A0A5K4F873_SCHMA Loading...

Equilibrative nucleoside transporter

AlphaFold DB , UniProt , Accession A0A5K4F873, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 559 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
1M37.9Very low53Low166 Ų166102.9 Ų102.982%0.81848%0.477SS*.  0-58.60-157.1176.5-93.300112.1R3 F4 L5M1-R3 PolarHBondContact O-N 3.3Å; M1-F4 WeakPolarHBondContact O-CA 3.26Å; M1-F4 WeakPolarHBondContact O-CB 3.37Å; M1-F4 PolarHBondContact O-N 3.2Å; M1-L5 HydrophobicContact CG-CD1 4.21Å; M1-L5 PolarHBondContact O-N 2.72Å
2L32.6Very low56.1Low110 Ų11094.3 Ų94.358%0.57644%0.437SS*.Hα-helixtrans-55-44.5178.5-161.375.2000114.5F4 L5 I6L2-F4 VanDerWaalsContact C-N 3.3Å; L2-F4 PolarHBondContact O-N 3.19Å; L2-L5 PolarHBondContact O-N 3.32Å; L2-I6 HydrophobicContact CD2-CD1 4.33Å; L2-I6 HydrophobicContact CG-CD1 3.95Å; L2-I6 WeakPolarHBondContact O-CB 3.14Å; L2-I6 VanDerWaalsContact O-CG1 3.22Å; L2-I6 WeakPolarHBondContact O-CG1 3.47Å; L2-I6 PolarHBondContact O-N 2.87Å
3R38.1Very low59Low225 Ų22591.4 Ų91.485%0.84942%0.42SS*.Hα-helixtrans-59.1-36.9173.1-91.6-174.7177.5-173.1-0.2113.4M1 L7M1-R3 PolarHBondContact O-N 3.3Å; R3-L7 WeakPolarHBondContact O-CB 3.4Å; R3-L7 PolarHBondContact O-N 3.39Å
4F42.9Very low61.5Low139 Ų13991.5 Ų91.561%0.6142%0.424SS*.Hα-helixtrans-74.2-35.4179.8-120.6-86.1000111.6M1 L2 R8M1-F4 WeakPolarHBondContact O-CA 3.26Å; M1-F4 WeakPolarHBondContact O-CB 3.37Å; M1-F4 PolarHBondContact O-N 3.2Å; L2-F4 VanDerWaalsContact C-N 3.3Å; L2-F4 PolarHBondContact O-N 3.19Å; F4-R8 WeakPolarHBondContact O-CG 3.29Å; F4-R8 PolarHBondContact O-N 3.42Å
5L37.7Very low63.7Low36 Ų3686.5 Ų86.519%0.18840%0.401CS..Hα-helixtrans-69.2-49173.3-77.9163.4000111.2M1 L2 L7 R8 Y9 D294M1-L5 HydrophobicContact CG-CD1 4.21Å; M1-L5 PolarHBondContact O-N 2.72Å; L2-L5 PolarHBondContact O-N 3.32Å; L5-L7 VanDerWaalsContact C-N 3.28Å; L5-L7 PolarHBondContact O-N 3.3Å; L5-R8 PolarHBondContact O-N 2.89Å; L5-Y9 VanDerWaalsContact C-CD2 3.42Å; L5-Y9 HydrophobicContact CB-CD2 4.39Å; L5-Y9 HydrophobicContact CB-CE2 3.87Å; L5-Y9 HydrophobicContact CD2-CE2 4.37Å; L5-Y9 WeakPolarHBondContact O-CD2 3.39Å; L5-Y9 PolarHBondContact O-N 2.93Å; L5-D294 HydrophobicContact CD1-CB 4.42Å; L5-D294 WeakPolarHBondContact CD1-O 3.49Å
6I49.4Very low65.8Low83 Ų8381.2 Ų81.243%0.42638%0.376SS..Hα-helixtrans-54.2-44.6174.2-69.1164.4000110.8L2 R8 Y9 N10L2-I6 HydrophobicContact CD2-CD1 4.33Å; L2-I6 HydrophobicContact CG-CD1 3.95Å; L2-I6 WeakPolarHBondContact O-CB 3.14Å; L2-I6 VanDerWaalsContact O-CG1 3.22Å; L2-I6 WeakPolarHBondContact O-CG1 3.47Å; L2-I6 PolarHBondContact O-N 2.87Å; I6-R8 VanDerWaalsContact C-N 3.34Å; I6-R8 PolarHBondContact O-N 2.88Å; I6-Y9 PolarHBondContact O-N 3.28Å; I6-N10 WeakPolarHBondContact O-CB 3.48Å; I6-N10 PolarHBondContact O-N 3.22Å; I6-N10 VanDerWaalsContact O-N 3.08Å; I6-N10 PolarHBondContact O-ND2 3.28Å; I6-N10 PolarHBondContact O-OD1 2.89Å
7L54.3Low67.5Low108 Ų10879.9 Ų79.957%0.56537%0.37SS*.Hα-helixtrans-59.4-44.2176.3-156.681.1000111.4R3 L5 N10 L11R3-L7 WeakPolarHBondContact O-CB 3.4Å; R3-L7 PolarHBondContact O-N 3.39Å; L5-L7 VanDerWaalsContact C-N 3.28Å; L5-L7 PolarHBondContact O-N 3.3Å; L7-N10 PolarHBondContact O-N 3.36Å; L7-L11 WeakPolarHBondContact O-CG 3.46Å; L7-L11 PolarHBondContact O-N 3.19Å
8R58.4Low69.1Low90 Ų9077.6 Ų77.634%0.3436%0.36SS..Hα-helixtrans-70.1-38.9-179.2-73.5176177.5178.62.8114F4 L5 I6 N10 L11 A12F4-R8 WeakPolarHBondContact O-CG 3.29Å; F4-R8 PolarHBondContact O-N 3.42Å; L5-R8 PolarHBondContact O-N 2.89Å; I6-R8 VanDerWaalsContact C-N 3.34Å; I6-R8 PolarHBondContact O-N 2.88Å; R8-N10 VanDerWaalsContact C-N 3.25Å; R8-N10 PolarHBondContact O-N 2.7Å; R8-L11 PolarHBondContact O-N 2.97Å; R8-A12 PolarHBondContact O-N 3.49Å
