtrans-60.8-43.7174.1-65.7-13.7000111.7D75 L78 L138 S139 G140 A144 V145 I146 Y179D75-N142 PolarHBondContact OD1-ND2 3.13Å; L78-N142 HydrophobicContact CD1-CB 4.27Å; L138-N142 PolarHBondContact O-N 2.83Å; S139-N142 WeakPolarHBondContact O-CB 3.38Å; S139-N142 PolarHBondContact O-N 3.25Å; G140-N142 VanDerWaalsContact C-N 3.29Å; G140-N142 PolarHBondContact O-N 3.35Å; N142-A144 VanDerWaalsContact C-N 3.29Å; N142-A144 PolarHBondContact O-N 2.75Å; N142-V145 PolarHBondContact O-N 2.97Å; N142-I146 WeakPolarHBondContact O-CB 3.45Å; N142-I146 VanDerWaalsContact O-CD1 3.3Å; N142-I146 WeakPolarHBondContact O-CD1 3.36Å; N142-I146 VanDerWaalsContact O-CG1 3.26Å; N142-I146 WeakPolarHBondContact O-CG1 3.14Å; N142-I146 PolarHBondContact O-N 2.86Å; N142-Y179 PolarHBondContact ND2-OH 2.9Å
143G95.2Very high89.6Confident0 Ų012.9 Ų12.90%06%0.063CC..Hα-helixtrans-55.5-44.8172.800000112.7S139 G140 F141 Y147 Y204S139-G143 PolarHBondContact O-N 2.9Å; G140-G143 PolarHBondContact O-N 3.35Å; F141-G143 VanDerWaalsContact C-N 3.35Å; F141-G143 PolarHBondContact O-N 2.67Å; G143-Y147 WeakPolarHBondContact O-CB 3.39Å; G143-Y147 PolarHBondContact O-N 3.39Å; G143-Y147 VanDerWaalsContact O-N 3.07Å; G143-Y204 VanDerWaalsContact CA-CD2 3.41Å
144A95.4Very high89.6Confident0 Ų014.9 Ų14.90%08%0.076CC..Hα-helixtrans-66.3-43.917800000113Y98 V102 G140 F141 N142 Y147 T148 I211Y98-A144 PolarHBondContact OH-O 3.2Å; Y98-A144 VanDerWaalsContact OH-O 3.12Å; V102-A144 HydrophobicContact CB-CB 4.5Å; V102-A144 HydrophobicContact CG1-CB 3.46Å; V102-A144 VanDerWaalsContact CG1-CB 3.46Å; V102-A144 HydrophobicContact CG2-CB 4.2Å; G140-A144 PolarHBondContact O-N 3.19Å; F141-A144 WeakPolarHBondContact O-CB 3.2Å; F141-A144 PolarHBondContact O-N 2.6Å; F141-A144 VanDerWaalsContact O-N 3.15Å; N142-A144 VanDerWaalsContact C-N 3.29Å; N142-A144 PolarHBondContact O-N 2.75Å; A144-Y147 PolarHBondContact O-N 2.81Å; A144-T148 WeakPolarHBondContact O-CB 3.47Å; A144-T148 PolarHBondContact O-N 2.89Å; A144-T148 PolarHBondContact O-OG1 3.47Å; A144-I211 HydrophobicContact CB-CB 3.99Å; A144-I211 HydrophobicContact CB-CG2 4.04Å
145V93.3Very high89.1Confident1 Ų121.4 Ų21.41%0.00611%0.106CC..Hα-helixtrans-60.2-48.9176.2163.80000110.8A82 Y98 F141 N142 Y147 T148 L149A82-V145 HydrophobicContact CB-CB 4.28Å; A82-V145 HydrophobicContact CB-CG1 3.47Å; A82-V145 VanDerWaalsContact CB-CG1 3.47Å; A82-V145 HydrophobicContact CB-CG2 3.74Å; Y98-V145 HydrophobicContact CE1-CG2 4.11Å; Y98-V145 PolarHBondContact OH-N 3.42Å; F141-V145 HydrophobicContact CD1-CG2 3.85Å; F141-V145 HydrophobicContact CD2-CG2 4.39Å; F141-V145 HydrophobicContact CE1-CG2 3.3Å; F141-V145 HydrophobicContact CE2-CG2 3.9Å; F141-V145 HydrophobicContact CG-CG2 4.37Å; F141-V145 HydrophobicContact CZ-CG2 3.33Å; F141-V145 WeakPolarHBondContact O-CG2 3.27Å; F141-V145 PolarHBondContact O-N 3.21Å; N142-V145 PolarHBondContact O-N 2.97Å; V145-Y147 VanDerWaalsContact C-N 3.3Å; V145-Y147 PolarHBondContact O-N 3.48Å; V145-T148 CarbonylContact O-C 3.49Å; V145-T148 WeakPolarHBondContact O-CB 3.46Å; V145-T148 PolarHBondContact O-N 3.37Å; V145-T148 VanDerWaalsContact O-N 3.09Å; V145-L149 HydrophobicContact CG1-CD1 3.87Å; V145-L149 HydrophobicContact CG1-CG 4.28Å; V145-L149 WeakPolarHBondContact O-CG 3.37Å; V145-L149 PolarHBondContact O-N 3.02Å
146I91.8Very high88.2Confident0 Ų022.6 Ų22.60%011%0.113CC..Hα-helixtrans-63.3-41-176.8-73.7158.2000110.8L78 N142 L149 A150 L171 P172 V175 Y204L78-I146 HydrophobicContact CD2-CD1 3.59Å; L78-I146 HydrophobicContact CD2-CG1 3.61Å; N142-I146 WeakPolarHBondContact O-CB 3.45Å; N142-I146 VanDerWaalsContact O-CD1 3.3Å; N142-I146 WeakPolarHBondContact O-CD1 3.36Å; N142-I146 VanDerWaalsContact O-CG1 3.26Å; N142-I146 WeakPolarHBondContact O-CG1 3.14Å; N142-I146 PolarHBondContact O-N 2.86Å; I146-L149 PolarHBondContact O-N 3.28Å; I146-A150 WeakPolarHBondContact O-CB 3.25Å; I146-A150 PolarHBondContact O-N 3.27Å; I146-L171 HydrophobicContact CG1-CD2 4.17Å; I146-L171 HydrophobicContact CG1-CG 4.37Å; I146-L171 HydrophobicContact CG2-CB 4.02Å; I146-L171 HydrophobicContact CG2-CD2 3.97Å; I146-L171 HydrophobicContact CG2-CG 3.7Å; I146-P172 VanDerWaalsContact CG2-CA 3.45Å; I146-P172 HydrophobicContact CG2-CB 4.01Å; I146-P172 HydrophobicContact CG2-CG 3.78Å; I146-V175 HydrophobicContact CD1-CB 3.54Å; I146-V175 HydrophobicContact CD1-CG1 3.36Å; I146-V175 HydrophobicContact CD1-CG2 3.57Å; I146-V175 HydrophobicContact CG1-CG2 4.44Å; I146-Y204 HydrophobicContact CD1-CE2 3.95Å
147Y91.3Very high87.5Confident42 Ų4223 Ų2317%0.16512%0.118CC..Hα-helixtrans-61.2-46.5171.9-175-89.1000111.9G143 A144 V145 L149 A150 H151 L208 I211 W212 F215G143-Y147 WeakPolarHBondContact O-CB 3.39Å; G143-Y147 PolarHBondContact O-N 3.39Å; G143-Y147 VanDerWaalsContact O-N 3.07Å; A144-Y147 PolarHBondContact O-N 2.81Å; V145-Y147 VanDerWaalsContact C-N 3.3Å; V145-Y147 PolarHBondContact O-N 3.48Å; Y147-L149 VanDerWaalsContact C-N 3.31Å; Y147-L149 PolarHBondContact O-N 3.35Å; Y147-A150 CarbonylContact O-C 3.59Å; Y147-A150 PolarHBondContact O-N 3.35Å; Y147-A150 VanDerWaalsContact O-N 3.15Å; Y147-H151 HydrophobicContact CD1-CB 4.37Å; Y147-H151 HydrophobicContact CE1-CB 4.02Å; Y147-H151 VanDerWaalsContact O-CB 3.3Å; Y147-H151 WeakPolarHBondContact O-CB 3.34Å; Y147-H151 PolarHBondContact O-N 2.9Å; Y147-L208 HydrophobicContact CD2-CD2 3.9Å; Y147-L208 HydrophobicContact CG-CD2 4.18Å; Y147-I211 HydrophobicContact CD1-CB 4.49Å; Y147-I211 HydrophobicContact CD1-CG1 4.32Å; Y147-I211 HydrophobicContact CD1-CG2 3.47Å; Y147-I211 VanDerWaalsContact CD1-CG2 3.47Å; Y147-I211 HydrophobicContact CE1-CG2 4.39Å; Y147-I211 HydrophobicContact CG-CG2 3.66Å; Y147-W212 HydrophobicContact CE1-CB 4.39Å; Y147-W212 HydrophobicContact CE2-CB 4.11Å; Y147-W212 AromaticContact CE2-CD1 3.75Å; Y147-W212 HydrophobicContact CE2-CG 4.35Å; Y147-W212 AromaticContact CZ-CD1 3.63Å; Y147-F215 AromaticContact CD1-CD2 3.96Å; Y147-F215 HydrophobicContact CD1-CD2 3.96Å; Y147-F215 HydrophobicContact CD1-CE2 4.15Å; Y147-F215 AromaticContact CE1-CD2 3.55Å; Y147-F215 HydrophobicContact CE1-CD2 3.55Å; Y147-F215 HydrophobicContact CE1-CE2 4.12Å; Y147-F215 HydrophobicContact CE1-CG 4.35Å
148T89.9Confident86.4Confident0 Ų027 Ų270%014%0.142CC..Hα-helixtrans-58.2-44.9178.3-62.70000110.8L86 W90 Y98 A144 V145 A150 H151 T152 F215L86-T148 HydrophobicContact CD2-CG2 3.97Å; W90-T148 HydrophobicContact CH2-CG2 3.63Å; W90-T148 HydrophobicContact CZ2-CG2 3.61Å; Y98-T148 PolarHBondContact OH-OG1 3.1Å; Y98-T148 VanDerWaalsContact OH-OG1 3.06Å; A144-T148 WeakPolarHBondContact O-CB 3.47Å; A144-T148 PolarHBondContact O-N 2.89Å; A144-T148 PolarHBondContact O-OG1 3.47Å; V145-T148 CarbonylContact O-C 3.49Å; V145-T148 WeakPolarHBondContact O-CB 3.46Å; V145-T148 PolarHBondContact O-N 3.37Å; V145-T148 VanDerWaalsContact O-N 3.09Å; T148-A150 PolarHBondContact O-N 3.42Å; T148-H151 PolarHBondContact O-N 3.29Å; T148-T152 WeakPolarHBondContact O-CB 3.36Å; T148-T152 PolarHBondContact O-N 3.03Å; T148-T152 PolarHBondContact O-OG1 2.88Å; T148-F215 HydrophobicContact CG2-CZ 4.36Å
149L86.1Confident85.4Confident19 Ų1932.8 Ų32.810%0.09917%0.165CC..Hα-helixtrans-63.3-42.3176-68174.1000111.6V85 V145 I146 Y147 H151 F153 V168V85-L149 HydrophobicContact CB-CD2 4.1Å; V85-L149 HydrophobicContact CG1-CD2 3.68Å; V85-L149 HydrophobicContact CG2-CD2 4.49Å; V145-L149 HydrophobicContact CG1-CD1 3.87Å; V145-L149 HydrophobicContact CG1-CG 4.28Å; V145-L149 WeakPolarHBondContact O-CG 3.37Å; V145-L149 PolarHBondContact O-N 3.02Å; I146-L149 PolarHBondContact O-N 3.28Å; Y147-L149 VanDerWaalsContact C-N 3.31Å; Y147-L149 PolarHBondContact O-N 3.35Å; L149-H151 VanDerWaalsContact C-N 3.33Å; L149-H151 PolarHBondContact O-N 3.35Å; L149-F153 WeakPolarHBondContact O-CA 3.2Å; L149-F153 PolarHBondContact O-N 3.37Å; L149-V168 HydrophobicContact CB-CG1 4.14Å
150A85.9Confident84.4Confident14 Ų1437 Ų3712%0.11618%0.183CC..Hα-helixtrans-67.5-32.3176.900000113.2I146 Y147 T148 P154 V168 P172I146-A150 WeakPolarHBondContact O-CB 3.25Å; I146-A150 PolarHBondContact O-N 3.27Å; Y147-A150 CarbonylContact O-C 3.59Å; Y147-A150 PolarHBondContact O-N 3.35Å; Y147-A150 VanDerWaalsContact O-N 3.15Å; T148-A150 PolarHBondContact O-N 3.42Å; A150-P154 WeakPolarHBondContact O-CA 3.41Å; A150-P154 WeakPolarHBondContact O-CB 3.09Å; A150-V168 HydrophobicContact CB-CG1 4.23Å; A150-P172 HydrophobicContact CB-CG 3.71Å
151H84.3Confident83.6Confident86 Ų8640.5 Ų40.540%0.39820%0.202SC..Hα-helixtrans-76.3-44.1177.4-174.873.8000111.6Y147 T148 L149 F215Y147-H151 HydrophobicContact CD1-CB 4.37Å; Y147-H151 HydrophobicContact CE1-CB 4.02Å; Y147-H151 VanDerWaalsContact O-CB 3.3Å; Y147-H151 WeakPolarHBondContact O-CB 3.34Å; Y147-H151 PolarHBondContact O-N 2.9Å; T148-H151 PolarHBondContact O-N 3.29Å; L149-H151 VanDerWaalsContact C-N 3.33Å; L149-H151 PolarHBondContact O-N 3.35Å; H151-F215 AromaticContact CD2-CD1 3.63Å; H151-F215 AromaticContact CD2-CE1 3.53Å; H151-F215 AromaticContact CD2-CZ 3.84Å; H151-F215 AromaticContact NE2-CD1 3.59Å; H151-F215 AromaticContact NE2-CE1 3.9Å
152T80.8Confident82.6Confident33 Ų3350.4 Ų50.420%0.20224%0.239CC..Hα-helixtrans-75.2-38.5-178.5-53.90000112T148 P154 P243T148-T152 WeakPolarHBondContact O-CB 3.36Å; T148-T152 PolarHBondContact O-N 3.03Å; T148-T152 PolarHBondContact O-OG1 2.88Å; T152-P154 VanDerWaalsContact C-CD 3.47Å; T152-P243 HydrophobicContact CG2-CG 3.9Å
153F79.9Confident81.7Confident26 Ų2657.8 Ų57.811%0.11427%0.273CS..  trans-129.758.3-173.3-55.8-69.3000113.2V85 I89 L149 Q155 T156 V168 P243 F249V85-F153 HydrophobicContact CG1-CD2 4.47Å; V85-F153 HydrophobicContact CG1-CE2 3.77Å; I89-F153 HydrophobicContact CD1-CE2 3.86Å; I89-F153 HydrophobicContact CD1-CZ 3.65Å; L149-F153 WeakPolarHBondContact O-CA 3.2Å; L149-F153 PolarHBondContact O-N 3.37Å; F153-Q155 VanDerWaalsContact C-N 3.28Å; F153-Q155 PolarHBondContact O-N 2.97Å; F153-T156 PolarHBondContact O-N 3.32Å; F153-V168 WeakPolarHBondContact O-CB 3.31Å; F153-P243 HydrophobicContact CE1-CG 4.43Å; F153-P243 HydrophobicContact CZ-CB 4.5Å; F153-P243 HydrophobicContact CZ-CG 4.26Å; F153-F249 HydrophobicContact CB-CD2 4.31Å; F153-F249 HydrophobicContact CB-CE2 4.17Å; F153-F249 HydrophobicContact CD1-CB 4.44Å; F153-F249 AromaticContact CD1-CD2 3.81Å; F153-F249 HydrophobicContact CD1-CD2 3.81Å; F153-F249 HydrophobicContact CD1-CE2 4.45Å; F153-F249 HydrophobicContact CD1-CG 4.41Å; F153-F249 AromaticContact CD2-CD2 3.61Å; F153-F249 HydrophobicContact CD2-CD2 3.61Å; F153-F249 AromaticContact CD2-CE2 3.58Å; F153-F249 HydrophobicContact CD2-CE2 3.58Å; F153-F249 HydrophobicContact CE1-CB 4.33Å; F153-F249 AromaticContact CE1-CD2 3.93Å; F153-F249 HydrophobicContact CE1-CD2 3.93Å; F153-F249 AromaticContact CE2-CD2 3.74Å; F153-F249 HydrophobicContact CE2-CD2 3.74Å; F153-F249 HydrophobicContact CE2-CE2 4.02Å; F153-F249 AromaticContact CG-CD2 3.63Å; F153-F249 HydrophobicContact CG-CD2 3.63Å; F153-F249 AromaticContact CG-CE2 3.82Å; F153-F249 HydrophobicContact CG-CE2 3.82Å; F153-F249 AromaticContact CZ-CD2 3.89Å; F153-F249 HydrophobicContact CZ-CD2 3.89Å
154P73.8Confident80.6Confident49 Ų4964.9 Ų64.932%0.31830%0.304SS..THydrogen-bonded Turntrans-63.8-31.1-172.123.2-33.1000113.8A150 T152A150-P154 WeakPolarHBondContact O-CA 3.41Å; A150-P154 WeakPolarHBondContact O-CB 3.09Å; T152-P154 VanDerWaalsContact C-CD 3.47Å
155Q74Confident79.7Confident137 Ų13767.3 Ų67.364%0.6432%0.316SS*.THydrogen-bonded Turntrans-92.7-0.5-173.3-57.1-57.6-27.500113.9F153 I157F153-Q155 VanDerWaalsContact C-N 3.28Å; F153-Q155 PolarHBondContact O-N 2.97Å; Q155-I157 PolarHBondContact O-N 3.45Å
156T72.7Confident78.8Confident26 Ų2670.2 Ų70.216%0.1633%0.331CS..  trans-69.2129.3177.1-62.30000109.7F153 Q167 V168 F249F153-T156 PolarHBondContact O-N 3.32Å; T156-Q167 CarbonylContact O-C 3.56Å; T156-Q167 VanDerWaalsContact O-CA 3.3Å; T156-Q167 WeakPolarHBondContact O-CA 3.14Å; T156-V168 HydrophobicContact CG2-CG2 4Å; T156-V168 WeakPolarHBondContact O-CG2 3.49Å; T156-V168 PolarHBondContact O-N 3.3Å; T156-F249 HydrophobicContact CG2-CD1 3.62Å; T156-F249 HydrophobicContact CG2-CE1 3.09Å; T156-F249 HydrophobicContact CG2-CZ 3.65Å