9Y59.2Low70.6Confident42 Ų4273.6 Ų73.617%0.16534%0.342CS..Hα-helixtrans-60.6-40.5172.3-67.7-67.5000110.7L5 I6 L11 Y13 Y152 F218 V295L5-Y9 VanDerWaalsContact C-CD2 3.42Å; L5-Y9 HydrophobicContact CB-CD2 4.39Å; L5-Y9 HydrophobicContact CB-CE2 3.87Å; L5-Y9 HydrophobicContact CD2-CE2 4.37Å; L5-Y9 WeakPolarHBondContact O-CD2 3.39Å; L5-Y9 PolarHBondContact O-N 2.93Å; I6-Y9 PolarHBondContact O-N 3.28Å; Y9-L11 VanDerWaalsContact C-N 3.35Å; Y9-Y13 PolarHBondContact O-N 2.98Å; Y9-Y152 PolarHBondContact O-OH 3.33Å; Y9-F218 AromaticContact CD1-CD2 3.38Å; Y9-F218 HydrophobicContact CD1-CD2 3.38Å; Y9-F218 AromaticContact CD1-CE2 3.39Å; Y9-F218 HydrophobicContact CD1-CE2 3.39Å; Y9-F218 HydrophobicContact CD1-CG 4.11Å; Y9-F218 HydrophobicContact CD1-CZ 4.21Å; Y9-F218 AromaticContact CE1-CD2 3.19Å; Y9-F218 HydrophobicContact CE1-CD2 3.19Å; Y9-F218 AromaticContact CE1-CE2 3.31Å; Y9-F218 HydrophobicContact CE1-CE2 3.31Å; Y9-F218 HydrophobicContact CE1-CG 4.24Å; Y9-F218 HydrophobicContact CE1-CZ 4.47Å; Y9-V295 HydrophobicContact CE1-CG1 4.39Å; Y9-V295 WeakPolarHBondContact OH-CA 3.48Å; Y9-V295 WeakPolarHBondContact OH-CG1 3.38Å
10N81.8Confident71.9Confident86 Ų8670 Ų7046%0.4632%0.324SS..Hα-helixtrans-68.8-33.1177.2-65.8-11.6000111.8I6 L7 R8 Y13 I14I6-N10 WeakPolarHBondContact O-CB 3.48Å; I6-N10 PolarHBondContact O-N 3.22Å; I6-N10 VanDerWaalsContact O-N 3.08Å; I6-N10 PolarHBondContact O-ND2 3.28Å; I6-N10 PolarHBondContact O-OD1 2.89Å; L7-N10 PolarHBondContact O-N 3.36Å; R8-N10 VanDerWaalsContact C-N 3.25Å; R8-N10 PolarHBondContact O-N 2.7Å; N10-Y13 WeakPolarHBondContact O-CB 3.45Å; N10-Y13 PolarHBondContact O-N 3.47Å; N10-I14 WeakPolarHBondContact O-CB 3.49Å; N10-I14 WeakPolarHBondContact O-CD1 3.39Å; N10-I14 WeakPolarHBondContact O-CG1 3.28Å; N10-I14 PolarHBondContact O-N 2.92Å
11L90Very high73.1Confident47 Ų4767.4 Ų67.425%0.24631%0.313CS..Hα-helixtrans-62.4-46.1177.2-74.4175.9000113.1L7 R8 Y9 Y13 I14 F15 L216L7-L11 WeakPolarHBondContact O-CG 3.46Å; L7-L11 PolarHBondContact O-N 3.19Å; R8-L11 PolarHBondContact O-N 2.97Å; Y9-L11 VanDerWaalsContact C-N 3.35Å; L11-Y13 PolarHBondContact O-N 3.12Å; L11-I14 PolarHBondContact O-N 3.24Å; L11-F15 HydrophobicContact CB-CZ 4.48Å; L11-F15 HydrophobicContact CD2-CE1 4.37Å; L11-F15 HydrophobicContact CD2-CZ 4.35Å; L11-F15 WeakPolarHBondContact O-CB 3.33Å; L11-F15 WeakPolarHBondContact O-CD1 3.14Å; L11-F15 WeakPolarHBondContact O-CG 3.37Å; L11-F15 PolarHBondContact O-N 3.4Å; L11-L216 HydrophobicContact CB-CD1 4.45Å
12A91.2Very high75.8Confident0 Ų059.5 Ų59.50%027%0.274CS..Hα-helixtrans-61.8-36.8178.100000111.7R8 L16 Y152 L213 L216 F218R8-A12 PolarHBondContact O-N 3.49Å; A12-L16 WeakPolarHBondContact O-CG 3.35Å; A12-L16 PolarHBondContact O-N 2.94Å; A12-L16 VanDerWaalsContact O-N 3.09Å; A12-Y152 HydrophobicContact CB-CD1 4.28Å; A12-Y152 HydrophobicContact CB-CE1 3.68Å; A12-L213 HydrophobicContact CB-CD1 3.97Å; A12-L216 HydrophobicContact CB-CD1 3.84Å; A12-F218 HydrophobicContact CB-CD1 4.08Å; A12-F218 HydrophobicContact CB-CE1 4.46Å
13Y92.7Very high78.8Confident56 Ų5654.3 Ų54.322%0.2225%0.247CC..Hα-helixtrans-65.8-47.9176-172.4-81.5000110.9Y9 N10 L11 F15 L16 F17 K151 Y152 A155Y9-Y13 PolarHBondContact O-N 2.98Å; N10-Y13 WeakPolarHBondContact O-CB 3.45Å; N10-Y13 PolarHBondContact O-N 3.47Å; L11-Y13 PolarHBondContact O-N 3.12Å; Y13-F15 VanDerWaalsContact C-N 3.34Å; Y13-F15 PolarHBondContact O-N 3.2Å; Y13-L16 PolarHBondContact O-N 2.82Å; Y13-F17 WeakPolarHBondContact O-CB 3.43Å; Y13-F17 PolarHBondContact O-N 3.08Å; Y13-K151 WeakPolarHBondContact CE2-O 3.5Å; Y13-Y152 HydrophobicContact CD2-CD1 4.44Å; Y13-A155 HydrophobicContact CD1-CB 4.13Å; Y13-A155 HydrophobicContact CD2-CB 3.62Å; Y13-A155 HydrophobicContact CE1-CB 3.98Å; Y13-A155 HydrophobicContact CE2-CB 3.47Å; Y13-A155 VanDerWaalsContact CE2-CB 3.47Å; Y13-A155 HydrophobicContact CG-CB 3.95Å
14I94.3Very high81.4Confident93 Ų9345.3 Ų45.348%0.47722%0.215SC..Hα-helixtrans-60.3-42.4177.7-68.8162.9000111.1N10 L11 F17 L18N10-I14 WeakPolarHBondContact O-CB 3.49Å; N10-I14 WeakPolarHBondContact O-CD1 3.39Å; N10-I14 WeakPolarHBondContact O-CG1 3.28Å; N10-I14 PolarHBondContact O-N 2.92Å; L11-I14 PolarHBondContact O-N 3.24Å; I14-F17 PolarHBondContact O-N 2.88Å; I14-L18 WeakPolarHBondContact O-CB 3.43Å; I14-L18 PolarHBondContact O-N 2.67Å
15F95.5Very high83.7Confident17 Ų1739.7 Ų39.78%0.07519%0.191CC..Hα-helixtrans-65.6-42.3178.7-66.1-10.9000112L11 Y13 L18 H19 T209 W212 L213 L216L11-F15 HydrophobicContact CB-CZ 4.48Å; L11-F15 HydrophobicContact CD2-CE1 4.37Å; L11-F15 HydrophobicContact CD2-CZ 4.35Å; L11-F15 WeakPolarHBondContact O-CB 3.33Å; L11-F15 WeakPolarHBondContact O-CD1 3.14Å; L11-F15 WeakPolarHBondContact O-CG 3.37Å; L11-F15 PolarHBondContact O-N 3.4Å; Y13-F15 VanDerWaalsContact C-N 3.34Å; Y13-F15 PolarHBondContact O-N 3.2Å; F15-L18 WeakPolarHBondContact O-CB 3.22Å; F15-L18 PolarHBondContact O-N 3.41Å; F15-H19 PolarHBondContact O-CD2 2.98Å; F15-H19 PolarHBondContact O-N 3.14Å; F15-T209 HydrophobicContact CD1-CG2 3.49Å; F15-T209 VanDerWaalsContact CD1-CG2 3.49Å; F15-T209 HydrophobicContact CE1-CG2 3.69Å; F15-T209 HydrophobicContact CG-CG2 4.01Å; F15-T209 HydrophobicContact CZ-CG2 4.35Å; F15-W212 HydrophobicContact CE2-CB 3.76Å; F15-W212 AromaticContact CE2-CD1 3.94Å; F15-W212 HydrophobicContact CE2-CD2 4.17Å; F15-W212 AromaticContact CE2-CG 3.67Å; F15-W212 HydrophobicContact CE2-CG 3.67Å; F15-W212 HydrophobicContact CZ-CB 4.24Å; F15-W212 AromaticContact CZ-CD2 3.94Å; F15-W212 HydrophobicContact CZ-CD2 3.94Å; F15-W212 HydrophobicContact CZ-CE3 4.19Å; F15-W212 AromaticContact CZ-CG 3.94Å; F15-W212 HydrophobicContact CZ-CG 3.94Å; F15-L213 HydrophobicContact CB-CD1 4.32Å; F15-L213 HydrophobicContact CD2-CB 4.08Å; F15-L213 HydrophobicContact CD2-CD1 4.27Å; F15-L216 HydrophobicContact CD2-CD1 4.22Å; F15-L216 HydrophobicContact CE2-CD1 4.21Å
16L95.8Very high86.1Confident1 Ų138 Ų381%0.00518%0.182CC..Hα-helixtrans-70-35.6176.8-75.3173.3000112.7A12 Y13 H19 G20 T141 A145 L148 Y152 A155 V156 L213A12-L16 WeakPolarHBondContact O-CG 3.35Å; A12-L16 PolarHBondContact O-N 2.94Å; A12-L16 VanDerWaalsContact O-N 3.09Å; Y13-L16 PolarHBondContact O-N 2.82Å; L16-H19 PolarHBondContact O-N 3.16Å; L16-G20 PolarHBondContact O-N 2.86Å; L16-T141 HydrophobicContact CD2-CG2 4.09Å; L16-A145 HydrophobicContact CD1-CB 4.01Å; L16-A145 HydrophobicContact CD2-CB 4.19Å; L16-L148 HydrophobicContact CD1-CD1 3.89Å; L16-Y152 HydrophobicContact CD1-CD1 3.98Å; L16-Y152 HydrophobicContact CD1-CG 4.23Å; L16-A155 HydrophobicContact CB-CB 4.22Å; L16-V156 HydrophobicContact CB-CG2 3.92Å; L16-V156 HydrophobicContact CD2-CG2 4.08Å; L16-V156 HydrophobicContact CG-CG2 4.49Å; L16-L213 HydrophobicContact CD2-CD2 3.96Å; L16-L213 HydrophobicContact CG-CD2 4.24Å