157I75.4Confident78.2Confident49 Ų4971.6 Ų71.625%0.25134%0.337SS..EExtended strand (participates in β ladder)trans-86.2113.7173.8-55.8166.9000107.7Q155 K160 Q167 I264Q155-I157 PolarHBondContact O-N 3.45Å; I157-K160 HydrophobicContact CG2-CB 4.01Å; I157-Q167 HydrophobicContact CG1-CG 4.31Å; I157-I264 HydrophobicContact CD1-CD1 4.21Å
158V70.5Confident77.4Confident84 Ų8469.9 Ų69.951%0.50933%0.331SS..EExtended strand (participates in β ladder)trans-79-42.7177.9-178.40000110.4L166 V168V158-L166 PolarHBondContact N-O 2.85Å; V158-V168 HydrophobicContact CG2-CB 4.28Å; V158-V168 HydrophobicContact CG2-CG2 3.35Å
159Y73.5Confident76.9Confident121 Ų12176.1 Ų76.148%0.47536%0.355SS..EExtended strand (participates in β ladder)trans-144.6127.5-177.8-177.7-106000110N161 L166Y159-N161 HydrophobicContact CD1-CB 4.46Å; Y159-N161 HydrophobicContact CE1-CB 3.8Å; Y159-N161 VanDerWaalsContact CE1-ND2 3.3Å; Y159-N161 WeakPolarHBondContact CE1-ND2 3.27Å; Y159-N161 VanDerWaalsContact CZ-CG 3.41Å; Y159-N161 VanDerWaalsContact CZ-OD1 3.3Å; Y159-N161 PolarHBondContact OH-ND2 3.06Å; Y159-N161 PolarHBondContact OH-OD1 3.39Å; Y159-L166 HydrophobicContact CD1-CD1 4.24Å; Y159-L166 PolarHBondContact N-O 3.29Å; Y159-L166 PolarHBondContact O-N 3.46Å
160K73.4Confident76.8Confident89 Ų8978.5 Ų78.539%0.38737%0.365SS..EExtended strand (participates in β ladder)trans-117.7107.2178.6-175.6176.3179.1-172.90108.9I157 Q165I157-K160 HydrophobicContact CG2-CB 4.01Å; K160-Q165 HydrophobicContact CG-CG 4.31Å
161N76.9Confident76.7Confident74 Ų7479.8 Ų79.840%0.39637%0.37SS..  trans-107.5161.6165-100.53000110.6Y159 H163 F164Y159-N161 HydrophobicContact CD1-CB 4.46Å; Y159-N161 HydrophobicContact CE1-CB 3.8Å; Y159-N161 VanDerWaalsContact CE1-ND2 3.3Å; Y159-N161 WeakPolarHBondContact CE1-ND2 3.27Å; Y159-N161 VanDerWaalsContact CZ-CG 3.41Å; Y159-N161 VanDerWaalsContact CZ-OD1 3.3Å; Y159-N161 PolarHBondContact OH-ND2 3.06Å; Y159-N161 PolarHBondContact OH-OD1 3.39Å; N161-H163 PolarHBondContact O-N 3.15Å; N161-H163 VanDerWaalsContact O-N 3.11Å; N161-F164 PolarHBondContact N-O 3.03Å; N161-F164 PolarHBondContact O-N 3.27Å; N161-F164 VanDerWaalsContact O-O 3.11Å
162R76.2Confident76.9Confident209 Ų20976.9 Ų76.979%0.78936%0.359SS*.SBendtrans-52.4-32.3177.5-179.5173.1172155.8-1.6113.6
163H74.5Confident77.3Confident154 Ų15478.8 Ų78.871%0.71338%0.378SS*.SBendtrans-105.6-19.5-178.7-58.3-65.7000114.3N161N161-H163 PolarHBondContact O-N 3.15Å; N161-H163 VanDerWaalsContact O-N 3.11Å
164F73.7Confident77.7Confident149 Ų14981.3 Ų81.365%0.65439%0.392SS*.  trans-141.6128.6-170.5-69.4-76.7000111.5N161N161-F164 PolarHBondContact N-O 3.03Å; N161-F164 PolarHBondContact O-N 3.27Å; N161-F164 VanDerWaalsContact O-O 3.11Å
165Q76Confident78.3Confident51 Ų5179.6 Ų79.624%0.23838%0.381CS..EExtended strand (participates in β ladder)trans-113.6101.7173.8-65.2177.223.700108.8K160 Q167K160-Q165 HydrophobicContact CG-CG 4.31Å; Q165-Q167 PolarHBondContact O-N 3.45Å
166L73.8Confident79.1Confident62 Ų6273.5 Ų73.533%0.32535%0.354SS..EExtended strand (participates in β ladder)trans-85.3108.6176.1-70.9172.6000108.9V158 Y159 L174V158-L166 PolarHBondContact N-O 2.85Å; Y159-L166 HydrophobicContact CD1-CD1 4.24Å; Y159-L166 PolarHBondContact N-O 3.29Å; Y159-L166 PolarHBondContact O-N 3.46Å; L166-L174 HydrophobicContact CD1-CD1 4.25Å; L166-L174 HydrophobicContact CD2-CD1 3.63Å; L166-L174 HydrophobicContact CG-CD1 4.44Å
167Q79.2Confident79.8Confident29 Ų2978 Ų7814%0.13637%0.372CS..EExtended strand (participates in β ladder)trans-91.8154.6171.5-66176.85.300110.6T156 I157 Q165 R169 H170T156-Q167 CarbonylContact O-C 3.56Å; T156-Q167 VanDerWaalsContact O-CA 3.3Å; T156-Q167 WeakPolarHBondContact O-CA 3.14Å; I157-Q167 HydrophobicContact CG1-CG 4.31Å; Q165-Q167 PolarHBondContact O-N 3.45Å; Q167-R169 HydrophobicContact CB-CG 3.9Å; Q167-R169 PolarHBondContact O-N 2.85Å; Q167-R169 VanDerWaalsContact O-N 3.12Å; Q167-R169 VanDerWaalsContact OE1-CD 3.26Å; Q167-H170 WeakPolarHBondContact O-CB 3.31Å; Q167-H170 PolarHBondContact O-N 2.81Å
168V75.1Confident80.4Confident6 Ų677.8 Ų77.84%0.03638%0.378CS..G310 helixtrans-58.3-28179.1-176.70000111.7L149 A150 F153 T156 V158 H170 L171 P172L149-V168 HydrophobicContact CB-CG1 4.14Å; A150-V168 HydrophobicContact CB-CG1 4.23Å; F153-V168 WeakPolarHBondContact O-CB 3.31Å; T156-V168 HydrophobicContact CG2-CG2 4Å; T156-V168 WeakPolarHBondContact O-CG2 3.49Å; T156-V168 PolarHBondContact O-N 3.3Å; V158-V168 HydrophobicContact CG2-CB 4.28Å; V158-V168 HydrophobicContact CG2-CG2 3.35Å; V168-H170 PolarHBondContact O-N 2.68Å; V168-L171 HydrophobicContact CG1-CB 4.41Å; V168-L171 HydrophobicContact CG1-CD2 4.31Å; V168-L171 WeakPolarHBondContact O-CB 3.2Å; V168-L171 PolarHBondContact O-N 2.81Å; V168-P172 WeakPolarHBondContact O-CD 3.15Å
169R78.3Confident81.1Confident131 Ų13174.2 Ų74.249%0.49436%0.355SS..G310 helixtrans-54.8-25.7172.574.7-175.7-176.1-173.3-5.5114.2Q167Q167-R169 HydrophobicContact CB-CG 3.9Å; Q167-R169 PolarHBondContact O-N 2.85Å; Q167-R169 VanDerWaalsContact O-N 3.12Å; Q167-R169 VanDerWaalsContact OE1-CD 3.26Å
170H84Confident81.7Confident69 Ų6972.2 Ų72.232%0.31935%0.353SS..G310 helixtrans-89.8-12.9178.1-58.2-59.6000112.7Q167 V168 A173 L174Q167-H170 WeakPolarHBondContact O-CB 3.31Å; Q167-H170 PolarHBondContact O-N 2.81Å; V168-H170 PolarHBondContact O-N 2.68Å; H170-A173 PolarHBondContact O-N 2.94Å; H170-A173 VanDerWaalsContact O-N 3.16Å; H170-L174 HydrophobicContact CB-CD1 4.35Å; H170-L174 WeakPolarHBondContact O-CG 3.32Å; H170-L174 PolarHBondContact O-N 3.45Å
171L84.7Confident82.1Confident42 Ų4271.5 Ų71.522%0.2235%0.353CS..Hα-helixtrans-58.7-40.7-176.6-168.667.6000113.4I146 V168 A173 L174 V175I146-L171 HydrophobicContact CG1-CD2 4.17Å; I146-L171 HydrophobicContact CG1-CG 4.37Å; I146-L171 HydrophobicContact CG2-CB 4.02Å; I146-L171 HydrophobicContact CG2-CD2 3.97Å; I146-L171 HydrophobicContact CG2-CG 3.7Å; V168-L171 HydrophobicContact CG1-CB 4.41Å; V168-L171 HydrophobicContact CG1-CD2 4.31Å; V168-L171 WeakPolarHBondContact O-CB 3.2Å; V168-L171 PolarHBondContact O-N 2.81Å; L171-A173 VanDerWaalsContact C-N 3.33Å; L171-A173 PolarHBondContact O-N 2.94Å; L171-L174 PolarHBondContact O-N 3.32Å; L171-V175 HydrophobicContact CD1-CG2 3.88Å; L171-V175 HydrophobicContact CG-CG2 4.14Å; L171-V175 WeakPolarHBondContact O-CB 3.3Å; L171-V175 WeakPolarHBondContact O-CG2 3.33Å; L171-V175 PolarHBondContact O-N 3.35Å
172P89Confident82.1Confident25 Ų2570.1 Ų70.116%0.16235%0.345CS..Hα-helixtrans-59.8-42175.3-21.230.7000112.9I146 A150 V168 G176 Y204 L208I146-P172 VanDerWaalsContact CG2-CA 3.45Å; I146-P172 HydrophobicContact CG2-CB 4.01Å; I146-P172 HydrophobicContact CG2-CG 3.78Å; A150-P172 HydrophobicContact CB-CG 3.71Å; V168-P172 WeakPolarHBondContact O-CD 3.15Å; P172-G176 PolarHBondContact O-N 3.47Å; P172-Y204 VanDerWaalsContact CA-OH 3.31Å; P172-Y204 WeakPolarHBondContact CA-OH 3.45Å; P172-Y204 PolarHBondContact O-OH 3.29Å; P172-L208 HydrophobicContact CB-CD2 4.2Å
173A88.6Confident81.9Confident72 Ų7261.8 Ų61.860%0.59532%0.318SS*.Hα-helixtrans-69.7-42.717800000111.7H170 L171 G176 F177H170-A173 PolarHBondContact O-N 2.94Å; H170-A173 VanDerWaalsContact O-N 3.16Å; L171-A173 VanDerWaalsContact C-N 3.33Å; L171-A173 PolarHBondContact O-N 2.94Å; A173-G176 PolarHBondContact O-N 3.39Å; A173-F177 VanDerWaalsContact O-CB 3.29Å; A173-F177 WeakPolarHBondContact O-CB 3.01Å; A173-F177 PolarHBondContact O-N 2.76Å
174L87.6Confident81.8Confident79 Ų7957.6 Ų57.641%0.41431%0.305SS..Hα-helixtrans-64.5-45.4-179.7-71.7173.1000112.4L166 H170 L171 F177 A178L166-L174 HydrophobicContact CD1-CD1 4.25Å; L166-L174 HydrophobicContact CD2-CD1 3.63Å; L166-L174 HydrophobicContact CG-CD1 4.44Å; H170-L174 HydrophobicContact CB-CD1 4.35Å; H170-L174 WeakPolarHBondContact O-CG 3.32Å; H170-L174 PolarHBondContact O-N 3.45Å; L171-L174 PolarHBondContact O-N 3.32Å; L174-F177 PolarHBondContact O-N 3.49Å; L174-A178 PolarHBondContact O-N 2.91Å
175V88.3Confident81.6Confident13 Ų1354 Ų548%0.07929%0.294CS..Hα-helixtrans-73.5-37.4179.3177.40000110.9F74 I146 L171 F177 A178 Y179 Y204F74-V175 HydrophobicContact CE1-CG1 3.92Å; F74-V175 HydrophobicContact CZ-CG1 3.75Å; F74-V175 HydrophobicContact CZ-CG2 4.44Å; I146-V175 HydrophobicContact CD1-CB 3.54Å; I146-V175 HydrophobicContact CD1-CG1 3.36Å; I146-V175 HydrophobicContact CD1-CG2 3.57Å; I146-V175 HydrophobicContact CG1-CG2 4.44Å; L171-V175 HydrophobicContact CD1-CG2 3.88Å; L171-V175 HydrophobicContact CG-CG2 4.14Å; L171-V175 WeakPolarHBondContact O-CB 3.3Å; L171-V175 WeakPolarHBondContact O-CG2 3.33Å; L171-V175 PolarHBondContact O-N 3.35Å; V175-F177 VanDerWaalsContact C-N 3.27Å; V175-F177 PolarHBondContact O-N 3.42Å; V175-A178 WeakPolarHBondContact O-CB 3.5Å; V175-A178 PolarHBondContact O-N 3.5Å; V175-A178 VanDerWaalsContact O-N 3.13Å; V175-Y179 HydrophobicContact CG1-CD2 3.66Å; V175-Y179 HydrophobicContact CG1-CE2 3.5Å; V175-Y179 VanDerWaalsContact O-CD2 3.29Å; V175-Y179 WeakPolarHBondContact O-CD2 3.35Å; V175-Y179 PolarHBondContact O-N 2.96Å; V175-Y204 HydrophobicContact CB-CE2 4.28Å; V175-Y204 HydrophobicContact CG1-CD2 4.48Å; V175-Y204 HydrophobicContact CG1-CE2 3.74Å
176G89.5Confident81.2Confident9 Ų951.9 Ų51.99%0.09329%0.286CS..Hα-helixtrans-57.8-41.7170.300000112.2P172 A173 Y179 L180P172-G176 PolarHBondContact O-N 3.47Å; A173-G176 PolarHBondContact O-N 3.39Å; G176-Y179 PolarHBondContact O-N 3.04Å; G176-L180 WeakPolarHBondContact O-CB 3.32Å; G176-L180 PolarHBondContact O-N 3.42Å
177F88.6Confident80.8Confident120 Ų12052.6 Ų52.653%0.52629%0.289SS..Hα-helixtrans-66-39.1173.8-172.4-107.7000112.2A173 L174 V175 L180 L181A173-F177 VanDerWaalsContact O-CB 3.29Å; A173-F177 WeakPolarHBondContact O-CB 3.01Å; A173-F177 PolarHBondContact O-N 2.76Å; L174-F177 PolarHBondContact O-N 3.49Å; V175-F177 VanDerWaalsContact C-N 3.27Å; V175-F177 PolarHBondContact O-N 3.42Å; F177-L180 PolarHBondContact O-N 3.28Å; F177-L181 HydrophobicContact CD1-CD1 3.76Å; F177-L181 HydrophobicContact CD1-CG 4.1Å; F177-L181 HydrophobicContact CE1-CD1 3.3Å; F177-L181 HydrophobicContact CE1-CD2 4.28Å; F177-L181 HydrophobicContact CE1-CG 3.79Å; F177-L181 HydrophobicContact CE2-CD2 4.4Å; F177-L181 HydrophobicContact CE2-CG 4.38Å; F177-L181 HydrophobicContact CZ-CD1 3.84Å; F177-L181 HydrophobicContact CZ-CD2 3.96Å; F177-L181 HydrophobicContact CZ-CG 3.93Å; F177-L181 WeakPolarHBondContact O-CB 3.24Å; F177-L181 WeakPolarHBondContact O-CG 3.18Å; F177-L181 PolarHBondContact O-N 3.31Å
178A86.6Confident80.5Confident46 Ų4660 Ų6038%0.3832%0.321SS..Hα-helixtrans-61.5-43.7174.300000112.1L174 V175 L181 L182L174-A178 PolarHBondContact O-N 2.91Å; V175-A178 WeakPolarHBondContact O-CB 3.5Å; V175-A178 PolarHBondContact O-N 3.5Å; V175-A178 VanDerWaalsContact O-N 3.13Å; A178-L181 PolarHBondContact O-N 3.35Å; A178-L182 PolarHBondContact O-N 2.95Å
179Y86.2Confident80.4Confident9 Ų965 Ų654%0.03535%0.347CS..Hα-helixtrans-65-39.2173.5-81.2-63.6000112.5F74 N142 V175 G176 L181 L182 C183 Y204F74-Y179 HydrophobicContact CD1-CE1 4.4Å; F74-Y179 AromaticContact CD1-CZ 3.89Å; F74-Y179 WeakPolarHBondContact CD1-OH 3.42Å; F74-Y179 HydrophobicContact CE1-CE1 4.34Å; F74-Y179 AromaticContact CE1-CE2 3.76Å; F74-Y179 HydrophobicContact CE1-CE2 3.76Å; F74-Y179 AromaticContact CE1-CZ 3.59Å; F74-Y179 WeakPolarHBondContact CE1-OH 3.39Å; N142-Y179 PolarHBondContact ND2-OH 2.9Å; V175-Y179 HydrophobicContact CG1-CD2 3.66Å; V175-Y179 HydrophobicContact CG1-CE2 3.5Å; V175-Y179 VanDerWaalsContact O-CD2 3.29Å; V175-Y179 WeakPolarHBondContact O-CD2 3.35Å; V175-Y179 PolarHBondContact O-N 2.96Å; G176-Y179 PolarHBondContact O-N 3.04Å; Y179-L181 VanDerWaalsContact C-N 3.33Å; Y179-L181 PolarHBondContact O-N 2.8Å; Y179-L182 WeakPolarHBondContact O-CB 2.96Å; Y179-L182 PolarHBondContact O-N 3.42Å; Y179-C183 PolarHBondContact O-N 3.26Å; Y179-Y204 HydrophobicContact CD2-CD1 4.43Å; Y179-Y204 AromaticContact CD2-CD2 3.45Å; Y179-Y204 HydrophobicContact CD2-CD2 3.45Å; Y179-Y204 VanDerWaalsContact CD2-CD2 3.45Å; Y179-Y204 AromaticContact CD2-CE2 3.96Å; Y179-Y204 HydrophobicContact CD2-CE2 3.96Å; Y179-Y204 AromaticContact CD2-CG 3.73Å; Y179-Y204 HydrophobicContact CD2-CG 3.73Å; Y179-Y204 AromaticContact CE2-CD2 3.43Å; Y179-Y204 HydrophobicContact CE2-CD2 3.43Å; Y179-Y204 VanDerWaalsContact CE2-CD2 3.43Å; Y179-Y204 AromaticContact CE2-CE2 3.93Å; Y179-Y204 HydrophobicContact CE2-CE2 3.93Å; Y179-Y204 HydrophobicContact CE2-CG 4.13Å
180L85Confident79.8Confident79 Ų7965.8 Ų65.841%0.41435%0.351SS..Hα-helixtrans-65.2-37.1176.2-172143.6000111.6G176 F177 C183 P184 F201G176-L180 WeakPolarHBondContact O-CB 3.32Å; G176-L180 PolarHBondContact O-N 3.42Å; F177-L180 PolarHBondContact O-N 3.28Å; L180-C183 WeakPolarHBondContact O-CB 3.19Å; L180-C183 PolarHBondContact O-N 3.47Å; L180-P184 WeakPolarHBondContact O-CD 3.21Å; L180-F201 HydrophobicContact CB-CD2 4.04Å; L180-F201 HydrophobicContact CB-CE2 4.17Å; L180-F201 HydrophobicContact CD1-CD2 4.47Å; L180-F201 HydrophobicContact CD1-CE2 4.03Å; L180-F201 HydrophobicContact CD1-CZ 4.18Å
181L82.4Confident78.4Confident74 Ų7464.3 Ų64.339%0.38735%0.354SS..Hα-helixtrans-73.8-30.1174.4-73.4-175.1000113.3F177 A178 Y179 C183 P184 V185F177-L181 HydrophobicContact CD1-CD1 3.76Å; F177-L181 HydrophobicContact CD1-CG 4.1Å; F177-L181 HydrophobicContact CE1-CD1 3.3Å; F177-L181 HydrophobicContact CE1-CD2 4.28Å; F177-L181 HydrophobicContact CE1-CG 3.79Å; F177-L181 HydrophobicContact CE2-CD2 4.4Å; F177-L181 HydrophobicContact CE2-CG 4.38Å; F177-L181 HydrophobicContact CZ-CD1 3.84Å; F177-L181 HydrophobicContact CZ-CD2 3.96Å; F177-L181 HydrophobicContact CZ-CG 3.93Å; F177-L181 WeakPolarHBondContact O-CB 3.24Å; F177-L181 WeakPolarHBondContact O-CG 3.18Å; F177-L181 PolarHBondContact O-N 3.31Å; A178-L181 PolarHBondContact O-N 3.35Å; Y179-L181 VanDerWaalsContact C-N 3.33Å; Y179-L181 PolarHBondContact O-N 2.8Å; L181-C183 PolarHBondContact O-N 2.98Å; L181-P184 WeakPolarHBondContact O-CD 3.28Å; L181-P184 WeakPolarHBondContact O-CG 3.5Å; L181-V185 WeakPolarHBondContact O-CB 3.49Å; L181-V185 WeakPolarHBondContact O-CG2 3.4Å; L181-V185 PolarHBondContact O-N 2.96Å
182L76.6Confident76.9Confident45 Ų4570.2 Ų70.224%0.23638%0.377CS..Hα-helixtrans-59.6-33.4174-163.975.4000110.9A178 Y179 S186 Y200A178-L182 PolarHBondContact O-N 2.95Å; Y179-L182 WeakPolarHBondContact O-CB 2.96Å; Y179-L182 PolarHBondContact O-N 3.42Å; L182-S186 WeakPolarHBondContact O-CB 3.27Å; L182-S186 PolarHBondContact O-N 3.17Å; L182-S186 PolarHBondContact O-OG 3.27Å; L182-S186 VanDerWaalsContact O-OG 3.07Å; L182-Y200 HydrophobicContact CD2-CD2 4.07Å; L182-Y200 HydrophobicContact CD2-CE2 4.3Å
183C72.4Confident75.1Confident34 Ų3477.6 Ų77.623%0.2341%0.41CS..Hα-helixtrans-58.9-60.7178.3-175.90000113.4Y179 L180 L181 S186 L187Y179-C183 PolarHBondContact O-N 3.26Å; L180-C183 WeakPolarHBondContact O-CB 3.19Å; L180-C183 PolarHBondContact O-N 3.47Å; L181-C183 PolarHBondContact O-N 2.98Å; C183-S186 PolarHBondContact O-N 3.02Å; C183-S186 PolarHBondContact O-OG 3.48Å; C183-L187 WeakPolarHBondContact O-CG 3.36Å; C183-L187 PolarHBondContact O-N 2.89Å
184P71.4Confident73.3Confident66 Ų6677.4 Ų77.443%0.42940%0.397SS..Hα-helixtrans-69.2-33.517827.7-35.3000113.4L180 L181 S186 L187 F188L180-P184 WeakPolarHBondContact O-CD 3.21Å; L181-P184 WeakPolarHBondContact O-CD 3.28Å; L181-P184 WeakPolarHBondContact O-CG 3.5Å; P184-S186 VanDerWaalsContact C-N 3.34Å; P184-S186 PolarHBondContact O-N 3.4Å; P184-L187 PolarHBondContact O-N 2.98Å; P184-F188 WeakPolarHBondContact O-CB 3.49Å; P184-F188 PolarHBondContact O-N 2.9Å
185V71.1Confident71.2Confident72 Ų7280.8 Ų80.844%0.43640%0.404SS..Hα-helixtrans-64.6-411781720000110.7L181 F188 L189L181-V185 WeakPolarHBondContact O-CB 3.49Å; L181-V185 WeakPolarHBondContact O-CG2 3.4Å; L181-V185 PolarHBondContact O-N 2.96Å; V185-F188 PolarHBondContact O-N 3.5Å; V185-L189 HydrophobicContact CG1-CD1 3.65Å; V185-L189 HydrophobicContact CG1-CG 4.25Å; V185-L189 WeakPolarHBondContact O-CB 2.91Å; V185-L189 WeakPolarHBondContact O-CG 3.41Å; V185-L189 PolarHBondContact O-N 3.39Å
186S66.7Low69.6Low8 Ų881.1 Ų81.16%0.05641%0.405CS..Hα-helixtrans-65-39.9175.570.10000112.4L182 C183 P184 F188 W190 Q197L182-S186 WeakPolarHBondContact O-CB 3.27Å; L182-S186 PolarHBondContact O-N 3.17Å; L182-S186 PolarHBondContact O-OG 3.27Å; L182-S186 VanDerWaalsContact O-OG 3.07Å; C183-S186 PolarHBondContact O-N 3.02Å; C183-S186 PolarHBondContact O-OG 3.48Å; P184-S186 VanDerWaalsContact C-N 3.34Å; P184-S186 PolarHBondContact O-N 3.4Å; S186-F188 VanDerWaalsContact C-N 3.35Å; S186-F188 PolarHBondContact O-N 3.5Å; S186-W190 PolarHBondContact O-N 2.9Å; S186-W190 VanDerWaalsContact O-N 3.08Å; S186-Q197 PolarHBondContact OG-OE1 2.95Å
187L66.1Low68.3Low76 Ų7681.3 Ų81.340%0.39840%0.403SS..Hα-helixtrans-62.7-38.8173.8-68.9172.8000112.6C183 P184 G191 R195C183-L187 WeakPolarHBondContact O-CG 3.36Å; C183-L187 PolarHBondContact O-N 2.89Å; P184-L187 PolarHBondContact O-N 2.98Å; L187-G191 PolarHBondContact O-N 3.49Å; L187-R195 HydrophobicContact CD2-CG 3.94Å
188F72.8Confident67.3Low185 Ų18579.6 Ų79.681%0.81140%0.397SS*.Hα-helixtrans-74.1-42.2-178.9-175.2-102000112.7P184 V185 S186P184-F188 WeakPolarHBondContact O-CB 3.49Å; P184-F188 PolarHBondContact O-N 2.9Å; V185-F188 PolarHBondContact O-N 3.5Å; S186-F188 VanDerWaalsContact C-N 3.35Å; S186-F188 PolarHBondContact O-N 3.5Å
189L72.5Confident67Low111 Ų11178 Ų7858%0.58138%0.382SS*.Hα-helixtrans-79.5-36.5-175.7-69.8175.8000113.7V185V185-L189 HydrophobicContact CG1-CD1 3.65Å; V185-L189 HydrophobicContact CG1-CG 4.25Å; V185-L189 WeakPolarHBondContact O-CB 2.91Å; V185-L189 WeakPolarHBondContact O-CG 3.41Å; V185-L189 PolarHBondContact O-N 3.39Å
190W66.6Low67.1Low148 Ų14877.8 Ų77.856%0.56138%0.381SS*.Hα-helixtrans-108.90.8-170.8-100.5-87.7000115.2S186 Q194S186-W190 PolarHBondContact O-N 2.9Å; S186-W190 VanDerWaalsContact O-N 3.08Å; W190-Q194 HydrophobicContact CB-CB 4.14Å
191G53.7Low67.3Low37 Ų3777.8 Ų77.838%0.38138%0.378SS..G310 helixtrans67.3-170.7174.200000114.3L187 E193L187-G191 PolarHBondContact O-N 3.49Å; G191-E193 PolarHBondContact O-N 3.48Å; G191-E193 VanDerWaalsContact O-N 3.17Å
192K52.8Low67.7Low166 Ų16676.9 Ų76.972%0.72237%0.373SS*.G310 helixtrans-64.9-18.8-169.6-73.9-177.7178.3176.60115.1R195K192-R195 WeakPolarHBondContact O-CB 3.07Å; K192-R195 VanDerWaalsContact O-CG 3.3Å; K192-R195 WeakPolarHBondContact O-CG 3.13Å
193E51.9Low68.5Low181 Ų18174.8 Ų74.885%0.84636%0.362SS*.G310 helixtrans-83.1-24.4-169.8-15764.5-156.600112.9G191G191-E193 PolarHBondContact O-N 3.48Å; G191-E193 VanDerWaalsContact O-N 3.17Å
194Q50.1Low69.5Low67 Ų6773.3 Ų73.331%0.31335%0.352SS..G310 helixtrans-105.534.2175-135.5176.43.500111.3W190 I196W190-Q194 HydrophobicContact CB-CB 4.14Å; Q194-I196 PolarHBondContact O-N 3.29Å
195R44.8Very low70.5Confident150 Ų15071.9 Ų71.957%0.56634%0.342SS*.  trans-59.8131.6173.1-93-156.1-101.8-1673.1109L187 K192L187-R195 HydrophobicContact CD2-CG 3.94Å; K192-R195 WeakPolarHBondContact O-CB 3.07Å; K192-R195 VanDerWaalsContact O-CG 3.3Å; K192-R195 WeakPolarHBondContact O-CG 3.13Å
196I53.2Low71.7Confident21 Ų2168.7 Ų68.711%0.10832%0.322CS..  trans99.661167.4-50.3156.6000115.2W126 M127 Q194 E198 H199W126-I196 HydrophobicContact CH2-CD1 4.27Å; W126-I196 HydrophobicContact CZ3-CD1 4.28Å; M127-I196 HydrophobicContact CE-CD1 3.61Å; M127-I196 HydrophobicContact CE-CG1 4.19Å; M127-I196 HydrophobicContact CE-CG2 4.3Å; Q194-I196 PolarHBondContact O-N 3.29Å; I196-E198 VanDerWaalsContact CA-OE2 3.31Å; I196-E198 WeakPolarHBondContact CA-OE2 3.21Å; I196-E198 WeakPolarHBondContact CG1-OE1 3.44Å; I196-E198 WeakPolarHBondContact CG1-OE2 3.35Å; I196-E198 HydrophobicContact CG2-CG 3.63Å; I196-E198 WeakPolarHBondContact CG2-OE1 3.45Å; I196-E198 WeakPolarHBondContact CG2-OE2 3.43Å; I196-H199 PolarHBondContact O-ND1 3.21Å; I196-H199 VanDerWaalsContact O-ND1 3.17Å
197Q63.5Low73.1Confident12 Ų1268.3 Ų68.36%0.05632%0.32CS..  trans-83.29.2154.1-68.5-165.97.300112.5S186 H199 Y200S186-Q197 PolarHBondContact OG-OE1 2.95Å; Q197-H199 PolarHBondContact O-N 2.97Å; Q197-H199 VanDerWaalsContact O-N 3.17Å; Q197-Y200 HydrophobicContact CB-CD2 3.77Å; Q197-Y200 HydrophobicContact CB-CE2 3.72Å; Q197-Y200 HydrophobicContact CG-CD2 4.33Å; Q197-Y200 HydrophobicContact CG-CE2 3.76Å; Q197-Y200 WeakPolarHBondContact O-CD2 3.5Å; Q197-Y200 PolarHBondContact O-N 3.41Å
198E67.1Low74.5Confident84 Ų8466.2 Ų66.239%0.39331%0.309SS..THydrogen-bonded Turntrans-64.9-19.1-178.262.5-117.1-158.700114.2M127 I196 Y200 F201 L202M127-E198 WeakPolarHBondContact CE-OE1 3.4Å; I196-E198 VanDerWaalsContact CA-OE2 3.31Å; I196-E198 WeakPolarHBondContact CA-OE2 3.21Å; I196-E198 WeakPolarHBondContact CG1-OE1 3.44Å; I196-E198 WeakPolarHBondContact CG1-OE2 3.35Å; I196-E198 HydrophobicContact CG2-CG 3.63Å; I196-E198 WeakPolarHBondContact CG2-OE1 3.45Å; I196-E198 WeakPolarHBondContact CG2-OE2 3.43Å; E198-Y200 PolarHBondContact O-N 2.84Å; E198-F201 PolarHBondContact O-N 2.79Å; E198-L202 PolarHBondContact O-N 3.4Å
199H80.9Confident75.5Confident14 Ų1462.3 Ų62.37%0.06530%0.295CS..Hα-helixtrans-62.7-28.8176.662.1-86.9000112.6I196 Q197 F201 L202 M203I196-H199 PolarHBondContact O-ND1 3.21Å; I196-H199 VanDerWaalsContact O-ND1 3.17Å; Q197-H199 PolarHBondContact O-N 2.97Å; Q197-H199 VanDerWaalsContact O-N 3.17Å; H199-F201 PolarHBondContact O-N 3.29Å; H199-L202 PolarHBondContact O-N 2.91Å; H199-M203 HydrophobicContact CB-SD 4.48Å; H199-M203 VanDerWaalsContact O-CB 3.24Å; H199-M203 WeakPolarHBondContact O-CB 3.4Å; H199-M203 WeakPolarHBondContact O-CG 3.3Å; H199-M203 PolarHBondContact O-N 3.26Å
200Y88Confident76.6Confident3 Ų357.9 Ų57.91%0.01227%0.273CS..Hα-helixtrans-61.8-45.3179.4-64.3-59.2000112.7E66 A71 L182 Q197 E198 Y204E66-Y200 PolarHBondContact OE1-OH 3.45Å; E66-Y200 VanDerWaalsContact OE2-CE1 3.28Å; E66-Y200 WeakPolarHBondContact OE2-CE1 3.29Å; A71-Y200 HydrophobicContact CB-CE1 4.42Å; L182-Y200 HydrophobicContact CD2-CD2 4.07Å; L182-Y200 HydrophobicContact CD2-CE2 4.3Å; Q197-Y200 HydrophobicContact CB-CD2 3.77Å; Q197-Y200 HydrophobicContact CB-CE2 3.72Å; Q197-Y200 HydrophobicContact CG-CD2 4.33Å; Q197-Y200 HydrophobicContact CG-CE2 3.76Å; Q197-Y200 WeakPolarHBondContact O-CD2 3.5Å; Q197-Y200 PolarHBondContact O-N 3.41Å; E198-Y200 PolarHBondContact O-N 2.84Å; Y200-Y204 WeakPolarHBondContact O-CB 3.5Å; Y200-Y204 PolarHBondContact O-N 3.08Å
201F89.4Confident77.9Confident80 Ų8051 Ų5135%0.35125%0.247SC..Hα-helixtrans-69.4-41.3179.7-179.2-99.7000111.1L180 E198 H199 Y204 T205L180-F201 HydrophobicContact CB-CD2 4.04Å; L180-F201 HydrophobicContact CB-CE2 4.17Å; L180-F201 HydrophobicContact CD1-CD2 4.47Å; L180-F201 HydrophobicContact CD1-CE2 4.03Å; L180-F201 HydrophobicContact CD1-CZ 4.18Å; E198-F201 PolarHBondContact O-N 2.79Å; H199-F201 PolarHBondContact O-N 3.29Å; F201-Y204 PolarHBondContact O-N 2.87Å; F201-T205 HydrophobicContact CD1-CG2 4.32Å; F201-T205 HydrophobicContact CD2-CG2 4.49Å; F201-T205 HydrophobicContact CE1-CG2 3.84Å; F201-T205 HydrophobicContact CE2-CG2 4.03Å; F201-T205 HydrophobicContact CZ-CG2 3.68Å; F201-T205 WeakPolarHBondContact O-CG2 3.34Å; F201-T205 PolarHBondContact O-N 3.48Å; F201-T205 PolarHBondContact O-OG1 2.85Å
202L89.6Confident79.7Confident55 Ų5555.3 Ų55.329%0.28825%0.252SS..Hα-helixtrans-60.9-48.6175.6-175.865000111T110 L113 E198 H199 Y204 T205 T206T110-L202 HydrophobicContact CG2-CD2 3.88Å; T110-L202 HydrophobicContact CG2-CG 4.07Å; L113-L202 HydrophobicContact CD1-CD1 4.33Å; E198-L202 PolarHBondContact O-N 3.4Å; H199-L202 PolarHBondContact O-N 2.91Å; L202-Y204 PolarHBondContact O-N 3.47Å; L202-T205 PolarHBondContact O-N 3.39Å; L202-T205 PolarHBondContact O-OG1 3.27Å; L202-T206 WeakPolarHBondContact O-CG2 3.35Å; L202-T206 PolarHBondContact O-N 2.66Å; L202-T206 PolarHBondContact O-OG1 3.33Å
203M93.7Very high81.4Confident1 Ų150 Ų501%0.00524%0.236CC..Hα-helixtrans-61.9-42.6177-73.3173.77200112.1F62 V106 T110 I135 R136 G137 S139 G140 H199 T205 T206 G207F62-M203 HydrophobicContact CD2-CE 3.92Å; F62-M203 HydrophobicContact CE2-CE 3.45Å; F62-M203 VanDerWaalsContact CE2-CE 3.45Å; V106-M203 HydrophobicContact CG1-CE 4.47Å; T110-M203 HydrophobicContact CG2-CG 3.77Å; I135-M203 HydrophobicContact CG2-CE 3.81Å; I135-M203 HydrophobicContact CG2-CG 3.94Å; I135-M203 HydrophobicContact CG2-SD 3.5Å; I135-M203 WeakPolarHBondContact CG2-SD 3.33Å; R136-M203 WeakPolarHBondContact O-CE 3.21Å; G137-M203 VanDerWaalsContact O-CE 3.31Å; G137-M203 WeakPolarHBondContact O-CE 3.28Å; S139-M203 WeakPolarHBondContact OG-CB 3.22Å; G140-M203 VanDerWaalsContact CA-C 3.47Å; G140-M203 WeakPolarHBondContact CA-O 3.15Å; H199-M203 HydrophobicContact CB-SD 4.48Å; H199-M203 VanDerWaalsContact O-CB 3.24Å; H199-M203 WeakPolarHBondContact O-CB 3.4Å; H199-M203 WeakPolarHBondContact O-CG 3.3Å; H199-M203 PolarHBondContact O-N 3.26Å; M203-T205 VanDerWaalsContact C-N 3.34Å; M203-T205 PolarHBondContact O-N 3.42Å; M203-T206 VanDerWaalsContact CA-OG1 3.31Å; M203-T206 WeakPolarHBondContact CA-OG1 3.4Å; M203-T206 PolarHBondContact O-N 2.82Å; M203-T206 PolarHBondContact O-OG1 3.47Å; M203-G207 PolarHBondContact O-N 3.38Å