17F96Very high88.1Confident60 Ų6035.2 Ų35.226%0.26317%0.167SC..Hα-helixtrans-58.8-46.7168.6172.7-87.6000111.4Y13 I14 H19 G20 I21 A155 V158 G159 A162Y13-F17 WeakPolarHBondContact O-CB 3.43Å; Y13-F17 PolarHBondContact O-N 3.08Å; I14-F17 PolarHBondContact O-N 2.88Å; F17-H19 VanDerWaalsContact C-N 3.33Å; F17-H19 PolarHBondContact O-N 3.34Å; F17-G20 WeakPolarHBondContact O-CA 2.93Å; F17-G20 PolarHBondContact O-N 3Å; F17-G20 VanDerWaalsContact O-N 3.09Å; F17-I21 HydrophobicContact CD1-CD1 4.09Å; F17-I21 HydrophobicContact CE1-CD1 3.47Å; F17-I21 VanDerWaalsContact CE1-CD1 3.47Å; F17-I21 HydrophobicContact CE1-CG1 4.43Å; F17-I21 HydrophobicContact CZ-CD1 3.96Å; F17-I21 PolarHBondContact O-N 3.46Å; F17-A155 WeakPolarHBondContact CA-O 3.41Å; F17-V158 HydrophobicContact CD2-CB 4.25Å; F17-V158 HydrophobicContact CD2-CG1 4.11Å; F17-V158 HydrophobicContact CE2-CB 4.46Å; F17-V158 HydrophobicContact CE2-CG1 3.91Å; F17-G159 VanDerWaalsContact CD2-CA 3.42Å; F17-G159 VanDerWaalsContact CE2-CA 3.47Å; F17-G159 WeakPolarHBondContact O-CA 3.49Å; F17-A162 HydrophobicContact CE2-CB 3.83Å; F17-A162 HydrophobicContact CZ-CB 3.64Å
18L96.6Very high89.8Confident38 Ų3831.5 Ų31.520%0.19915%0.148CC..Hα-helixtrans-60.7-40.6176-179.567.2000111.8I14 F15 G20 I21 G22 I202 A205 T209I14-L18 WeakPolarHBondContact O-CB 3.43Å; I14-L18 PolarHBondContact O-N 2.67Å; F15-L18 WeakPolarHBondContact O-CB 3.22Å; F15-L18 PolarHBondContact O-N 3.41Å; L18-G20 VanDerWaalsContact C-N 3.28Å; L18-G20 PolarHBondContact O-N 3.04Å; L18-I21 WeakPolarHBondContact O-CB 3.36Å; L18-I21 PolarHBondContact O-N 2.95Å; L18-I21 VanDerWaalsContact O-N 3.14Å; L18-G22 PolarHBondContact O-N 3.11Å; L18-I202 HydrophobicContact CD1-CG2 4.45Å; L18-A205 HydrophobicContact CD2-CB 3.95Å; L18-T209 HydrophobicContact CD2-CG2 3.71Å
19H96.6Very high91.4Very high2 Ų227.6 Ų27.61%0.00913%0.134CC..Hα-helixtrans-64.2-33.8175-76.8-65.1000113F15 L16 F17 I21 G22 F23 F90 H137 T141 C206 T209F15-H19 PolarHBondContact O-CD2 2.98Å; F15-H19 PolarHBondContact O-N 3.14Å; L16-H19 PolarHBondContact O-N 3.16Å; F17-H19 VanDerWaalsContact C-N 3.33Å; F17-H19 PolarHBondContact O-N 3.34Å; H19-I21 VanDerWaalsContact C-N 3.28Å; H19-I21 PolarHBondContact O-N 3.46Å; H19-G22 PolarHBondContact O-N 2.99Å; H19-G22 VanDerWaalsContact O-N 3.17Å; H19-F23 WeakPolarHBondContact O-CD1 3.36Å; H19-F23 WeakPolarHBondContact O-CE1 3.35Å; H19-F23 PolarHBondContact O-N 3.35Å; H19-F23 VanDerWaalsContact O-N 3.17Å; H19-F90 AromaticContact CE1-CZ 3.39Å; H19-F90 WeakPolarHBondContact CE1-CZ 3.4Å; H19-F90 AromaticContact ND1-CZ 3.63Å; H19-H137 AromaticContact ND1-NE2 3.34Å; H19-H137 PolarHBondContact ND1-NE2 3.27Å; H19-T141 HydrophobicContact CB-CG2 3.63Å; H19-C206 PolarHBondContact CE1-O 3.37Å; H19-T209 PolarHBondContact NE2-OG1 3.1Å
20G96.9Very high92.9Very high0 Ų025.6 Ų25.60%013%0.126CC..Hα-helixtrans-54.9-42.4169.700000113.3L16 F17 L18 F23 V156 S160L16-G20 PolarHBondContact O-N 2.86Å; F17-G20 WeakPolarHBondContact O-CA 2.93Å; F17-G20 PolarHBondContact O-N 3Å; F17-G20 VanDerWaalsContact O-N 3.09Å; L18-G20 VanDerWaalsContact C-N 3.28Å; L18-G20 PolarHBondContact O-N 3.04Å; G20-F23 VanDerWaalsContact CA-CE1 3.49Å; G20-V156 VanDerWaalsContact CA-O 3.23Å; G20-V156 WeakPolarHBondContact CA-O 3.43Å; G20-S160 WeakPolarHBondContact O-CA 2.95Å
21I96.3Very high93.2Very high16 Ų1623.8 Ų23.88%0.08212%0.116CC..Hα-helixtrans-70.1-45.7173.3-62.9172.5000110.3F17 L18 H19 F23 L24 I25 G159 C163 I202F17-I21 HydrophobicContact CD1-CD1 4.09Å; F17-I21 HydrophobicContact CE1-CD1 3.47Å; F17-I21 VanDerWaalsContact CE1-CD1 3.47Å; F17-I21 HydrophobicContact CE1-CG1 4.43Å; F17-I21 HydrophobicContact CZ-CD1 3.96Å; F17-I21 PolarHBondContact O-N 3.46Å; L18-I21 WeakPolarHBondContact O-CB 3.36Å; L18-I21 PolarHBondContact O-N 2.95Å; L18-I21 VanDerWaalsContact O-N 3.14Å; H19-I21 VanDerWaalsContact C-N 3.28Å; H19-I21 PolarHBondContact O-N 3.46Å; I21-F23 PolarHBondContact O-N 3.04Å; I21-L24 PolarHBondContact O-N 3.21Å; I21-L24 VanDerWaalsContact O-N 3.07Å; I21-I25 HydrophobicContact CG2-CD1 3.28Å; I21-I25 HydrophobicContact CG2-CG1 3.81Å; I21-I25 PolarHBondContact O-N 2.95Å; I21-I25 VanDerWaalsContact O-N 3.09Å; I21-G159 WeakPolarHBondContact CG1-O 3.47Å; I21-C163 HydrophobicContact CB-CB 4.33Å; I21-C163 HydrophobicContact CG1-CB 4.18Å; I21-C163 HydrophobicContact CG2-CB 4.14Å; I21-I202 HydrophobicContact CG2-CG2 4.25Å