204Y94.2Very high83.2Confident2 Ų243.4 Ų43.41%0.00820%0.203CC..Hα-helixtrans-57.3-47.9176.4177.4-98.1000111.7G143 I146 P172 V175 Y179 Y200 F201 L202 G207 L208G143-Y204 VanDerWaalsContact CA-CD2 3.41Å; I146-Y204 HydrophobicContact CD1-CE2 3.95Å; P172-Y204 VanDerWaalsContact CA-OH 3.31Å; P172-Y204 WeakPolarHBondContact CA-OH 3.45Å; P172-Y204 PolarHBondContact O-OH 3.29Å; V175-Y204 HydrophobicContact CB-CE2 4.28Å; V175-Y204 HydrophobicContact CG1-CD2 4.48Å; V175-Y204 HydrophobicContact CG1-CE2 3.74Å; Y179-Y204 HydrophobicContact CD2-CD1 4.43Å; Y179-Y204 AromaticContact CD2-CD2 3.45Å; Y179-Y204 HydrophobicContact CD2-CD2 3.45Å; Y179-Y204 VanDerWaalsContact CD2-CD2 3.45Å; Y179-Y204 AromaticContact CD2-CE2 3.96Å; Y179-Y204 HydrophobicContact CD2-CE2 3.96Å; Y179-Y204 AromaticContact CD2-CG 3.73Å; Y179-Y204 HydrophobicContact CD2-CG 3.73Å; Y179-Y204 AromaticContact CE2-CD2 3.43Å; Y179-Y204 HydrophobicContact CE2-CD2 3.43Å; Y179-Y204 VanDerWaalsContact CE2-CD2 3.43Å; Y179-Y204 AromaticContact CE2-CE2 3.93Å; Y179-Y204 HydrophobicContact CE2-CE2 3.93Å; Y179-Y204 HydrophobicContact CE2-CG 4.13Å; Y200-Y204 WeakPolarHBondContact O-CB 3.5Å; Y200-Y204 PolarHBondContact O-N 3.08Å; F201-Y204 PolarHBondContact O-N 2.87Å; L202-Y204 PolarHBondContact O-N 3.47Å; Y204-G207 PolarHBondContact O-N 3.15Å; Y204-L208 HydrophobicContact CD1-CD1 3.79Å; Y204-L208 HydrophobicContact CE1-CD1 3.23Å; Y204-L208 HydrophobicContact CE1-CG 4.19Å; Y204-L208 PolarHBondContact O-N 3.45Å
205T92.8Very high84.8Confident37 Ų3741 Ų4123%0.22719%0.192CC..Hα-helixtrans-70-36.7179.1550000112.6F201 L202 M203 L208 I209F201-T205 HydrophobicContact CD1-CG2 4.32Å; F201-T205 HydrophobicContact CD2-CG2 4.49Å; F201-T205 HydrophobicContact CE1-CG2 3.84Å; F201-T205 HydrophobicContact CE2-CG2 4.03Å; F201-T205 HydrophobicContact CZ-CG2 3.68Å; F201-T205 WeakPolarHBondContact O-CG2 3.34Å; F201-T205 PolarHBondContact O-N 3.48Å; F201-T205 PolarHBondContact O-OG1 2.85Å; L202-T205 PolarHBondContact O-N 3.39Å; L202-T205 PolarHBondContact O-OG1 3.27Å; M203-T205 VanDerWaalsContact C-N 3.34Å; M203-T205 PolarHBondContact O-N 3.42Å; T205-L208 WeakPolarHBondContact O-CB 3.49Å; T205-L208 PolarHBondContact O-N 2.82Å; T205-I209 VanDerWaalsContact O-CG1 3.27Å; T205-I209 WeakPolarHBondContact O-CG1 3.14Å; T205-I209 PolarHBondContact O-N 2.94Å
206T95Very high86.7Confident4 Ų436.6 Ų36.63%0.02518%0.178CC..Hα-helixtrans-65.2-40.3172.857.30000111.5T110 L113 L202 M203 L208 I209 V210T110-T206 PolarHBondContact OG1-OG1 3.41Å; L113-T206 HydrophobicContact CD1-CG2 3.39Å; L202-T206 WeakPolarHBondContact O-CG2 3.35Å; L202-T206 PolarHBondContact O-N 2.66Å; L202-T206 PolarHBondContact O-OG1 3.33Å; M203-T206 VanDerWaalsContact CA-OG1 3.31Å; M203-T206 WeakPolarHBondContact CA-OG1 3.4Å; M203-T206 PolarHBondContact O-N 2.82Å; M203-T206 PolarHBondContact O-OG1 3.47Å; T206-L208 PolarHBondContact O-N 3.47Å; T206-I209 PolarHBondContact O-N 2.99Å; T206-V210 WeakPolarHBondContact O-CB 3.31Å; T206-V210 VanDerWaalsContact O-CG2 3.23Å; T206-V210 WeakPolarHBondContact O-CG2 3.2Å; T206-V210 PolarHBondContact O-N 3.3Å
207G96.6Very high88.1Confident0 Ų041.6 Ų41.60%020%0.196CC..Hα-helixtrans-57.4-46.7172.900000113.2G140 M203 Y204 V210 I211G140-G207 VanDerWaalsContact O-CA 3.31Å; G140-G207 WeakPolarHBondContact O-CA 3.41Å; M203-G207 PolarHBondContact O-N 3.38Å; Y204-G207 PolarHBondContact O-N 3.15Å; G207-V210 PolarHBondContact O-N 2.87Å; G207-I211 WeakPolarHBondContact O-CG2 3.39Å; G207-I211 PolarHBondContact O-N 3.43Å; G207-I211 VanDerWaalsContact O-N 3.1Å
208L94.5Very high88.5Confident33 Ų3343.4 Ų43.417%0.17320%0.202CC..Hα-helixtrans-56-49.7172.4-82.7166.9000111.8Y147 P172 Y204 T205 T206 I211 W212Y147-L208 HydrophobicContact CD2-CD2 3.9Å; Y147-L208 HydrophobicContact CG-CD2 4.18Å; P172-L208 HydrophobicContact CB-CD2 4.2Å; Y204-L208 HydrophobicContact CD1-CD1 3.79Å; Y204-L208 HydrophobicContact CE1-CD1 3.23Å; Y204-L208 HydrophobicContact CE1-CG 4.19Å; Y204-L208 PolarHBondContact O-N 3.45Å; T205-L208 WeakPolarHBondContact O-CB 3.49Å; T205-L208 PolarHBondContact O-N 2.82Å; T206-L208 PolarHBondContact O-N 3.47Å; L208-I211 WeakPolarHBondContact O-CG2 3.17Å; L208-W212 WeakPolarHBondContact O-CB 3.38Å; L208-W212 PolarHBondContact O-N 3.46Å
209I94.7Very high88.7Confident102 Ų10244 Ų4452%0.52321%0.205SC..Hα-helixtrans-66.1-43.1-177.9-68164.4000111.2T205 T206 W212 S213T205-I209 VanDerWaalsContact O-CG1 3.27Å; T205-I209 WeakPolarHBondContact O-CG1 3.14Å; T205-I209 PolarHBondContact O-N 2.94Å; T206-I209 PolarHBondContact O-N 2.99Å; I209-W212 PolarHBondContact O-N 3.39Å; I209-S213 VanDerWaalsContact O-CB 3.23Å; I209-S213 WeakPolarHBondContact O-CB 3.48Å; I209-S213 PolarHBondContact O-N 3.39Å; I209-S213 PolarHBondContact O-OG 3.4Å
210V94.9Very high88.2Confident18 Ų1851.4 Ų51.411%0.10924%0.237CC..Hα-helixtrans-57.9-53.9178.6165.10000109.8A105 F109 T206 G207 S213 Y214A105-V210 HydrophobicContact CB-CG1 3.64Å; A105-V210 HydrophobicContact CB-CG2 4.18Å; F109-V210 HydrophobicContact CD2-CG2 3.56Å; F109-V210 HydrophobicContact CE2-CG2 4.1Å; F109-V210 HydrophobicContact CG-CG2 4.37Å; T206-V210 WeakPolarHBondContact O-CB 3.31Å; T206-V210 VanDerWaalsContact O-CG2 3.23Å; T206-V210 WeakPolarHBondContact O-CG2 3.2Å; T206-V210 PolarHBondContact O-N 3.3Å; G207-V210 PolarHBondContact O-N 2.87Å; V210-S213 PolarHBondContact O-N 2.87Å; V210-S213 PolarHBondContact O-OG 2.84Å; V210-Y214 WeakPolarHBondContact O-CB 3.13Å; V210-Y214 PolarHBondContact O-N 3.09Å
211I93.7Very high87.1Confident5 Ų559.3 Ų59.33%0.02627%0.267CS..Hα-helixtrans-71.2-35-177.5-164.356.5000112.3Y98 A144 Y147 G207 L208 Y214 F215Y98-I211 HydrophobicContact CE2-CD1 3.68Å; Y98-I211 HydrophobicContact CE2-CG1 4.37Å; A144-I211 HydrophobicContact CB-CB 3.99Å; A144-I211 HydrophobicContact CB-CG2 4.04Å; Y147-I211 HydrophobicContact CD1-CB 4.49Å; Y147-I211 HydrophobicContact CD1-CG1 4.32Å; Y147-I211 HydrophobicContact CD1-CG2 3.47Å; Y147-I211 VanDerWaalsContact CD1-CG2 3.47Å; Y147-I211 HydrophobicContact CE1-CG2 4.39Å; Y147-I211 HydrophobicContact CG-CG2 3.66Å; G207-I211 WeakPolarHBondContact O-CG2 3.39Å; G207-I211 PolarHBondContact O-N 3.43Å; G207-I211 VanDerWaalsContact O-N 3.1Å; L208-I211 WeakPolarHBondContact O-CG2 3.17Å; I211-Y214 HydrophobicContact CD1-CD1 4.02Å; I211-Y214 HydrophobicContact CD1-CG 4.44Å; I211-Y214 WeakPolarHBondContact O-CB 3.38Å; I211-Y214 PolarHBondContact O-N 3.47Å; I211-F215 HydrophobicContact CD1-CD2 4.19Å; I211-F215 HydrophobicContact CD1-CE2 3.91Å; I211-F215 HydrophobicContact CG1-CD2 3.84Å; I211-F215 HydrophobicContact CG1-CE2 3.63Å; I211-F215 VanDerWaalsContact O-CD2 3.26Å; I211-F215 WeakPolarHBondContact O-CD2 3.33Å; I211-F215 PolarHBondContact O-N 3.37Å
212W91.7Very high85.3Confident126 Ų12659 Ų5948%0.47727%0.267SS..Hα-helixtrans-60.7-49.3174.117488.8000110.7Y147 L208 I209 Y214 F215 Q216Y147-W212 HydrophobicContact CE1-CB 4.39Å; Y147-W212 HydrophobicContact CE2-CB 4.11Å; Y147-W212 AromaticContact CE2-CD1 3.75Å; Y147-W212 HydrophobicContact CE2-CG 4.35Å; Y147-W212 AromaticContact CZ-CD1 3.63Å; L208-W212 WeakPolarHBondContact O-CB 3.38Å; L208-W212 PolarHBondContact O-N 3.46Å; I209-W212 PolarHBondContact O-N 3.39Å; W212-Y214 PolarHBondContact O-N 3.46Å; W212-F215 PolarHBondContact O-N 3.02Å; W212-Q216 HydrophobicContact CD2-CG 3.91Å; W212-Q216 HydrophobicContact CE3-CG 4.39Å; W212-Q216 HydrophobicContact CG-CG 4.37Å; W212-Q216 HydrophobicContact CH2-CG 4.34Å; W212-Q216 HydrophobicContact CZ2-CG 3.84Å; W212-Q216 WeakPolarHBondContact O-CB 3.42Å; W212-Q216 WeakPolarHBondContact O-CG 3.47Å; W212-Q216 PolarHBondContact O-N 3.37Å
213S90.1Very high83.6Confident55 Ų5559.4 Ų59.439%0.38527%0.274SS..Hα-helixtrans-60.2-37.1178.273.80000111.8I209 V210 W217I209-S213 VanDerWaalsContact O-CB 3.23Å; I209-S213 WeakPolarHBondContact O-CB 3.48Å; I209-S213 PolarHBondContact O-N 3.39Å; I209-S213 PolarHBondContact O-OG 3.4Å; V210-S213 PolarHBondContact O-N 2.87Å; V210-S213 PolarHBondContact O-OG 2.84Å; S213-W217 VanDerWaalsContact O-CB 3.23Å; S213-W217 WeakPolarHBondContact O-CB 3.31Å; S213-W217 PolarHBondContact O-N 2.98Å
214Y87.8Confident81.8Confident42 Ų4264.6 Ų64.617%0.16531%0.305CS..Hα-helixtrans-63.5-50.4174.9173.2-87.9000111.9V210 I211 W212 Q216 W217 Y218 L237 L241V210-Y214 WeakPolarHBondContact O-CB 3.13Å; V210-Y214 PolarHBondContact O-N 3.09Å; I211-Y214 HydrophobicContact CD1-CD1 4.02Å; I211-Y214 HydrophobicContact CD1-CG 4.44Å; I211-Y214 WeakPolarHBondContact O-CB 3.38Å; I211-Y214 PolarHBondContact O-N 3.47Å; W212-Y214 PolarHBondContact O-N 3.46Å; Y214-Q216 VanDerWaalsContact C-N 3.34Å; Y214-Q216 PolarHBondContact O-N 3.46Å; Y214-W217 PolarHBondContact O-N 3.11Å; Y214-Y218 VanDerWaalsContact O-CB 3.27Å; Y214-Y218 WeakPolarHBondContact O-CB 3.42Å; Y214-Y218 PolarHBondContact O-N 2.89Å; Y214-L237 WeakPolarHBondContact OH-CB 3.5Å; Y214-L241 HydrophobicContact CE1-CD1 3.34Å; Y214-L241 VanDerWaalsContact OH-CD1 3.23Å; Y214-L241 WeakPolarHBondContact OH-CD1 3.41Å
215F84.8Confident79.7Confident16 Ų1671.2 Ų71.27%0.0734%0.341CS..Hα-helixtrans-62.1-40.8177.3-83.4-67.7000112.1Y147 T148 H151 I211 W212 Y218 E219Y147-F215 AromaticContact CD1-CD2 3.96Å; Y147-F215 HydrophobicContact CD1-CD2 3.96Å; Y147-F215 HydrophobicContact CD1-CE2 4.15Å; Y147-F215 AromaticContact CE1-CD2 3.55Å; Y147-F215 HydrophobicContact CE1-CD2 3.55Å; Y147-F215 HydrophobicContact CE1-CE2 4.12Å; Y147-F215 HydrophobicContact CE1-CG 4.35Å; T148-F215 HydrophobicContact CG2-CZ 4.36Å; H151-F215 AromaticContact CD2-CD1 3.63Å; H151-F215 AromaticContact CD2-CE1 3.53Å; H151-F215 AromaticContact CD2-CZ 3.84Å; H151-F215 AromaticContact NE2-CD1 3.59Å; H151-F215 AromaticContact NE2-CE1 3.9Å; I211-F215 HydrophobicContact CD1-CD2 4.19Å; I211-F215 HydrophobicContact CD1-CE2 3.91Å; I211-F215 HydrophobicContact CG1-CD2 3.84Å; I211-F215 HydrophobicContact CG1-CE2 3.63Å; I211-F215 VanDerWaalsContact O-CD2 3.26Å; I211-F215 WeakPolarHBondContact O-CD2 3.33Å; I211-F215 PolarHBondContact O-N 3.37Å; W212-F215 PolarHBondContact O-N 3.02Å; F215-Y218 PolarHBondContact O-N 3.07Å; F215-E219 WeakPolarHBondContact O-CB 3.11Å; F215-E219 PolarHBondContact O-N 3.45Å
216Q83.6Confident77.4Confident59 Ų5973.6 Ų73.628%0.27635%0.35SS..Hα-helixtrans-63.7-44.8176.8-70.9-65.8-24.800112.3W212 Y214 Y218 K220W212-Q216 HydrophobicContact CD2-CG 3.91Å; W212-Q216 HydrophobicContact CE3-CG 4.39Å; W212-Q216 HydrophobicContact CG-CG 4.37Å; W212-Q216 HydrophobicContact CH2-CG 4.34Å; W212-Q216 HydrophobicContact CZ2-CG 3.84Å; W212-Q216 WeakPolarHBondContact O-CB 3.42Å; W212-Q216 WeakPolarHBondContact O-CG 3.47Å; W212-Q216 PolarHBondContact O-N 3.37Å; Y214-Q216 VanDerWaalsContact C-N 3.34Å; Y214-Q216 PolarHBondContact O-N 3.46Å; Q216-Y218 VanDerWaalsContact C-N 3.3Å; Q216-Y218 PolarHBondContact O-N 2.87Å; Q216-K220 WeakPolarHBondContact O-CB 3.36Å; Q216-K220 VanDerWaalsContact O-CG 3.28Å; Q216-K220 WeakPolarHBondContact O-CG 3.18Å; Q216-K220 PolarHBondContact O-N 2.8Å; Q216-K220 VanDerWaalsContact O-N 3.09Å
217W82.5Confident75.2Confident126 Ų12679.9 Ų79.948%0.47738%0.377SS..Hα-helixtrans-62.1-41.5175.9174.893.5000111.4S213 Y214 R221S213-W217 VanDerWaalsContact O-CB 3.23Å; S213-W217 WeakPolarHBondContact O-CB 3.31Å; S213-W217 PolarHBondContact O-N 2.98Å; Y214-W217 PolarHBondContact O-N 3.11Å; W217-R221 VanDerWaalsContact CZ2-NH1 3.33Å; W217-R221 VanDerWaalsContact NE1-CZ 3.33Å; W217-R221 WeakPolarHBondContact O-CG 3.5Å; W217-R221 PolarHBondContact O-N 3.26Å
218Y72.2Confident72.7Confident49 Ų4984.1 Ų84.119%0.19241%0.406CS..Hα-helixtrans-67.1-46.4-180-175.9-110000111.7Y214 F215 Q216 K220 R221 M222 S235 G238Y214-Y218 VanDerWaalsContact O-CB 3.27Å; Y214-Y218 WeakPolarHBondContact O-CB 3.42Å; Y214-Y218 PolarHBondContact O-N 2.89Å; F215-Y218 PolarHBondContact O-N 3.07Å; Q216-Y218 VanDerWaalsContact C-N 3.3Å; Q216-Y218 PolarHBondContact O-N 2.87Å; Y218-K220 PolarHBondContact O-N 3.29Å; Y218-R221 PolarHBondContact O-N 3.17Å; Y218-M222 HydrophobicContact CD1-CE 3.48Å; Y218-M222 VanDerWaalsContact CD1-CE 3.48Å; Y218-M222 HydrophobicContact CE1-CE 2.96Å; Y218-M222 HydrophobicContact CG-CE 4.44Å; Y218-S235 PolarHBondContact OH-OG 3.41Å; Y218-G238 VanDerWaalsContact CZ-CA 3.43Å; Y218-G238 WeakPolarHBondContact OH-CA 3.31Å
219E72.4Confident70.1Confident98 Ų9889.3 Ų89.346%0.45843%0.429SS..Hα-helixtrans-62.2-42.9178-175.2176.4-177.600112.3F215 R221 M222F215-E219 WeakPolarHBondContact O-CB 3.11Å; F215-E219 PolarHBondContact O-N 3.45Å; E219-R221 PolarHBondContact O-N 2.77Å; E219-M222 WeakPolarHBondContact O-CB 3.28Å; E219-M222 PolarHBondContact O-N 3.15Å; E219-M222 VanDerWaalsContact O-N 3.15Å
220K70.5Confident67.7Low169 Ų16989.7 Ų89.774%0.73542%0.424SS*.Hα-helixtrans-62.8-28.3178.5-75.9175-177.4-179.90113.5Q216 Y218 M222Q216-K220 WeakPolarHBondContact O-CB 3.36Å; Q216-K220 VanDerWaalsContact O-CG 3.28Å; Q216-K220 WeakPolarHBondContact O-CG 3.18Å; Q216-K220 PolarHBondContact O-N 2.8Å; Q216-K220 VanDerWaalsContact O-N 3.09Å; Y218-K220 PolarHBondContact O-N 3.29Å; K220-M222 VanDerWaalsContact C-N 3.31Å
221R64.1Low65.3Low168 Ų16895.7 Ų95.763%0.63446%0.461SS*.THydrogen-bonded Turntrans-84.9-4180-73.1-179.4175.3-134.61.5113.3W217 Y218 E219 P223W217-R221 VanDerWaalsContact CZ2-NH1 3.33Å; W217-R221 VanDerWaalsContact NE1-CZ 3.33Å; W217-R221 WeakPolarHBondContact O-CG 3.5Å; W217-R221 PolarHBondContact O-N 3.26Å; Y218-R221 PolarHBondContact O-N 3.17Å; E219-R221 PolarHBondContact O-N 2.77Å; R221-P223 VanDerWaalsContact O-CD 3.3Å; R221-P223 WeakPolarHBondContact O-CD 3.41Å
222M51.5Low62.8Low73 Ų73105.1 Ų105.136%0.3650%0.496SS..SBendtrans-79.5116171.3-61.3-177.3-175.600110Y218 E219 K220 T224Y218-M222 HydrophobicContact CD1-CE 3.48Å; Y218-M222 VanDerWaalsContact CD1-CE 3.48Å; Y218-M222 HydrophobicContact CE1-CE 2.96Å; Y218-M222 HydrophobicContact CG-CE 4.44Å; E219-M222 WeakPolarHBondContact O-CB 3.28Å; E219-M222 PolarHBondContact O-N 3.15Å; E219-M222 VanDerWaalsContact O-N 3.15Å; K220-M222 VanDerWaalsContact C-N 3.31Å; M222-T224 PolarHBondContact O-N 3.28Å
223P54.3Low60Low65 Ų65104.6 Ų104.642%0.42251%0.507SS..  trans-67.7137172.325.8-28.4000110.1R221 N225 E226 K227R221-P223 VanDerWaalsContact O-CD 3.3Å; R221-P223 WeakPolarHBondContact O-CD 3.41Å; P223-N225 PolarHBondContact O-N 2.79Å; P223-N225 VanDerWaalsContact O-N 3.08Å; P223-E226 WeakPolarHBondContact CD-OE2 3.49Å; P223-E226 HydrophobicContact CG-CB 3.84Å; P223-E226 HydrophobicContact CG-CG 3.69Å; P223-E226 WeakPolarHBondContact CG-OE2 3.41Å; P223-E226 PolarHBondContact O-N 2.64Å; P223-K227 PolarHBondContact O-N 3.17Å
224T56.3Low57.3Low110 Ų110106.3 Ų106.368%0.67552%0.519SS*.THydrogen-bonded Turntrans-55.7-28.6-175.9-55.80000113.8M222 K227M222-T224 PolarHBondContact O-N 3.28Å; T224-K227 WeakPolarHBondContact O-CB 3.36Å; T224-K227 PolarHBondContact O-N 3.24Å
225N50Low55.4Low140 Ų140106.3 Ų106.375%0.74953%0.525SS*.THydrogen-bonded Turntrans-78.3-25.1175.1-88-19000113.9P223 K227 S228P223-N225 PolarHBondContact O-N 2.79Å; P223-N225 VanDerWaalsContact O-N 3.08Å; N225-K227 PolarHBondContact O-N 3.47Å; N225-S228 PolarHBondContact O-N 3.23Å; N225-S228 PolarHBondContact O-OG 2.77Å
226E44.6Very low53.5Low88 Ų88113.6 Ų113.641%0.41155%0.552SS.*THydrogen-bonded Turntrans-82.5-2.7172.1-68.8-172.3140.700112.3P223 S228 R230P223-E226 WeakPolarHBondContact CD-OE2 3.49Å; P223-E226 HydrophobicContact CG-CB 3.84Å; P223-E226 HydrophobicContact CG-CG 3.69Å; P223-E226 WeakPolarHBondContact CG-OE2 3.41Å; P223-E226 PolarHBondContact O-N 2.64Å; E226-S228 PolarHBondContact O-N 3.43Å; E226-R230 IonicContact OE1-CZ 3.74Å; E226-R230 IonicContact OE1-NH2 3.08Å; E226-R230 PolarHBondContact OE1-NH2 3.31Å
227K47.9Very low51.7Low136 Ų136113.6 Ų113.659%0.59155%0.554SS**THydrogen-bonded Turntrans-66.5-24.3166.5-64.1-177.4177-1790111.9P223 T224 N225P223-K227 PolarHBondContact O-N 3.17Å; T224-K227 WeakPolarHBondContact O-CB 3.36Å; T224-K227 PolarHBondContact O-N 3.24Å; N225-K227 PolarHBondContact O-N 3.47Å
228S44.4Very low50.1Low88 Ų88108.1 Ų108.162%0.61554%0.536SS*.THydrogen-bonded Turntrans-100-37.6179630000113.8N225 E226N225-S228 PolarHBondContact O-N 3.23Å; N225-S228 PolarHBondContact O-OG 2.77Å; E226-S228 PolarHBondContact O-N 3.43Å
229E39.1Very low48.9Very low142 Ų142109.8 Ų109.866%0.66456%0.555SS**SBendtrans-100105.1-178.9-137.486.2-167.900109.1
230R45Very low47.8Very low111 Ų111108.1 Ų108.142%0.41955%0.546SS..  trans99.5109.3173.9-58.4-170.7-100.2-179.9-0.2114.1E226 R232 T233 S234E226-R230 IonicContact OE1-CZ 3.74Å; E226-R230 IonicContact OE1-NH2 3.08Å; E226-R230 PolarHBondContact OE1-NH2 3.31Å; R230-R232 HydrophobicContact CB-CB 4.5Å; R230-R232 WeakPolarHBondContact CD-O 3.49Å; R230-R232 HydrophobicContact CG-CB 4.29Å; R230-R232 WeakPolarHBondContact CG-O 3.3Å; R230-T233 WeakPolarHBondContact CD-O 3.28Å; R230-T233 PolarHBondContact NH1-O 3.36Å; R230-T233 PolarHBondContact NH1-OG1 3.46Å; R230-S234 PolarHBondContact NH1-OG 2.84Å; R230-S234 VanDerWaalsContact NH1-OG 3.13Å
231T44.9Very low46.7Very low143 Ų143100.9 Ų100.988%0.87752%0.516SS*.SBendcis43.7-171837.60000119.2
232R40Very low45.9Very low204 Ų204100.7 Ų100.777%0.7752%0.515SS*.SBendtrans-159.488.8-177.4-80.9-171.1159.3171.2-7.2113.4R230R230-R232 HydrophobicContact CB-CB 4.5Å; R230-R232 WeakPolarHBondContact CD-O 3.49Å; R230-R232 HydrophobicContact CG-CB 4.29Å; R230-R232 WeakPolarHBondContact CG-O 3.3Å
233T34.8Very low45.6Very low114 Ų11498.6 Ų98.670%0.69951%0.507SS*.  trans98.8134.9157.376.70000118.8R230R230-T233 WeakPolarHBondContact CD-O 3.28Å; R230-T233 PolarHBondContact NH1-O 3.36Å; R230-T233 PolarHBondContact NH1-OG1 3.46Å
234S32.1Very low45.2Very low92 Ų92100.1 Ų100.164%0.64351%0.512SS*.  trans87.161.7158.480.20000120.1R230R230-S234 PolarHBondContact NH1-OG 2.84Å; R230-S234 VanDerWaalsContact NH1-OG 3.13Å
235S47.5Very low44.7Very low41 Ų41100.6 Ų100.629%0.28751%0.51SS..  -141.5126.9120.360.60000108.1Y218 L237 G238 S239Y218-S235 PolarHBondContact OH-OG 3.41Å; S235-L237 VanDerWaalsContact C-N 3.3Å; S235-L237 PolarHBondContact O-N 3.22Å; S235-G238 PolarHBondContact O-N 3.16Å; S235-G238 VanDerWaalsContact OG-CA 3.27Å; S235-G238 WeakPolarHBondContact OG-CA 3.41Å; S235-G238 PolarHBondContact OG-N 2.92Å; S235-S239 PolarHBondContact O-N 3.26Å; S235-S239 PolarHBondContact O-OG 3.31Å; S235-S239 VanDerWaalsContact O-OG 3.09Å
236W45.8Very low44.3Very low170 Ų170100.3 Ų100.364%0.64451%0.508SS*.Hα-helixtrans-53.9-48.4-173.4179.278.8000110.6S239 F240W236-S239 PolarHBondContact O-OG 3.48Å; W236-S239 VanDerWaalsContact O-OG 3.08Å; W236-F240 AromaticContact CD1-CE2 3.7Å; W236-F240 HydrophobicContact CD2-CD2 4.33Å; W236-F240 AromaticContact CD2-CE2 3.88Å; W236-F240 HydrophobicContact CD2-CE2 3.88Å; W236-F240 AromaticContact CE2-CE2 3.59Å; W236-F240 HydrophobicContact CG-CD2 4.5Å; W236-F240 AromaticContact CG-CE2 3.94Å; W236-F240 HydrophobicContact CG-CE2 3.94Å; W236-F240 HydrophobicContact CZ2-CE2 4.12Å; W236-F240 AromaticContact NE1-CE2 3.49Å; W236-F240 WeakPolarHBondContact O-CD2 3.11Å; W236-F240 VanDerWaalsContact O-CE2 3.25Å; W236-F240 WeakPolarHBondContact O-CE2 3.33Å; W236-F240 PolarHBondContact O-N 3.42Å
237L46.5Very low44.5Very low58 Ų5897.5 Ų97.530%0.30450%0.5SS..Hα-helixtrans-76.6-31.6176.3-88.8142.7000115.3Y214 S235 F240 L241Y214-L237 WeakPolarHBondContact OH-CB 3.5Å; S235-L237 VanDerWaalsContact C-N 3.3Å; S235-L237 PolarHBondContact O-N 3.22Å; L237-F240 CarbonylContact O-C 3.45Å; L237-F240 WeakPolarHBondContact O-CB 3.28Å; L237-F240 PolarHBondContact O-N 3.3Å; L237-F240 VanDerWaalsContact O-N 3.16Å; L237-L241 WeakPolarHBondContact O-CB 3.47Å; L237-L241 WeakPolarHBondContact O-CG 3.14Å; L237-L241 PolarHBondContact O-N 3.5Å
238G48.2Very low44.5Very low11 Ų1196 Ų9611%0.11350%0.495CS..Hα-helixtrans-73.7-32.9-18000000115Y218 S235 F240 L241Y218-G238 VanDerWaalsContact CZ-CA 3.43Å; Y218-G238 WeakPolarHBondContact OH-CA 3.31Å; S235-G238 PolarHBondContact O-N 3.16Å; S235-G238 VanDerWaalsContact OG-CA 3.27Å; S235-G238 WeakPolarHBondContact OG-CA 3.41Å; S235-G238 PolarHBondContact OG-N 2.92Å; G238-F240 VanDerWaalsContact C-N 3.25Å; G238-L241 PolarHBondContact O-N 3.07Å
239S47.9Very low44.6Very low84 Ų8493.4 Ų93.459%0.58747%0.473SS*.Hα-helixtrans-68.8-28.116760.90000111.8S235 W236S235-S239 PolarHBondContact O-N 3.26Å; S235-S239 PolarHBondContact O-OG 3.31Å; S235-S239 VanDerWaalsContact O-OG 3.09Å; W236-S239 PolarHBondContact O-OG 3.48Å; W236-S239 VanDerWaalsContact O-OG 3.08Å
240F48.7Very low45.1Very low63 Ų6389 Ų8928%0.27645%0.452SS..Hα-helixtrans-72.6-44.6171.8-75.1-57.5000111.4W90 W236 L237 G238 R242W90-F240 WeakPolarHBondContact CA-O 3.43Å; W90-F240 VanDerWaalsContact CG-O 3.26Å; W90-F240 PolarHBondContact NE1-O 2.97Å; W90-F240 VanDerWaalsContact O-CD1 3.27Å; W90-F240 WeakPolarHBondContact O-CD1 3.49Å; W236-F240 AromaticContact CD1-CE2 3.7Å; W236-F240 HydrophobicContact CD2-CD2 4.33Å; W236-F240 AromaticContact CD2-CE2 3.88Å; W236-F240 HydrophobicContact CD2-CE2 3.88Å; W236-F240 AromaticContact CE2-CE2 3.59Å; W236-F240 HydrophobicContact CG-CD2 4.5Å; W236-F240 AromaticContact CG-CE2 3.94Å; W236-F240 HydrophobicContact CG-CE2 3.94Å; W236-F240 HydrophobicContact CZ2-CE2 4.12Å; W236-F240 AromaticContact NE1-CE2 3.49Å; W236-F240 WeakPolarHBondContact O-CD2 3.11Å; W236-F240 VanDerWaalsContact O-CE2 3.25Å; W236-F240 WeakPolarHBondContact O-CE2 3.33Å; W236-F240 PolarHBondContact O-N 3.42Å; L237-F240 CarbonylContact O-C 3.45Å; L237-F240 WeakPolarHBondContact O-CB 3.28Å; L237-F240 PolarHBondContact O-N 3.3Å; L237-F240 VanDerWaalsContact O-N 3.16Å; G238-F240 VanDerWaalsContact C-N 3.25Å; F240-R242 VanDerWaalsContact C-N 3.28Å; F240-R242 PolarHBondContact O-N 2.96Å
241L47.5Very low45.5Very low17 Ų1790.2 Ų90.29%0.08947%0.467CS..Hα-helixtrans-72.9-14.5-169.1-73.3166.1000115.1W90 Y214 L237 G238W90-L241 HydrophobicContact CD2-CD2 4.29Å; W90-L241 HydrophobicContact CH2-CD2 3.6Å; W90-L241 HydrophobicContact CZ2-CD2 3.28Å; W90-L241 HydrophobicContact CZ2-CG 4.49Å; W90-L241 HydrophobicContact CZ3-CD2 4.26Å; W90-L241 VanDerWaalsContact NE1-C 3.25Å; W90-L241 VanDerWaalsContact NE1-CA 3.28Å; W90-L241 PolarHBondContact NE1-O 2.9Å; Y214-L241 HydrophobicContact CE1-CD1 3.34Å; Y214-L241 VanDerWaalsContact OH-CD1 3.23Å; Y214-L241 WeakPolarHBondContact OH-CD1 3.41Å; L237-L241 WeakPolarHBondContact O-CB 3.47Å; L237-L241 WeakPolarHBondContact O-CG 3.14Å; L237-L241 PolarHBondContact O-N 3.5Å; G238-L241 PolarHBondContact O-N 3.07Å
242R46.5Very low45.8Very low165 Ų16584.1 Ų84.162%0.62343%0.429SS*.SBendtrans-97.7130.3-178.3-163176.2148.7115.52111F240 N244 D245F240-R242 VanDerWaalsContact C-N 3.28Å; F240-R242 PolarHBondContact O-N 2.96Å; R242-N244 PolarHBondContact O-N 3.43Å; R242-D245 IonicContact CZ-OD1 2.87Å; R242-D245 IonicContact NE-OD1 2.8Å; R242-D245 IonicContact NH2-OD1 3.78Å; R242-D245 PolarHBondContact NH2-OD1 3.35Å
243P45.6Very low46.2Very low28 Ų2876.1 Ų76.118%0.18240%0.401CS..PPolyproline II helixtrans-50.7137.2171.914.7-25.9000111.8I89 T152 F153 D245I89-P243 HydrophobicContact CB-CB 4.41Å; I89-P243 HydrophobicContact CD1-CB 4.04Å; I89-P243 HydrophobicContact CG1-CB 3.94Å; I89-P243 HydrophobicContact CG2-CB 3.74Å; I89-P243 HydrophobicContact CG2-CG 4.37Å; I89-P243 VanDerWaalsContact CG2-N 3.32Å; T152-P243 HydrophobicContact CG2-CG 3.9Å; F153-P243 HydrophobicContact CE1-CG 4.43Å; F153-P243 HydrophobicContact CZ-CB 4.5Å; F153-P243 HydrophobicContact CZ-CG 4.26Å; P243-D245 PolarHBondContact O-N 2.93Å
244N46Very low46.7Very low98 Ų9877.3 Ų77.352%0.52440%0.403SS..PPolyproline II helixtrans-47.8122.6159.3-171.730000107.1R242 D246 A247R242-N244 PolarHBondContact O-N 3.43Å; N244-D246 PolarHBondContact O-N 2.96Å; N244-A247 PolarHBondContact O-N 3.2Å
245D45.6Very low47.4Very low120 Ų12076.9 Ų76.964%0.64240%0.397SS*.THydrogen-bonded Turntrans-59.7-14.5-171.6-68.4-48.4000112.2R242 P243R242-D245 IonicContact CZ-OD1 2.87Å; R242-D245 IonicContact NE-OD1 2.8Å; R242-D245 IonicContact NH2-OD1 3.78Å; R242-D245 PolarHBondContact NH2-OD1 3.35Å; P243-D245 PolarHBondContact O-N 2.93Å