22G95.7Very high93.1Very high0 Ų023.3 Ų23.30%011%0.113CC..Hα-helixtrans-57.2-44.1-17200000114.6L18 H19 L24 P26 I203L18-G22 PolarHBondContact O-N 3.11Å; H19-G22 PolarHBondContact O-N 2.99Å; H19-G22 VanDerWaalsContact O-N 3.17Å; G22-L24 VanDerWaalsContact C-N 3.29Å; G22-L24 PolarHBondContact O-N 3.34Å; G22-P26 WeakPolarHBondContact O-CD 3.42Å; G22-P26 WeakPolarHBondContact O-CG 3.34Å; G22-I203 VanDerWaalsContact O-CD1 3.28Å; G22-I203 WeakPolarHBondContact O-CD1 3.47Å
23F94.7Very high92.9Very high1 Ų123.7 Ų23.70%0.00412%0.117CC..THydrogen-bonded Turntrans-76.1-15.5179.659.7-112.3000113.5H19 G20 I21 V134 H137 Q138 F142 V156H19-F23 WeakPolarHBondContact O-CD1 3.36Å; H19-F23 WeakPolarHBondContact O-CE1 3.35Å; H19-F23 PolarHBondContact O-N 3.35Å; H19-F23 VanDerWaalsContact O-N 3.17Å; G20-F23 VanDerWaalsContact CA-CE1 3.49Å; I21-F23 PolarHBondContact O-N 3.04Å; F23-V134 HydrophobicContact CB-CG1 4.35Å; F23-V134 WeakPolarHBondContact O-CG1 3.43Å; F23-V134 VanDerWaalsContact O-CG2 3.29Å; F23-V134 WeakPolarHBondContact O-CG2 3.48Å; F23-H137 HydrophobicContact CB-CB 4.33Å; F23-H137 WeakPolarHBondContact CB-ND1 3.3Å; F23-H137 PolarHBondContact N-CE1 3.47Å; F23-Q138 HydrophobicContact CB-CB 4.4Å; F23-Q138 HydrophobicContact CD1-CB 4.14Å; F23-Q138 HydrophobicContact CD1-CG 4.21Å; F23-Q138 HydrophobicContact CD2-CB 4.22Å; F23-Q138 HydrophobicContact CD2-CG 4.08Å; F23-Q138 HydrophobicContact CE1-CB 4.48Å; F23-Q138 HydrophobicContact CE1-CG 4.07Å; F23-Q138 HydrophobicContact CE2-CG 3.96Å; F23-Q138 HydrophobicContact CG-CB 4.02Å; F23-Q138 HydrophobicContact CG-CG 4.24Å; F23-Q138 HydrophobicContact CZ-CG 3.97Å; F23-F142 HydrophobicContact CZ-CE2 4.42Å; F23-V156 HydrophobicContact CE1-CG1 3.56Å; F23-V156 HydrophobicContact CZ-CG1 3.93Å
24L93Very high92.7Very high36 Ų3626.1 Ų26.119%0.18813%0.127CC..THydrogen-bonded Turntrans-93.4-36.1-179.7-76-170.8000113.6I21 G22 W27 N28 S160 C163I21-L24 PolarHBondContact O-N 3.21Å; I21-L24 VanDerWaalsContact O-N 3.07Å; G22-L24 VanDerWaalsContact C-N 3.29Å; G22-L24 PolarHBondContact O-N 3.34Å; L24-W27 PolarHBondContact O-N 2.78Å; L24-N28 WeakPolarHBondContact O-CB 3.44Å; L24-N28 PolarHBondContact O-N 3.22Å; L24-N28 PolarHBondContact O-ND2 3.34Å; L24-S160 VanDerWaalsContact CD1-O 3.29Å; L24-S160 WeakPolarHBondContact CD1-O 3.37Å; L24-S160 VanDerWaalsContact CD1-OG 3.23Å; L24-S160 WeakPolarHBondContact CD1-OG 3.44Å; L24-C163 HydrophobicContact CB-CB 4.4Å; L24-C163 HydrophobicContact CD1-CB 4.36Å
25I91.9Very high92.4Very high21 Ų2125.6 Ų25.611%0.10812%0.122CC..Hα-helixtrans-58-45.4-175.7-75-172.4000113.6I21 W27 N28 V29 C163 A199 I202I21-I25 HydrophobicContact CG2-CD1 3.28Å; I21-I25 HydrophobicContact CG2-CG1 3.81Å; I21-I25 PolarHBondContact O-N 2.95Å; I21-I25 VanDerWaalsContact O-N 3.09Å; I25-W27 PolarHBondContact O-N 3.15Å; I25-N28 PolarHBondContact O-N 3.16Å; I25-V29 HydrophobicContact CG2-CG1 4.31Å; I25-V29 PolarHBondContact O-N 2.92Å; I25-C163 WeakPolarHBondContact CG1-SG 2.93Å; I25-A199 HydrophobicContact CG2-CB 3.5Å; I25-A199 VanDerWaalsContact CG2-CB 3.5Å; I25-I202 HydrophobicContact CD1-CB 4.48Å; I25-I202 HydrophobicContact CD1-CD1 3.15Å; I25-I202 HydrophobicContact CD1-CG1 4.35Å; I25-I202 HydrophobicContact CD1-CG2 4.23Å