246D42.4Very low46.7Very low133 Ų13383 Ų8371%0.71142%0.419SS*.THydrogen-bonded Turntrans-85.2-16176.8-63.6-28.6000115N244 Q248N244-D246 PolarHBondContact O-N 2.96Å; D246-Q248 PolarHBondContact O-N 3.49Å
247A47.5Very low46.6Very low29 Ų2976.9 Ų76.924%0.2440%0.4CS..  trans-83.888.5-174.800000110.2N244 F249 L252N244-A247 PolarHBondContact O-N 3.2Å; A247-F249 PolarHBondContact O-N 2.94Å; A247-L252 HydrophobicContact CB-CD1 3.61Å
248Q47.6Very low46.1Very low105 Ų10580.7 Ų80.749%0.49142%0.415SS..  trans-62.8125.6172.3-61.1-156.6-2.400108.7D246 E250 D251 L252D246-Q248 PolarHBondContact O-N 3.49Å; Q248-E250 PolarHBondContact O-N 2.9Å; Q248-D251 PolarHBondContact O-N 2.95Å; Q248-L252 PolarHBondContact O-N 2.83Å
249F47.4Very low45.4Very low33 Ų3386.9 Ų86.915%0.14544%0.439CS..Hα-helixtrans-50.9-26.8178.1-175.1-90.5000113.2V85 F153 T156 A247 L252 L253V85-F249 HydrophobicContact CG1-CE2 4.4Å; F153-F249 HydrophobicContact CB-CD2 4.31Å; F153-F249 HydrophobicContact CB-CE2 4.17Å; F153-F249 HydrophobicContact CD1-CB 4.44Å; F153-F249 AromaticContact CD1-CD2 3.81Å; F153-F249 HydrophobicContact CD1-CD2 3.81Å; F153-F249 HydrophobicContact CD1-CE2 4.45Å; F153-F249 HydrophobicContact CD1-CG 4.41Å; F153-F249 AromaticContact CD2-CD2 3.61Å; F153-F249 HydrophobicContact CD2-CD2 3.61Å; F153-F249 AromaticContact CD2-CE2 3.58Å; F153-F249 HydrophobicContact CD2-CE2 3.58Å; F153-F249 HydrophobicContact CE1-CB 4.33Å; F153-F249 AromaticContact CE1-CD2 3.93Å; F153-F249 HydrophobicContact CE1-CD2 3.93Å; F153-F249 AromaticContact CE2-CD2 3.74Å; F153-F249 HydrophobicContact CE2-CD2 3.74Å; F153-F249 HydrophobicContact CE2-CE2 4.02Å; F153-F249 AromaticContact CG-CD2 3.63Å; F153-F249 HydrophobicContact CG-CD2 3.63Å; F153-F249 AromaticContact CG-CE2 3.82Å; F153-F249 HydrophobicContact CG-CE2 3.82Å; F153-F249 AromaticContact CZ-CD2 3.89Å; F153-F249 HydrophobicContact CZ-CD2 3.89Å; T156-F249 HydrophobicContact CG2-CD1 3.62Å; T156-F249 HydrophobicContact CG2-CE1 3.09Å; T156-F249 HydrophobicContact CG2-CZ 3.65Å; A247-F249 PolarHBondContact O-N 2.94Å; F249-L252 PolarHBondContact O-N 3.23Å; F249-L253 HydrophobicContact CD1-CD1 3.92Å; F249-L253 HydrophobicContact CD2-CD1 4.23Å; F249-L253 HydrophobicContact CE1-CD1 3.16Å; F249-L253 HydrophobicContact CE2-CD1 3.57Å; F249-L253 HydrophobicContact CG-CD1 4.41Å; F249-L253 HydrophobicContact CZ-CD1 3Å; F249-L253 HydrophobicContact CZ-CG 4.46Å; F249-L253 PolarHBondContact O-N 3.4Å
250E49.8Very low45Very low50 Ų5085.5 Ų85.523%0.23443%0.427CS..Hα-helixtrans-60.7-42.5173.7-54.3-168.8153.100112.4Q248 D254 V257 K259Q248-E250 PolarHBondContact O-N 2.9Å; E250-D254 PolarHBondContact O-N 3.31Å; E250-V257 HydrophobicContact CG-CB 4.01Å; E250-V257 HydrophobicContact CG-CG2 4.29Å; E250-K259 WeakPolarHBondContact OE2-CE 3.35Å; E250-K259 IonicContact OE2-NZ 3.05Å; E250-K259 PolarHBondContact OE2-NZ 3.45Å
251D52.4Low44.7Very low136 Ų13687.6 Ų87.673%0.72746%0.456SS*.Hα-helixtrans-72.4-34.5177.4-72.9-13.6000111.4Q248Q248-D251 PolarHBondContact O-N 2.95Å
252L51.3Low44.3Very low16 Ų1691.2 Ų91.28%0.08448%0.479CS..Hα-helixtrans-68.5-36.5-176.9-90.9126.6000113.3R84 V85 P88 I89 A247 Q248 F249R84-L252 WeakPolarHBondContact CD-O 3.48Å; R84-L252 WeakPolarHBondContact CG-O 3.48Å; R84-L252 VanDerWaalsContact CZ-O 3.25Å; R84-L252 PolarHBondContact NE-O 3.29Å; R84-L252 PolarHBondContact NH2-O 3.09Å; R84-L252 WeakPolarHBondContact O-CD2 3.32Å; V85-L252 WeakPolarHBondContact O-CD2 3.37Å; P88-L252 HydrophobicContact CB-CD2 3.91Å; P88-L252 HydrophobicContact CG-CD2 3.66Å; I89-L252 HydrophobicContact CD1-CD2 4.47Å; I89-L252 HydrophobicContact CG1-CD2 4.34Å; A247-L252 HydrophobicContact CB-CD1 3.61Å; Q248-L252 PolarHBondContact O-N 2.83Å; F249-L252 PolarHBondContact O-N 3.23Å
253L49.1Very low43.9Very low35 Ų3587.6 Ų87.618%0.18348%0.477CS..Hα-helixtrans-100.3-10.3-175.1-87.2154.9000114.7R84 V85 F249 V255R84-L253 VanDerWaalsContact NH1-C 3.34Å; R84-L253 PolarHBondContact NH1-O 3.18Å; R84-L253 PolarHBondContact NH2-O 3.18Å; V85-L253 HydrophobicContact CG2-CD1 3.89Å; V85-L253 HydrophobicContact CG2-CD2 4.07Å; V85-L253 HydrophobicContact CG2-CG 3.84Å; F249-L253 HydrophobicContact CD1-CD1 3.92Å; F249-L253 HydrophobicContact CD2-CD1 4.23Å; F249-L253 HydrophobicContact CE1-CD1 3.16Å; F249-L253 HydrophobicContact CE2-CD1 3.57Å; F249-L253 HydrophobicContact CG-CD1 4.41Å; F249-L253 HydrophobicContact CZ-CD1 3Å; F249-L253 HydrophobicContact CZ-CG 4.46Å; F249-L253 PolarHBondContact O-N 3.4Å; L253-V255 HydrophobicContact CB-CB 4.19Å; L253-V255 HydrophobicContact CB-CG2 4.14Å; L253-V255 PolarHBondContact O-N 3.39Å
254D46.3Very low43.9Very low139 Ų13988.6 Ų88.674%0.74348%0.481SS*.  trans47.39.4-170.9-160.532.7000113.2R84 E250 K256R84-D254 VanDerWaalsContact NH2-N 3.17Å; E250-D254 PolarHBondContact O-N 3.31Å; D254-K256 PolarHBondContact O-N 2.91Å
255V44.9Very low43.6Very low84 Ų8491.4 Ų91.451%0.50949%0.49SS..  trans-77.7104159.6178.60000101.3L253 V257L253-V255 HydrophobicContact CB-CB 4.19Å; L253-V255 HydrophobicContact CB-CG2 4.14Å; L253-V255 PolarHBondContact O-N 3.39Å; V255-V257 PolarHBondContact O-N 3.46Å
256K33.2Very low43.9Very low170 Ų17089.7 Ų89.774%0.73950%0.501SS*.  trans-57.182.1165-161.3177-167.9177.60106.9D254 H258D254-K256 PolarHBondContact O-N 2.91Å; K256-H258 PolarHBondContact O-N 2.99Å; K256-H258 PolarHBondContact O-ND1 3.36Å
257V43.8Very low44.2Very low41 Ų4186.7 Ų86.725%0.24849%0.488CS..  trans-54.6108159.8-178.50000101E250 V255 K259E250-V257 HydrophobicContact CG-CB 4.01Å; E250-V257 HydrophobicContact CG-CG2 4.29Å; V255-V257 PolarHBondContact O-N 3.46Å; V257-K259 VanDerWaalsContact C-N 3.3Å; V257-K259 PolarHBondContact O-N 2.9Å
258H36.5Very low44.1Very low137 Ų13787 Ų8763%0.63449%0.494SS*.  trans-60.7112.4175.9-7545.3000103.3K256 V260K256-H258 PolarHBondContact O-N 2.99Å; K256-H258 PolarHBondContact O-ND1 3.36Å; H258-V260 HydrophobicContact CB-CG2 3.27Å; H258-V260 WeakPolarHBondContact O-CG2 3.03Å; H258-V260 PolarHBondContact O-N 3.31Å
259K33.4Very low44.5Very low141 Ų14184.6 Ų84.661%0.61349%0.492SS*.  trans-64.374.1163.8-128.8173-157.6134.80105.2E250 V257 A261E250-K259 WeakPolarHBondContact OE2-CE 3.35Å; E250-K259 IonicContact OE2-NZ 3.05Å; E250-K259 PolarHBondContact OE2-NZ 3.45Å; V257-K259 VanDerWaalsContact C-N 3.3Å; V257-K259 PolarHBondContact O-N 2.9Å; K259-A261 VanDerWaalsContact C-N 3.26Å; K259-A261 PolarHBondContact O-N 2.91Å
260V39.8Very low45Very low55 Ų5589.1 Ų89.133%0.33352%0.516SS..  trans-79.292.2-176.6-172.20000104.5H258 T262H258-V260 HydrophobicContact CB-CG2 3.27Å; H258-V260 WeakPolarHBondContact O-CG2 3.03Å; H258-V260 PolarHBondContact O-N 3.31Å; V260-T262 HydrophobicContact CG1-CG2 4.03Å; V260-T262 VanDerWaalsContact CG1-O 3.23Å; V260-T262 WeakPolarHBondContact CG1-O 3.27Å; V260-T262 WeakPolarHBondContact CG1-OG1 3.31Å; V260-T262 PolarHBondContact O-N 3.34Å
261A42Very low45.7Very low107 Ų10789.9 Ų89.988%0.88452%0.522SS*.  trans-63.3-2.7157.200000111.7K259K259-A261 VanDerWaalsContact C-N 3.26Å; K259-A261 PolarHBondContact O-N 2.91Å
262T39.5Very low46.2Very low94 Ų9486.5 Ų86.558%0.57751%0.513SS*.SBendtrans-82.6137.5168.885.40000111V260 I264V260-T262 HydrophobicContact CG1-CG2 4.03Å; V260-T262 VanDerWaalsContact CG1-O 3.23Å; V260-T262 WeakPolarHBondContact CG1-O 3.27Å; V260-T262 WeakPolarHBondContact CG1-OG1 3.31Å; V260-T262 PolarHBondContact O-N 3.34Å; T262-I264 PolarHBondContact O-N 2.85Å
263P37.4Very low47.4Very low89 Ų8989.3 Ų89.358%0.57853%0.526SS*.  trans-52.3132.8-177.4-27.935.7000111.9E265 A269P263-E265 PolarHBondContact O-N 2.99Å; P263-E265 VanDerWaalsContact O-N 3.15Å; P263-A269 HydrophobicContact CB-CB 4.03Å; P263-A269 HydrophobicContact CG-CB 4.11Å
264I46.4Very low48.7Very low49 Ų4995.2 Ų95.225%0.25155%0.546SS..  trans-68.1109.8168.8-65.5173.9000107.4I157 T262 G266 V267I157-I264 HydrophobicContact CD1-CD1 4.21Å; T262-I264 PolarHBondContact O-N 2.85Å; I264-G266 PolarHBondContact O-N 3.32Å; I264-V267 HydrophobicContact CB-CB 4.45Å; I264-V267 HydrophobicContact CG2-CB 4.12Å; I264-V267 HydrophobicContact CG2-CG2 4.35Å; I264-V267 CarbonylContact O-C 3.56Å; I264-V267 PolarHBondContact O-N 2.93Å; I264-V267 VanDerWaalsContact O-N 3.16Å
265E39.3Very low50Low157 Ų15797.1 Ų97.173%0.73454%0.543SS*.THydrogen-bonded Turntrans-57.2120.6175.5-142.9174.9-171.300109.5P263P263-E265 PolarHBondContact O-N 2.99Å; P263-E265 VanDerWaalsContact O-N 3.15Å
266G51.9Low51.6Low84 Ų84100.7 Ų100.787%0.86655%0.548SS*.THydrogen-bonded Turntrans98-22.6-178.200000116.5I264I264-G266 PolarHBondContact O-N 3.32Å
267V48.9Very low54.2Low70 Ų7097.8 Ų97.842%0.42454%0.537SS..SBendtrans-110.590.3165.2-179.70000105.4I264 A269I264-V267 HydrophobicContact CB-CB 4.45Å; I264-V267 HydrophobicContact CG2-CB 4.12Å; I264-V267 HydrophobicContact CG2-CG2 4.35Å; I264-V267 CarbonylContact O-C 3.56Å; I264-V267 PolarHBondContact O-N 2.93Å; I264-V267 VanDerWaalsContact O-N 3.16Å; V267-A269 PolarHBondContact O-N 2.9Å
268G45.7Very low56.2Low36 Ų36103.1 Ų103.137%0.37156%0.557SS.*  trans-47.2135.7-169.800000111.1L270 D271G268-L270 PolarHBondContact O-N 3.4Å; G268-D271 PolarHBondContact O-N 2.87Å
269A54.6Low58.5Low54 Ų5499.6 Ų99.645%0.44655%0.551SS.*Hα-helixtrans-45.2-28.5173.700000112.7P263 V267 D271 E273P263-A269 HydrophobicContact CB-CB 4.03Å; P263-A269 HydrophobicContact CG-CB 4.11Å; V267-A269 PolarHBondContact O-N 2.9Å; A269-D271 PolarHBondContact O-N 2.94Å; A269-E273 VanDerWaalsContact O-CB 3.27Å; A269-E273 WeakPolarHBondContact O-CB 3.48Å; A269-E273 PolarHBondContact O-N 2.94Å
270L59.5Low61.3Low127 Ų12796.9 Ų96.967%0.66554%0.542SS*.Hα-helixtrans-57-40.4173.5-70.6165.3000114G268 R274G268-L270 PolarHBondContact O-N 3.4Å; L270-R274 VanDerWaalsContact O-CB 3.25Å; L270-R274 WeakPolarHBondContact O-CB 3.15Å; L270-R274 WeakPolarHBondContact O-CD 3.34Å; L270-R274 WeakPolarHBondContact O-CG 3.3Å; L270-R274 PolarHBondContact O-N 3.48Å
271D64.2Low63.8Low67 Ų67101.3 Ų101.336%0.35856%0.557SS.*Hα-helixtrans-77.1-42.5-176.7-70.5-30.1000111.6G268 A269 E273 R274 Y275G268-D271 PolarHBondContact O-N 2.87Å; A269-D271 PolarHBondContact O-N 2.94Å; D271-E273 VanDerWaalsContact C-N 3.3Å; D271-E273 PolarHBondContact O-N 3.36Å; D271-R274 WeakPolarHBondContact O-CB 3.32Å; D271-R274 PolarHBondContact O-N 3.02Å; D271-R274 IonicContact OD1-NH1 3.52Å; D271-Y275 WeakPolarHBondContact O-CD2 3.29Å; D271-Y275 PolarHBondContact O-N 3.38Å
272A62.6Low66.2Low64 Ų6499.6 Ų99.653%0.52953%0.533SS..Hα-helixtrans-59.6-43.5173.600000111.3Y275 R276A272-Y275 PolarHBondContact O-N 2.86Å; A272-R276 WeakPolarHBondContact O-CB 3.24Å; A272-R276 PolarHBondContact O-N 2.92Å
273E76.8Confident68.7Low75 Ų75100 Ų10035%0.3553%0.531SS..Hα-helixtrans-68-37.6175.7-173.557.2-154.100111.6A269 D271 Y275 R276 Q277A269-E273 VanDerWaalsContact O-CB 3.27Å; A269-E273 WeakPolarHBondContact O-CB 3.48Å; A269-E273 PolarHBondContact O-N 2.94Å; D271-E273 VanDerWaalsContact C-N 3.3Å; D271-E273 PolarHBondContact O-N 3.36Å; E273-Y275 PolarHBondContact O-N 3.05Å; E273-R276 PolarHBondContact O-N 2.88Å; E273-R276 IonicContact OE2-NH1 2.87Å; E273-Q277 HydrophobicContact CG-CG 4.35Å; E273-Q277 WeakPolarHBondContact O-CB 3.31Å; E273-Q277 VanDerWaalsContact O-CG 3.23Å; E273-Q277 WeakPolarHBondContact O-CG 3.26Å; E273-Q277 PolarHBondContact O-N 3.12Å; E273-Q277 WeakPolarHBondContact OE1-CG 3.28Å; E273-Q277 PolarHBondContact OE1-NE2 2.96Å
274R76.7Confident71.4Confident160 Ų160100.2 Ų100.260%0.60453%0.528SS*.Hα-helixtrans-59.9-44.2171.9-81.6166.7176.1-170.1-3112.1L270 D271 Q277 K278L270-R274 VanDerWaalsContact O-CB 3.25Å; L270-R274 WeakPolarHBondContact O-CB 3.15Å; L270-R274 WeakPolarHBondContact O-CD 3.34Å; L270-R274 WeakPolarHBondContact O-CG 3.3Å; L270-R274 PolarHBondContact O-N 3.48Å; D271-R274 WeakPolarHBondContact O-CB 3.32Å; D271-R274 PolarHBondContact O-N 3.02Å; D271-R274 IonicContact OD1-NH1 3.52Å; R274-Q277 PolarHBondContact O-N 2.75Å; R274-K278 VanDerWaalsContact O-CB 3.26Å; R274-K278 WeakPolarHBondContact O-CB 3.36Å; R274-K278 PolarHBondContact O-N 3.13Å
275Y73Confident73.6Confident178 Ų178102.2 Ų102.270%0.69854%0.536SS*.Hα-helixtrans-64.1-42.9176-84.7-74.7000111.5D271 A272 E273 K278 A279D271-Y275 WeakPolarHBondContact O-CD2 3.29Å; D271-Y275 PolarHBondContact O-N 3.38Å; A272-Y275 PolarHBondContact O-N 2.86Å; E273-Y275 PolarHBondContact O-N 3.05Å; Y275-K278 PolarHBondContact O-N 2.96Å; Y275-A279 WeakPolarHBondContact O-CB 3.34Å; Y275-A279 PolarHBondContact O-N 3.33Å
276R78.8Confident76.1Confident159 Ų159102.1 Ų102.160%0.653%0.529SS*.Hα-helixtrans-61.3-47.7176.1-171.4-174.9-177.5-169.71.6111.7A272 E273 K278 A279 I280A272-R276 WeakPolarHBondContact O-CB 3.24Å; A272-R276 PolarHBondContact O-N 2.92Å; E273-R276 PolarHBondContact O-N 2.88Å; E273-R276 IonicContact OE2-NH1 2.87Å; R276-K278 PolarHBondContact O-N 2.8Å; R276-A279 PolarHBondContact O-N 3.39Å; R276-I280 HydrophobicContact CG-CD1 4.03Å; R276-I280 WeakPolarHBondContact O-CG1 3.29Å; R276-I280 PolarHBondContact O-N 3.25Å
277Q87Confident78Confident109 Ų109101.9 Ų101.951%0.50951%0.507SS..Hα-helixtrans-64-40.1177.9-72.7177.15.300111.8E273 R274 I280 K281E273-Q277 HydrophobicContact CG-CG 4.35Å; E273-Q277 WeakPolarHBondContact O-CB 3.31Å; E273-Q277 VanDerWaalsContact O-CG 3.23Å; E273-Q277 WeakPolarHBondContact O-CG 3.26Å; E273-Q277 PolarHBondContact O-N 3.12Å; E273-Q277 WeakPolarHBondContact OE1-CG 3.28Å; E273-Q277 PolarHBondContact OE1-NE2 2.96Å; R274-Q277 PolarHBondContact O-N 2.75Å; Q277-I280 PolarHBondContact O-N 3.17Å; Q277-K281 VanDerWaalsContact O-CB 3.26Å; Q277-K281 WeakPolarHBondContact O-CB 3.43Å; Q277-K281 PolarHBondContact O-N 3.24Å
278K87Confident80Confident154 Ų154101.2 Ų101.267%0.6751%0.509SS*.Hα-helixtrans-62.7-42.5175-171.1177.2-177.3-1790111.7R274 Y275 R276 K281 D282R274-K278 VanDerWaalsContact O-CB 3.26Å; R274-K278 WeakPolarHBondContact O-CB 3.36Å; R274-K278 PolarHBondContact O-N 3.13Å; Y275-K278 PolarHBondContact O-N 2.96Å; R276-K278 PolarHBondContact O-N 2.8Å; K278-K281 PolarHBondContact O-N 2.93Å; K278-D282 WeakPolarHBondContact O-CB 3.32Å; K278-D282 PolarHBondContact O-N 3.31Å
279A85Confident82.2Confident62 Ų62105.7 Ų105.751%0.51252%0.518SS..Hα-helixtrans-65.2-44.2177.200000112.2Y275 R276 K281 D282 L283Y275-A279 WeakPolarHBondContact O-CB 3.34Å; Y275-A279 PolarHBondContact O-N 3.33Å; R276-A279 PolarHBondContact O-N 3.39Å; A279-K281 VanDerWaalsContact C-N 3.34Å; A279-K281 PolarHBondContact O-N 3.01Å; A279-D282 PolarHBondContact O-N 2.96Å; A279-L283 WeakPolarHBondContact O-CB 3.46Å; A279-L283 PolarHBondContact O-N 3.29Å
280I90.6Very high83.9Confident84 Ų84107.6 Ų107.643%0.43153%0.525SS..Hα-helixtrans-64.6-39.8176.5-67.2168000110.9R276 Q277 L283 N284R276-I280 HydrophobicContact CG-CD1 4.03Å; R276-I280 WeakPolarHBondContact O-CG1 3.29Å; R276-I280 PolarHBondContact O-N 3.25Å; Q277-I280 PolarHBondContact O-N 3.17Å; I280-L283 PolarHBondContact O-N 3.4Å; I280-N284 WeakPolarHBondContact O-CB 3.43Å; I280-N284 PolarHBondContact O-N 3.43Å
281K92.4Very high85.4Confident149 Ų149109.5 Ų109.565%0.64852%0.523SS*.Hα-helixtrans-64.9-47177-173.7178.3177.3-178.80111.9Q277 K278 A279 L283 N284 E285Q277-K281 VanDerWaalsContact O-CB 3.26Å; Q277-K281 WeakPolarHBondContact O-CB 3.43Å; Q277-K281 PolarHBondContact O-N 3.24Å; K278-K281 PolarHBondContact O-N 2.93Å; A279-K281 VanDerWaalsContact C-N 3.34Å; A279-K281 PolarHBondContact O-N 3.01Å; K281-L283 VanDerWaalsContact C-N 3.29Å; K281-L283 PolarHBondContact O-N 2.52Å; K281-N284 PolarHBondContact O-N 3.34Å; K281-E285 WeakPolarHBondContact O-CB 3.46Å; K281-E285 PolarHBondContact O-N 2.99Å
282D93Very high86.5Confident70 Ų70108.7 Ų108.737%0.37453%0.525SS..Hα-helixtrans-60.9-40.3176.5-17059.5000111.1K278 A279 E285 R286K278-D282 WeakPolarHBondContact O-CB 3.32Å; K278-D282 PolarHBondContact O-N 3.31Å; A279-D282 PolarHBondContact O-N 2.96Å; D282-E285 PolarHBondContact O-N 2.96Å; D282-R286 WeakPolarHBondContact O-CB 3.45Å; D282-R286 VanDerWaalsContact O-CG 3.27Å; D282-R286 WeakPolarHBondContact O-CG 3.48Å; D282-R286 PolarHBondContact O-N 3.08Å; D282-R286 IonicContact OD1-NE 3.04Å; D282-R286 IonicContact OD2-CZ 3.79Å; D282-R286 VanDerWaalsContact OD2-CZ 3.3Å; D282-R286 IonicContact OD2-NE 3.3Å; D282-R286 PolarHBondContact OD2-NE 3.11Å; D282-R286 IonicContact OD2-NH2 3.89Å; D282-R286 PolarHBondContact OD2-NH2 3.5Å
283L91.7Very high87.7Confident102 Ų102108.6 Ų108.653%0.53453%0.525SS..Hα-helixtrans-63.2-47.4175.7-168.279.1000111.9A279 I280 K281 E285 R286 L287A279-L283 WeakPolarHBondContact O-CB 3.46Å; A279-L283 PolarHBondContact O-N 3.29Å; I280-L283 PolarHBondContact O-N 3.4Å; K281-L283 VanDerWaalsContact C-N 3.29Å; K281-L283 PolarHBondContact O-N 2.52Å; L283-E285 VanDerWaalsContact C-N 3.31Å; L283-E285 PolarHBondContact O-N 3.32Å; L283-R286 PolarHBondContact O-N 3.46Å; L283-L287 HydrophobicContact CD2-CD1 4.49Å; L283-L287 HydrophobicContact CG-CD1 4.24Å; L283-L287 WeakPolarHBondContact O-CB 3.26Å; L283-L287 WeakPolarHBondContact O-CG 3.01Å; L283-L287 PolarHBondContact O-N 2.98Å
284N94Very high88Confident94 Ų94107.6 Ų107.650%0.50353%0.526SS..Hα-helixtrans-63.9-37.9178.6-78.1-20.2000111.9I280 K281 L287 A288I280-N284 WeakPolarHBondContact O-CB 3.43Å; I280-N284 PolarHBondContact O-N 3.43Å; K281-N284 PolarHBondContact O-N 3.34Å; N284-L287 PolarHBondContact O-N 3.02Å; N284-A288 VanDerWaalsContact O-CB 3.3Å; N284-A288 WeakPolarHBondContact O-CB 3.11Å; N284-A288 PolarHBondContact O-N 3.16Å
285E93.1Very high88.5Confident91 Ų91106 Ų10643%0.42553%0.526SS..Hα-helixtrans-65.9-42.5175.6-169-178.1153.200111.6K281 D282 L283 A288 K289K281-E285 WeakPolarHBondContact O-CB 3.46Å; K281-E285 PolarHBondContact O-N 2.99Å; D282-E285 PolarHBondContact O-N 2.96Å; L283-E285 VanDerWaalsContact C-N 3.31Å; L283-E285 PolarHBondContact O-N 3.32Å; E285-A288 PolarHBondContact O-N 3.17Å; E285-K289 WeakPolarHBondContact O-CG 3.28Å; E285-K289 PolarHBondContact O-N 3.45Å; E285-K289 VanDerWaalsContact OE1-CE 3.27Å; E285-K289 WeakPolarHBondContact OE1-CE 3.42Å; E285-K289 IonicContact OE1-NZ 2.68Å; E285-K289 PolarHBondContact OE1-NZ 3.18Å
286R92.4Very high89Confident156 Ų156101.6 Ų101.659%0.58952%0.517SS*.Hα-helixtrans-62.3-46.5173.7-72.4173.8-172.3-139.83.4111.6D282 L283 A288 K289 T290D282-R286 WeakPolarHBondContact O-CB 3.45Å; D282-R286 VanDerWaalsContact O-CG 3.27Å; D282-R286 WeakPolarHBondContact O-CG 3.48Å; D282-R286 PolarHBondContact O-N 3.08Å; D282-R286 IonicContact OD1-NE 3.04Å; D282-R286 IonicContact OD2-CZ 3.79Å; D282-R286 VanDerWaalsContact OD2-CZ 3.3Å; D282-R286 IonicContact OD2-NE 3.3Å; D282-R286 PolarHBondContact OD2-NE 3.11Å; D282-R286 IonicContact OD2-NH2 3.89Å; D282-R286 PolarHBondContact OD2-NH2 3.5Å; L283-R286 PolarHBondContact O-N 3.46Å; R286-A288 VanDerWaalsContact C-N 3.31Å; R286-A288 PolarHBondContact O-N 3.14Å; R286-K289 PolarHBondContact O-N 3.44Å; R286-T290 WeakPolarHBondContact O-CB 3.49Å; R286-T290 PolarHBondContact O-N 2.86Å; R286-T290 PolarHBondContact O-OG1 3.11Å
287L90.6Very high89.1Confident78 Ų78103 Ų10341%0.40852%0.522SS..Hα-helixtrans-62.2-39.3177.5-72.9174.1000111.7L283 N284 T290 R291L283-L287 HydrophobicContact CD2-CD1 4.49Å; L283-L287 HydrophobicContact CG-CD1 4.24Å; L283-L287 WeakPolarHBondContact O-CB 3.26Å; L283-L287 WeakPolarHBondContact O-CG 3.01Å; L283-L287 PolarHBondContact O-N 2.98Å; N284-L287 PolarHBondContact O-N 3.02Å; L287-T290 PolarHBondContact O-N 2.93Å; L287-R291 WeakPolarHBondContact O-CB 3.29Å; L287-R291 VanDerWaalsContact O-CG 3.27Å; L287-R291 WeakPolarHBondContact O-CG 3.49Å; L287-R291 PolarHBondContact O-N 3.23Å
288A90.7Very high88.9Confident57 Ų57102.7 Ų102.747%0.47152%0.524SS..Hα-helixtrans-65.1-44.7175.100000111.8N284 E285 R286 T290 R291 A292N284-A288 VanDerWaalsContact O-CB 3.3Å; N284-A288 WeakPolarHBondContact O-CB 3.11Å; N284-A288 PolarHBondContact O-N 3.16Å; E285-A288 PolarHBondContact O-N 3.17Å; R286-A288 VanDerWaalsContact C-N 3.31Å; R286-A288 PolarHBondContact O-N 3.14Å; A288-T290 PolarHBondContact O-N 2.87Å; A288-R291 PolarHBondContact O-N 3.25Å; A288-A292 WeakPolarHBondContact O-CB 3.49Å; A288-A292 PolarHBondContact O-N 3.47Å
289K92.1Very high88.6Confident129 Ų12998.2 Ų98.256%0.56152%0.515SS*.Hα-helixtrans-60.9-42.5174.4-74.4175.1-174.2167.80111.8E285 R286 A292 A293E285-K289 WeakPolarHBondContact O-CG 3.28Å; E285-K289 PolarHBondContact O-N 3.45Å; E285-K289 VanDerWaalsContact OE1-CE 3.27Å; E285-K289 WeakPolarHBondContact OE1-CE 3.42Å; E285-K289 IonicContact OE1-NZ 2.68Å; E285-K289 PolarHBondContact OE1-NZ 3.18Å; R286-K289 PolarHBondContact O-N 3.44Å; K289-A292 PolarHBondContact O-N 3.31Å; K289-A293 WeakPolarHBondContact O-CB 3.4Å; K289-A293 PolarHBondContact O-N 2.98Å
290T91.3Very high88.3Confident94 Ų94101.1 Ų101.158%0.57752%0.518SS*.Hα-helixtrans-65.3-41.4176.4-57.20000111.8R286 L287 A288 A293 S294R286-T290 WeakPolarHBondContact O-CB 3.49Å; R286-T290 PolarHBondContact O-N 2.86Å; R286-T290 PolarHBondContact O-OG1 3.11Å; L287-T290 PolarHBondContact O-N 2.93Å; A288-T290 PolarHBondContact O-N 2.87Å; T290-A293 PolarHBondContact O-N 2.86Å; T290-S294 WeakPolarHBondContact O-CB 3.47Å; T290-S294 PolarHBondContact O-N 2.97Å
291R90.3Very high87.5Confident168 Ų16899.4 Ų99.463%0.63452%0.517SS*.Hα-helixtrans-62.8-48.7174.9-75.9176.6-174.41792.4111.4L287 A288 A293 S294 E295L287-R291 WeakPolarHBondContact O-CB 3.29Å; L287-R291 VanDerWaalsContact O-CG 3.27Å; L287-R291 WeakPolarHBondContact O-CG 3.49Å; L287-R291 PolarHBondContact O-N 3.23Å; A288-R291 PolarHBondContact O-N 3.25Å; R291-A293 VanDerWaalsContact C-N 3.34Å; R291-A293 PolarHBondContact O-N 3.4Å; R291-S294 WeakPolarHBondContact CA-OG 3.37Å; R291-S294 PolarHBondContact O-N 2.94Å; R291-S294 VanDerWaalsContact O-N 3.07Å; R291-S294 PolarHBondContact O-OG 3.24Å; R291-E295 WeakPolarHBondContact O-CG 3.45Å; R291-E295 PolarHBondContact O-N 3.37Å
292A88Confident86.7Confident49 Ų4996 Ų9641%0.40551%0.508SS..Hα-helixtrans-59.7-42.7176.800000112.2A288 K289 S294 E295 V296A288-A292 WeakPolarHBondContact O-CB 3.49Å; A288-A292 PolarHBondContact O-N 3.47Å; K289-A292 PolarHBondContact O-N 3.31Å; A292-S294 VanDerWaalsContact C-N 3.32Å; A292-S294 PolarHBondContact O-N 2.67Å; A292-E295 PolarHBondContact O-N 3.36Å; A292-V296 WeakPolarHBondContact O-CG2 3.2Å; A292-V296 PolarHBondContact O-N 3.33Å
293A86.5Confident85.7Confident63 Ų6397.1 Ų97.152%0.52152%0.518SS..Hα-helixtrans-62.2-38.8174.600000112.2K289 T290 R291 R297K289-A293 WeakPolarHBondContact O-CB 3.4Å; K289-A293 PolarHBondContact O-N 2.98Å; T290-A293 PolarHBondContact O-N 2.86Å; R291-A293 VanDerWaalsContact C-N 3.34Å; R291-A293 PolarHBondContact O-N 3.4Å; A293-R297 WeakPolarHBondContact O-CB 3.44Å; A293-R297 PolarHBondContact O-N 3.46Å; A293-R297 VanDerWaalsContact O-N 3.08Å
294S83.8Confident84Confident53 Ų5399.1 Ų99.137%0.37152%0.524SS..Hα-helixtrans-67.9-37.4175.9750000112.8T290 R291 A292 R297 N298T290-S294 WeakPolarHBondContact O-CB 3.47Å; T290-S294 PolarHBondContact O-N 2.97Å; R291-S294 WeakPolarHBondContact CA-OG 3.37Å; R291-S294 PolarHBondContact O-N 2.94Å; R291-S294 VanDerWaalsContact O-N 3.07Å; R291-S294 PolarHBondContact O-OG 3.24Å; A292-S294 VanDerWaalsContact C-N 3.32Å; A292-S294 PolarHBondContact O-N 2.67Å; S294-R297 PolarHBondContact O-N 2.9Å; S294-N298 WeakPolarHBondContact O-CB 3.41Å; S294-N298 PolarHBondContact O-N 3.3Å; S294-N298 PolarHBondContact O-ND2 3.34Å; S294-N298 PolarHBondContact O-OD1 2.9Å
295E86.6Confident82.2Confident128 Ų128101.5 Ų101.560%0.59853%0.532SS*.Hα-helixtrans-66.5-45177.3-73.7171.1-172.200111.7R291 A292 R297 N298 A299R291-E295 WeakPolarHBondContact O-CG 3.45Å; R291-E295 PolarHBondContact O-N 3.37Å; A292-E295 PolarHBondContact O-N 3.36Å; E295-R297 VanDerWaalsContact C-N 3.34Å; E295-R297 PolarHBondContact O-N 3.46Å; E295-N298 PolarHBondContact O-N 3.44Å; E295-A299 WeakPolarHBondContact O-CB 3.37Å; E295-A299 PolarHBondContact O-N 3.24Å
296V83.5Confident80.5Confident84 Ų84104.9 Ų104.951%0.50955%0.545SS..Hα-helixtrans-61.4-43.6175.31740000110.8A292 N298 A299 Q300A292-V296 WeakPolarHBondContact O-CG2 3.2Å; A292-V296 PolarHBondContact O-N 3.33Å; V296-N298 PolarHBondContact O-N 2.79Å; V296-A299 PolarHBondContact O-N 2.95Å; V296-Q300 WeakPolarHBondContact O-CG 3.23Å; V296-Q300 PolarHBondContact O-N 2.85Å
297R81.6Confident78.6Confident190 Ų190102.5 Ų102.572%0.71755%0.548SS*.Hα-helixtrans-63.3-41.8177.5-171.4178.6-179.1-179.60.3111.9A293 S294 E295 Q300 A301A293-R297 WeakPolarHBondContact O-CB 3.44Å; A293-R297 PolarHBondContact O-N 3.46Å; A293-R297 VanDerWaalsContact O-N 3.08Å; S294-R297 PolarHBondContact O-N 2.9Å; E295-R297 VanDerWaalsContact C-N 3.34Å; E295-R297 PolarHBondContact O-N 3.46Å; R297-Q300 PolarHBondContact O-N 3.45Å; R297-A301 WeakPolarHBondContact O-CB 3.45Å; R297-A301 PolarHBondContact O-N 3.48Å