26P88.1Confident92.3Very high0 Ų025.1 Ų25.10%012%0.12CC..Hα-helixtrans-57.5-34.6-178.6-26.534.2000113.3G22 V29 F30 I130 V134 I203G22-P26 WeakPolarHBondContact O-CD 3.42Å; G22-P26 WeakPolarHBondContact O-CG 3.34Å; P26-V29 WeakPolarHBondContact O-CG2 3.46Å; P26-F30 WeakPolarHBondContact O-CD2 3.43Å; P26-F30 VanDerWaalsContact O-CE2 3.28Å; P26-F30 WeakPolarHBondContact O-CE2 3.4Å; P26-I130 HydrophobicContact CB-CD1 3.5Å; P26-I130 HydrophobicContact CB-CG1 3.82Å; P26-V134 HydrophobicContact CB-CG2 4.49Å; P26-I203 HydrophobicContact CG-CD1 3.67Å; P26-I203 HydrophobicContact CG-CG1 3.99Å
27W90.8Very high92.2Very high26 Ų2625.2 Ų25.210%0.09812%0.12CC..Hα-helixtrans-76.3-44.6173.9166.3-129.9000111.7L24 I25 V29 F30 I31 F59 A63 V127L24-W27 PolarHBondContact O-N 2.78Å; I25-W27 PolarHBondContact O-N 3.15Å; W27-V29 VanDerWaalsContact C-N 3.3Å; W27-V29 PolarHBondContact O-N 3.46Å; W27-F30 HydrophobicContact CE3-CB 4.39Å; W27-F30 HydrophobicContact CZ3-CB 4.3Å; W27-F30 PolarHBondContact O-N 3.05Å; W27-F30 VanDerWaalsContact O-N 3.13Å; W27-I31 HydrophobicContact CD2-CD1 3.96Å; W27-I31 HydrophobicContact CD2-CG1 4.35Å; W27-I31 HydrophobicContact CE3-CG1 4.49Å; W27-I31 HydrophobicContact CG-CD1 4.47Å; W27-I31 HydrophobicContact CH2-CD1 3.97Å; W27-I31 HydrophobicContact CH2-CG1 3.72Å; W27-I31 HydrophobicContact CZ2-CD1 3.27Å; W27-I31 HydrophobicContact CZ2-CG1 3.58Å; W27-I31 HydrophobicContact CZ3-CG1 4.18Å; W27-I31 VanDerWaalsContact NE1-CD1 3.3Å; W27-F59 VanDerWaalsContact CH2-C 3.46Å; W27-F59 HydrophobicContact CH2-CB 3.9Å; W27-F59 WeakPolarHBondContact CH2-O 3.47Å; W27-F59 HydrophobicContact CZ3-CB 4.14Å; W27-A63 HydrophobicContact CD2-CB 3.74Å; W27-A63 HydrophobicContact CE3-CB 3.51Å; W27-A63 HydrophobicContact CH2-CB 3.3Å; W27-A63 HydrophobicContact CZ2-CB 3.48Å; W27-A63 VanDerWaalsContact CZ2-CB 3.48Å; W27-A63 HydrophobicContact CZ3-CB 3.32Å; W27-V127 HydrophobicContact CE3-CG1 4.36Å; W27-V127 HydrophobicContact CZ3-CG1 3.87Å
28N91.3Very high92Very high30 Ų3024 Ų2416%0.1612%0.117CC..Hα-helixtrans-64-30.8-175.3-85.6-76.9000113.7L24 I25 F30 I31 N32 I167L24-N28 WeakPolarHBondContact O-CB 3.44Å; L24-N28 PolarHBondContact O-N 3.22Å; L24-N28 PolarHBondContact O-ND2 3.34Å; I25-N28 PolarHBondContact O-N 3.16Å; N28-F30 PolarHBondContact O-N 2.88Å; N28-I31 PolarHBondContact O-N 2.79Å; N28-N32 WeakPolarHBondContact O-CB 3.5Å; N28-N32 PolarHBondContact O-N 2.95Å; N28-N32 PolarHBondContact O-ND2 2.88Å; N28-I167 HydrophobicContact CB-CD1 3.33Å; N28-I167 HydrophobicContact CB-CG1 4.48Å
29V90.6Very high91.8Very high8 Ų824.9 Ų24.95%0.04812%0.118CC..Hα-helixtrans-60.9-29.1176.2-67.20000112.8I25 P26 W27 G33 L101 F195 F196 A199I25-V29 HydrophobicContact CG2-CG1 4.31Å; I25-V29 PolarHBondContact O-N 2.92Å; P26-V29 WeakPolarHBondContact O-CG2 3.46Å; W27-V29 VanDerWaalsContact C-N 3.3Å; W27-V29 PolarHBondContact O-N 3.46Å; V29-G33 WeakPolarHBondContact O-CA 3.39Å; V29-G33 PolarHBondContact O-N 2.85Å; V29-L101 HydrophobicContact CG2-CD2 4.22Å; V29-F195 HydrophobicContact CG1-CB 4.25Å; V29-F196 HydrophobicContact CB-CD1 4.04Å; V29-F196 HydrophobicContact CB-CE1 4.05Å; V29-F196 HydrophobicContact CG2-CD1 3.74Å; V29-F196 HydrophobicContact CG2-CE1 3.75Å; V29-A199 HydrophobicContact CG1-CB 4Å