298N83.7Confident76.6Confident102 Ų102103.6 Ų103.655%0.54556%0.563SS.*Hα-helixtrans-67-41.6177.4-70.7-15.3000111.6S294 E295 V296 Q300 A301 V302S294-N298 WeakPolarHBondContact O-CB 3.41Å; S294-N298 PolarHBondContact O-N 3.3Å; S294-N298 PolarHBondContact O-ND2 3.34Å; S294-N298 PolarHBondContact O-OD1 2.9Å; E295-N298 PolarHBondContact O-N 3.44Å; V296-N298 PolarHBondContact O-N 2.79Å; N298-Q300 PolarHBondContact O-N 3.04Å; N298-A301 PolarHBondContact O-N 3.48Å; N298-V302 WeakPolarHBondContact O-CG2 3.42Å; N298-V302 PolarHBondContact O-N 3.03Å
299A80.5Confident74Confident59 Ų59108.9 Ų108.949%0.48858%0.577SS.*Hα-helixtrans-61.7-43.1175.300000111.8E295 V296 V302 V303E295-A299 WeakPolarHBondContact O-CB 3.37Å; E295-A299 PolarHBondContact O-N 3.24Å; V296-A299 PolarHBondContact O-N 2.95Å; A299-V302 PolarHBondContact O-N 3.47Å; A299-V303 WeakPolarHBondContact O-CG2 3.36Å; A299-V303 PolarHBondContact O-N 3.35Å; A299-V303 VanDerWaalsContact O-N 3.09Å
300Q77.7Confident71.3Confident124 Ų124107.8 Ų107.858%0.57959%0.586SS**Hα-helixtrans-63.3-42.1175.1-75176.7-19.300112.3V296 R297 N298 V302 V303 Q304V296-Q300 WeakPolarHBondContact O-CG 3.23Å; V296-Q300 PolarHBondContact O-N 2.85Å; R297-Q300 PolarHBondContact O-N 3.45Å; N298-Q300 PolarHBondContact O-N 3.04Å; Q300-V302 PolarHBondContact O-N 3.15Å; Q300-V303 PolarHBondContact O-N 2.96Å; Q300-Q304 PolarHBondContact O-N 3.22Å
301A74.3Confident69Low48 Ų48108.8 Ų108.840%0.39759%0.594SS.*Hα-helixtrans-62.8-40.2177.300000112.5R297 N298 Q304 Q305R297-A301 WeakPolarHBondContact O-CB 3.45Å; R297-A301 PolarHBondContact O-N 3.48Å; N298-A301 PolarHBondContact O-N 3.48Å; A301-Q304 PolarHBondContact O-N 3.04Å; A301-Q305 PolarHBondContact O-N 3.2Å
302V75.8Confident66.2Low77 Ų77110.6 Ų110.647%0.46761%0.607SS.*Hα-helixtrans-65.8-39.1176.2172.90000111.5N298 A299 Q300 Q305 K306N298-V302 WeakPolarHBondContact O-CG2 3.42Å; N298-V302 PolarHBondContact O-N 3.03Å; A299-V302 PolarHBondContact O-N 3.47Å; Q300-V302 PolarHBondContact O-N 3.15Å; V302-Q305 PolarHBondContact O-N 3.14Å; V302-K306 PolarHBondContact O-N 2.96Å; V302-K306 VanDerWaalsContact O-N 3.13Å
303V70.7Confident63.6Low94 Ų94116.6 Ų116.657%0.5763%0.626SS**Hα-helixtrans-66.9-40.7176.2173.70000111.2A299 Q300 K306 T307A299-V303 WeakPolarHBondContact O-CG2 3.36Å; A299-V303 PolarHBondContact O-N 3.35Å; A299-V303 VanDerWaalsContact O-N 3.09Å; Q300-V303 PolarHBondContact O-N 2.96Å; V303-K306 PolarHBondContact O-N 3.12Å; V303-T307 PolarHBondContact O-N 2.59Å; V303-T307 VanDerWaalsContact O-N 3.11Å; V303-T307 PolarHBondContact O-OG1 2.96Å
304Q57.8Low61.1Low143 Ų143119 Ų11967%0.66864%0.636SS**Hα-helixtrans-65.3-40.5176.6-116.7167.6-10.300112.1Q300 A301 K306 T307 S308Q300-Q304 PolarHBondContact O-N 3.22Å; A301-Q304 PolarHBondContact O-N 3.04Å; Q304-K306 PolarHBondContact O-N 2.87Å; Q304-T307 PolarHBondContact O-N 3.27Å; Q304-S308 PolarHBondContact O-N 3.26Å; Q304-S308 PolarHBondContact O-OG 3.22Å; Q304-S308 VanDerWaalsContact O-OG 3.07Å
305Q55.3Low58.6Low144 Ų144125.3 Ų125.367%0.67366%0.66SS**Hα-helixtrans-62.9-39.4174.4-92.7-176.7-26.900113.1A301 V302 T307 S308A301-Q305 PolarHBondContact O-N 3.2Å; V302-Q305 PolarHBondContact O-N 3.14Å; Q305-T307 VanDerWaalsContact C-N 3.3Å; Q305-T307 PolarHBondContact O-N 3.07Å; Q305-S308 PolarHBondContact O-N 3.47Å
306K56.6Low55.9Low163 Ų163127 Ų12771%0.70967%0.672SS**Hα-helixtrans-67.3-29.8176.3-79.5-177.2176-178.80113.2V302 V303 Q304V302-K306 PolarHBondContact O-N 2.96Å; V302-K306 VanDerWaalsContact O-N 3.13Å; V303-K306 PolarHBondContact O-N 3.12Å; Q304-K306 PolarHBondContact O-N 2.87Å
307T52.8Low53.8Low105 Ų105128 Ų12864%0.64468%0.681SS**Hα-helixtrans-79-27.1-179.5-42.50000112V303 Q304 Q305 Q309V303-T307 PolarHBondContact O-N 2.59Å; V303-T307 VanDerWaalsContact O-N 3.11Å; V303-T307 PolarHBondContact O-OG1 2.96Å; Q304-T307 PolarHBondContact O-N 3.27Å; Q305-T307 VanDerWaalsContact C-N 3.3Å; Q305-T307 PolarHBondContact O-N 3.07Å; T307-Q309 VanDerWaalsContact C-N 3.34Å
308S48.5Very low51.9Low102 Ų102128 Ų12871%0.71369%0.689SS**Hα-helixtrans-81.1-10.9177.5-50.80000114.3Q304 Q305Q304-S308 PolarHBondContact O-N 3.26Å; Q304-S308 PolarHBondContact O-OG 3.22Å; Q304-S308 VanDerWaalsContact O-OG 3.07Å; Q305-S308 PolarHBondContact O-N 3.47Å
309Q36.3Very low49.9Very low167 Ų167128.2 Ų128.278%0.7870%0.698SS**  trans-113.859.7174.8-69-174.4-900110.1T307T307-Q309 VanDerWaalsContact C-N 3.34Å
310S36.3Very low48Very low107 Ų107132.2 Ų132.275%0.74871%0.711SS**  trans-80.3125.2163.9-167.90000109.3
311P42Very low46.6Very low114 Ų114129.7 Ų129.774%0.7471%0.707SS**  trans-75.5152.6-174.33.311.2000112.3H313P311-H313 PolarHBondContact O-N 3.42Å
312K32.6Very low45.2Very low206 Ų206133.6 Ų133.690%0.89672%0.721SS**  trans-45.3123.8175.3-75.9175.2173178.70112.1
313H32.8Very low43.9Very low175 Ų175133 Ų13381%0.8173%0.725SS**PPolyproline II helixtrans-56.3130.4172.9-135.6-63.5000111.7P311P311-H313 PolarHBondContact O-N 3.42Å
314P35Very low43Very low114 Ų114132.5 Ų132.574%0.7473%0.725SS**PPolyproline II helixtrans-90.5140.6147.30.219.2000109.4
315E29.8Very low42.7Very low185 Ų185128.1 Ų128.186%0.86471%0.713SS**PPolyproline II helixtrans-63.2135178.4-69.6161.9127.600112.6
316L31.2Very low42.4Very low163 Ų163131.2 Ų131.285%0.85372%0.719SS**  trans-159.5157.2152.7-129.193.2000108.2
317P38.3Very low42.1Very low107 Ų107129.7 Ų129.770%0.69572%0.718SS**  -101.3160.7-116.97.615.1000114.3S319P317-S319 VanDerWaalsContact C-N 3.35Å; P317-S319 PolarHBondContact O-N 2.68Å
318E42.1Very low42Very low189 Ų189126.4 Ų126.488%0.88371%0.705SS**SBendtrans-77.943.4-155.2-148.5173.8-164.100116.3
319S41.8Very low42.2Very low107 Ų107130.2 Ų130.275%0.74870%0.703SS**SBendtrans-121.59.7-177.761.50000117P317P317-S319 VanDerWaalsContact C-N 3.35Å; P317-S319 PolarHBondContact O-N 2.68Å
320L39.6Very low43.2Very low142 Ų142126.1 Ų126.174%0.74369%0.693SS**SBendtrans-126.69.8176.4-75.2166.9000114.8D322L320-D322 VanDerWaalsContact C-N 3.34Å; L320-D322 PolarHBondContact O-N 3.35Å
321S48.6Very low44.2Very low72 Ų72124.8 Ų124.850%0.50368%0.681SS.*Hα-helixtrans-68.2-26.1-177.355.80000114.3
322D45.7Very low44.9Very low129 Ų129124.7 Ų124.769%0.6967%0.674SS**Hα-helixtrans-82.9-21.5-175.6-79-19.3000114.4L320L320-D322 VanDerWaalsContact C-N 3.34Å; L320-D322 PolarHBondContact O-N 3.35Å
323A48.6Very low46Very low66 Ų66120.6 Ų120.655%0.54566%0.658SS.*Hα-helixtrans-79.6-39.4-179.900000112.3R326 L327A323-R326 PolarHBondContact O-N 3.07Å; A323-L327 PolarHBondContact O-N 2.69Å
324S51.1Low47.5Very low83 Ų83114.9 Ų114.958%0.5864%0.641SS**Hα-helixtrans-74.7-32.5-179.168.60000112.6R326 L327 G328S324-R326 VanDerWaalsContact C-N 3.28Å; S324-R326 PolarHBondContact O-N 2.85Å; S324-L327 PolarHBondContact O-N 2.62Å; S324-G328 PolarHBondContact O-N 2.57Å
325A51.8Low48.8Very low51 Ų51114.9 Ų114.942%0.42163%0.634SS.*Hα-helixtrans-64.3-31.7175.700000112.7
326R48.2Very low50.5Low208 Ų208110.7 Ų110.779%0.78562%0.617SS**Hα-helixtrans-76-36.1175.4-72.5-174.6-178.9-1571.5112.5A323 S324A323-R326 PolarHBondContact O-N 3.07Å; S324-R326 VanDerWaalsContact C-N 3.28Å; S324-R326 PolarHBondContact O-N 2.85Å
327L51.1Low52.1Low132 Ų132107.8 Ų107.869%0.69160%0.603SS**Hα-helixtrans-71-39.6178.6-127.6100.3000112.4A323 S324 R329 S330 T331A323-L327 PolarHBondContact O-N 2.69Å; S324-L327 PolarHBondContact O-N 2.62Å; L327-R329 PolarHBondContact O-N 3.44Å; L327-S330 PolarHBondContact O-N 3.35Å; L327-T331 PolarHBondContact O-N 3.46Å; L327-T331 PolarHBondContact O-OG1 2.97Å
328G50.8Low53.3Low36 Ų36108.5 Ų108.537%0.37160%0.6SS.*Hα-helixtrans-68.4-30.7-179.900000114.2S324 T331 L332S324-G328 PolarHBondContact O-N 2.57Å; G328-T331 PolarHBondContact O-OG1 3.21Å; G328-L332 PolarHBondContact O-N 3.1Å
329R53.4Low54.4Low181 Ų181102.2 Ų102.268%0.68358%0.58SS**Hα-helixtrans-76.1-30.1178.5-149.5178.5-67.4-175.7-0.9112.3L327 H333L327-R329 PolarHBondContact O-N 3.44Å; R329-H333 PolarHBondContact O-CD2 3.35Å; R329-H333 PolarHBondContact O-N 3.29Å
330S57.5Low55.5Low81 Ų81103.7 Ų103.757%0.56657%0.573SS**Hα-helixtrans-66.8-45.8175.6174.30000112.2L327 L332 A334L327-S330 PolarHBondContact O-N 3.35Å; S330-L332 PolarHBondContact O-N 3.5Å; S330-A334 PolarHBondContact O-N 2.92Å
331T56.9Low56.6Low80 Ų80106.1 Ų106.149%0.49157%0.572SS.*Hα-helixtrans-70.6-33.3-177.951.70000112.9L327 G328 A334 N335L327-T331 PolarHBondContact O-N 3.46Å; L327-T331 PolarHBondContact O-OG1 2.97Å; G328-T331 PolarHBondContact O-OG1 3.21Å; T331-A334 PolarHBondContact O-N 3.17Å; T331-N335 PolarHBondContact O-N 3.27Å; T331-N335 PolarHBondContact O-ND2 3.09Å
332L57.4Low57.3Low112 Ų112110.9 Ų110.959%0.58658%0.584SS**Hα-helixtrans-70.7-38.5179.3-137.4153.4000111.9G328 S330 L336G328-L332 PolarHBondContact O-N 3.1Å; S330-L332 PolarHBondContact O-N 3.5Å; L332-L336 HydrophobicContact CD2-CD1 4.1Å; L332-L336 PolarHBondContact O-N 2.83Å
333H54.7Low58Low120 Ų120115 Ų11556%0.55659%0.592SS**Hα-helixtrans-69.2-34.9173.9-86.9-69.6000113.1R329 N337R329-H333 PolarHBondContact O-CD2 3.35Å; R329-H333 PolarHBondContact O-N 3.29Å; H333-N337 PolarHBondContact O-N 3.45Å; H333-N337 PolarHBondContact O-ND2 3.14Å
334A65.2Low58.4Low55 Ų55119.7 Ų119.746%0.45560%0.602SS.*Hα-helixtrans-64.1-42.8175.900000112.1S330 T331 N337 L338S330-A334 PolarHBondContact O-N 2.92Å; T331-A334 PolarHBondContact O-N 3.17Å; A334-N337 PolarHBondContact O-N 3.16Å; A334-L338 PolarHBondContact O-N 3.2Å
335N60.8Low58.5Low113 Ų113126.7 Ų126.760%0.60463%0.626SS**Hα-helixtrans-69.8-35.1-179.8-75.3-24.1000113.1T331 L338 A339T331-N335 PolarHBondContact O-N 3.27Å; T331-N335 PolarHBondContact O-ND2 3.09Å; N335-L338 PolarHBondContact O-N 2.74Å; N335-A339 PolarHBondContact O-N 3.08Å
336L65.7Low58.8Low98 Ų98130.5 Ų130.551%0.51364%0.636SS.*Hα-helixtrans-67.7-36.4176.5-111.9151.3000112.5L332 A339 K340L332-L336 HydrophobicContact CD2-CD1 4.1Å; L332-L336 PolarHBondContact O-N 2.83Å; L336-A339 PolarHBondContact O-N 3.5Å; L336-K340 PolarHBondContact O-N 3.05Å
337N64.4Low59.4Low102 Ų102126.4 Ų126.455%0.54563%0.628SS.*Hα-helixtrans-70.9-34.8176.3-73.3-19.6000112.5H333 A334 K340 R341H333-N337 PolarHBondContact O-N 3.45Å; H333-N337 PolarHBondContact O-ND2 3.14Å; A334-N337 PolarHBondContact O-N 3.16Å; N337-K340 PolarHBondContact O-N 3.08Å; N337-R341 PolarHBondContact O-N 3.37Å; N337-R341 VanDerWaalsContact O-N 3.11Å
338L64.7Low59.9Low121 Ų121126.1 Ų126.163%0.63463%0.625SS**Hα-helixtrans-67.9-39.3173.7-116.6158.3000111.8A334 N335 K342A334-L338 PolarHBondContact O-N 3.2Å; N335-L338 PolarHBondContact O-N 2.74Å; L338-K342 PolarHBondContact O-N 2.81Å
339A65.4Low60.4Low57 Ų57131.4 Ų131.447%0.47164%0.64SS.*Hα-helixtrans-66.8-36.8175.100000112.6N335 L336N335-A339 PolarHBondContact O-N 3.08Å; L336-A339 PolarHBondContact O-N 3.5Å
340K64.1Low60.8Low139 Ų139128.3 Ų128.360%0.60464%0.637SS**Hα-helixtrans-67-44.3175.8-105.4-175.5172.7-172.30113L336 N337 K342 Y343L336-K340 PolarHBondContact O-N 3.05Å; N337-K340 PolarHBondContact O-N 3.08Å; K340-K342 PolarHBondContact O-N 3.15Å; K340-Y343 PolarHBondContact O-N 3.13Å; K340-Y343 VanDerWaalsContact O-N 3.14Å
341R62.8Low61.1Low192 Ų192131.5 Ų131.573%0.72564%0.642SS**Hα-helixtrans-61.7-33.7178.2-78.3-172179.9-173-0.1113.1N337 Y343 E344N337-R341 PolarHBondContact O-N 3.37Å; N337-R341 VanDerWaalsContact O-N 3.11Å; R341-Y343 PolarHBondContact O-N 3.26Å; R341-E344 PolarHBondContact O-N 3.2Å
342K63.8Low61.4Low172 Ų172135.1 Ų135.175%0.74865%0.652SS**THydrogen-bonded Turntrans-72-7.7179.6-141-177.7-171.3-176.40114.5L338 K340L338-K342 PolarHBondContact O-N 2.81Å; K340-K342 PolarHBondContact O-N 3.15Å
343Y60.5Low61.7Low216 Ų216136.9 Ų136.985%0.84766%0.657SS**THydrogen-bonded Turntrans-107.6-7.1177.6-96.9-83.5000113.2K340 R341K340-Y343 PolarHBondContact O-N 3.13Å; K340-Y343 VanDerWaalsContact O-N 3.14Å; R341-Y343 PolarHBondContact O-N 3.26Å
344E56.9Low62.2Low164 Ų164138.3 Ų138.377%0.76667%0.666SS**THydrogen-bonded Turntrans-106.3-1.9178.5-70.117817700113.1R341R341-E344 PolarHBondContact O-N 3.2Å
345E52.8Low62Low231 Ų231145.9 Ų145.9100%1.07969%0.685SS**  trans-101.10162.8-69179.1-178.300109.8

Retrieved 345 of 345 residues in 171.9 ms (Link to these results)

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