30F91.7Very high91.7Very high0 Ų025.2 Ų25.20%012%0.119CC..Hα-helixtrans-74.1-42.3176.2-68.6-88.9000112.5P26 W27 N28 F37 F59 T104 T123 V127 I130 F196P26-F30 WeakPolarHBondContact O-CD2 3.43Å; P26-F30 VanDerWaalsContact O-CE2 3.28Å; P26-F30 WeakPolarHBondContact O-CE2 3.4Å; W27-F30 HydrophobicContact CE3-CB 4.39Å; W27-F30 HydrophobicContact CZ3-CB 4.3Å; W27-F30 PolarHBondContact O-N 3.05Å; W27-F30 VanDerWaalsContact O-N 3.13Å; N28-F30 PolarHBondContact O-N 2.88Å; F30-F37 HydrophobicContact CB-CE2 4.46Å; F30-F37 HydrophobicContact CD1-CE1 4.36Å; F30-F37 HydrophobicContact CD1-CE2 4.24Å; F30-F37 AromaticContact CD1-CZ 3.57Å; F30-F37 HydrophobicContact CD1-CZ 3.57Å; F30-F37 HydrophobicContact CE1-CZ 4.2Å; F30-F37 HydrophobicContact CG-CZ 4.44Å; F30-F37 WeakPolarHBondContact O-CE2 3.47Å; F30-F59 HydrophobicContact CB-CD2 4.22Å; F30-F59 HydrophobicContact CB-CE2 4.22Å; F30-T104 HydrophobicContact CE1-CG2 3.87Å; F30-T104 HydrophobicContact CZ-CG2 3.73Å; F30-T123 HydrophobicContact CD1-CG2 4.46Å; F30-T123 HydrophobicContact CE1-CG2 4.38Å; F30-V127 HydrophobicContact CB-CG2 4.44Å; F30-V127 HydrophobicContact CD1-CG2 3.43Å; F30-V127 VanDerWaalsContact CD1-CG2 3.43Å; F30-V127 HydrophobicContact CD2-CG2 4.33Å; F30-V127 HydrophobicContact CE1-CG2 3.62Å; F30-V127 HydrophobicContact CE2-CG2 4.49Å; F30-V127 HydrophobicContact CG-CG2 3.82Å; F30-V127 HydrophobicContact CZ-CG2 4.14Å; F30-I130 HydrophobicContact CE2-CD1 3.92Å; F30-I130 HydrophobicContact CE2-CG2 3.94Å; F30-F196 HydrophobicContact CE1-CE1 4.48Å; F30-F196 HydrophobicContact CZ-CE1 4.49Å
31I88.1Confident91.6Very high48 Ų4825.3 Ų25.325%0.24612%0.12CC..Hα-helixtrans-66.4-48178.3-65163.3000110.5W27 N28 G33 Y34 L56W27-I31 HydrophobicContact CD2-CD1 3.96Å; W27-I31 HydrophobicContact CD2-CG1 4.35Å; W27-I31 HydrophobicContact CE3-CG1 4.49Å; W27-I31 HydrophobicContact CG-CD1 4.47Å; W27-I31 HydrophobicContact CH2-CD1 3.97Å; W27-I31 HydrophobicContact CH2-CG1 3.72Å; W27-I31 HydrophobicContact CZ2-CD1 3.27Å; W27-I31 HydrophobicContact CZ2-CG1 3.58Å; W27-I31 HydrophobicContact CZ3-CG1 4.18Å; W27-I31 VanDerWaalsContact NE1-CD1 3.3Å; N28-I31 PolarHBondContact O-N 2.79Å; I31-G33 VanDerWaalsContact C-N 3.33Å; I31-Y34 PolarHBondContact O-N 3.07Å; I31-L56 HydrophobicContact CG1-CD1 4.29Å; I31-L56 HydrophobicContact CG2-CD1 4.01Å
32N87.9Confident91.4Very high36 Ų3628.6 Ų28.619%0.19314%0.138CC..Hα-helixtrans-78.7-20.8-174.3-61.9-69.3000112.4N28 Y34 I167 N171N28-N32 WeakPolarHBondContact O-CB 3.5Å; N28-N32 PolarHBondContact O-N 2.95Å; N28-N32 PolarHBondContact O-ND2 2.88Å; N32-Y34 PolarHBondContact O-N 3.42Å; N32-I167 VanDerWaalsContact CG-CG2 3.42Å; N32-I167 WeakPolarHBondContact ND2-CG2 3.34Å; N32-I167 WeakPolarHBondContact OD1-CG2 3.42Å; N32-N171 PolarHBondContact OD1-ND2 3.27Å
33G86.3Confident91.3Very high8 Ų829.6 Ų29.68%0.08214%0.144CC..THydrogen-bonded Turntrans-76.113.617100000114.7V29 I31 E35 Y36 F37V29-G33 WeakPolarHBondContact O-CA 3.39Å; V29-G33 PolarHBondContact O-N 2.85Å; I31-G33 VanDerWaalsContact C-N 3.33Å; G33-E35 VanDerWaalsContact C-N 3.26Å; G33-E35 PolarHBondContact O-N 2.85Å; G33-E35 VanDerWaalsContact O-N 3.15Å; G33-Y36 WeakPolarHBondContact O-CB 3.28Å; G33-Y36 PolarHBondContact O-N 3.25Å; G33-F37 WeakPolarHBondContact O-CD2 3.43Å; G33-F37 PolarHBondContact O-N 3.22Å
34Y88.6Confident91.1Very high108 Ų10839.5 Ų39.542%0.42419%0.187SC..Hα-helixtrans-48.6-44.5-174.8170.5-100.7000113.3I31 N32 Y36 F37 D38 L55I31-Y34 PolarHBondContact O-N 3.07Å; N32-Y34 PolarHBondContact O-N 3.42Å; Y34-Y36 VanDerWaalsContact C-N 3.25Å; Y34-Y36 PolarHBondContact O-N 3.33Å; Y34-F37 PolarHBondContact O-N 3.48Å; Y34-F37 VanDerWaalsContact O-N 3.13Å; Y34-D38 HydrophobicContact CE1-CB 4.31Å; Y34-D38 HydrophobicContact CE2-CB 4.49Å; Y34-D38 PolarHBondContact O-N 3.46Å; Y34-L55 HydrophobicContact CD2-CD2 4.07Å; Y34-L55 HydrophobicContact CE2-CD2 4.19Å
35E88.1Confident91Very high82 Ų8243.1 Ų43.138%0.38321%0.211SC..Hα-helixtrans-60.7-35.5-179.3-57.9-169.6157.600113G33 Y39 K183G33-E35 VanDerWaalsContact C-N 3.26Å; G33-E35 PolarHBondContact O-N 2.85Å; G33-E35 VanDerWaalsContact O-N 3.15Å; E35-Y39 VanDerWaalsContact O-CB 3.25Å; E35-Y39 WeakPolarHBondContact O-CB 3.44Å; E35-Y39 PolarHBondContact O-N 3.01Å; E35-K183 IonicContact OE1-NZ 2.87Å; E35-K183 PolarHBondContact OE1-NZ 2.95Å; E35-K183 WeakPolarHBondContact OE2-CE 3.23Å; E35-K183 IonicContact OE2-NZ 3.63Å; E35-K183 PolarHBondContact OE2-NZ 2.95Å
36Y92.7Very high91Very high6 Ų642.1 Ų42.12%0.02421%0.205CC..Hα-helixtrans-68.5-44.4175.6151.3-98.6000111.5G33 Y34 Y39 K40 A108 F119 A192 F196G33-Y36 WeakPolarHBondContact O-CB 3.28Å; G33-Y36 PolarHBondContact O-N 3.25Å; Y34-Y36 VanDerWaalsContact C-N 3.25Å; Y34-Y36 PolarHBondContact O-N 3.33Å; Y36-Y39 PolarHBondContact O-N 3.32Å; Y36-K40 HydrophobicContact CD2-CG 4.12Å; Y36-K40 HydrophobicContact CE2-CD 4.26Å; Y36-K40 HydrophobicContact CE2-CG 3.59Å; Y36-K40 PolarHBondContact O-N 2.92Å; Y36-A108 HydrophobicContact CE2-CB 3.78Å; Y36-A108 WeakPolarHBondContact OH-CA 3.3Å; Y36-A108 PolarHBondContact OH-N 3.43Å; Y36-F119 HydrophobicContact CE1-CZ 4.3Å; Y36-F119 WeakPolarHBondContact OH-CE2 3.5Å; Y36-F119 WeakPolarHBondContact OH-CZ 3.34Å; Y36-A192 HydrophobicContact CD1-CB 4.05Å; Y36-A192 HydrophobicContact CD2-CB 3.76Å; Y36-A192 HydrophobicContact CE2-CB 4.44Å; Y36-A192 HydrophobicContact CG-CB 3.53Å; Y36-F196 HydrophobicContact CE1-CE2 4.21Å; Y36-F196 HydrophobicContact CE1-CZ 4.47Å
37F94.5Very high91Very high3 Ų343.9 Ų43.91%0.01322%0.218CC..Hα-helixtrans-67.9-40.6178.3-65.5-73.2000111.5F30 G33 Y34 Y39 K40 L41 L55 F59 F119 T123 F196F30-F37 HydrophobicContact CB-CE2 4.46Å; F30-F37 HydrophobicContact CD1-CE1 4.36Å; F30-F37 HydrophobicContact CD1-CE2 4.24Å; F30-F37 AromaticContact CD1-CZ 3.57Å; F30-F37 HydrophobicContact CD1-CZ 3.57Å; F30-F37 HydrophobicContact CE1-CZ 4.2Å; F30-F37 HydrophobicContact CG-CZ 4.44Å; F30-F37 WeakPolarHBondContact O-CE2 3.47Å; G33-F37 WeakPolarHBondContact O-CD2 3.43Å; G33-F37 PolarHBondContact O-N 3.22Å; Y34-F37 PolarHBondContact O-N 3.48Å; Y34-F37 VanDerWaalsContact O-N 3.13Å; F37-Y39 VanDerWaalsContact C-N 3.34Å; F37-Y39 PolarHBondContact O-N 3.18Å; F37-K40 PolarHBondContact O-N 3.08Å; F37-L41 VanDerWaalsContact O-CB 3.32Å; F37-L41 WeakPolarHBondContact O-CB 3.46Å; F37-L41 WeakPolarHBondContact O-CG 3.46Å; F37-L41 PolarHBondContact O-N 3.24Å; F37-L55 HydrophobicContact CB-CD2 3.5Å; F37-L55 HydrophobicContact CG-CD2 4.43Å; F37-F59 HydrophobicContact CD1-CE2 4.39Å; F37-F59 AromaticContact CD1-CZ 3.89Å; F37-F59 HydrophobicContact CD1-CZ 3.89Å; F37-F59 AromaticContact CD2-CE2 3.69Å; F37-F59 HydrophobicContact CD2-CE2 3.69Å; F37-F59 HydrophobicContact CD2-CZ 4.04Å; F37-F59 HydrophobicContact CE1-CE2 4.48Å; F37-F59 HydrophobicContact CE1-CZ 4.01Å; F37-F59 AromaticContact CE2-CE2 3.83Å; F37-F59 HydrophobicContact CE2-CE2 3.83Å; F37-F59 HydrophobicContact CE2-CZ 4.19Å; F37-F59 HydrophobicContact CG-CE2 4.01Å; F37-F59 AromaticContact CG-CZ 3.91Å; F37-F59 HydrophobicContact CG-CZ 3.91Å; F37-F59 HydrophobicContact CZ-CE2 4.22Å; F37-F59 HydrophobicContact CZ-CZ 4.16Å; F37-F119 HydrophobicContact CD1-CE1 4.24Å; F37-F119 HydrophobicContact CD1-CZ 4.08Å; F37-F119 HydrophobicContact CE1-CZ 4.44Å; F37-T123 HydrophobicContact CD1-CG2 4.08Å; F37-T123 HydrophobicContact CE1-CG2 3.5Å; F37-T123 HydrophobicContact CZ-CG2 4.3Å; F37-F196 AromaticContact CZ-CZ 3.97Å; F37-F196 HydrophobicContact CZ-CZ 3.97Å
38D92.1Very high91Very high36 Ų3649.2 Ų49.219%0.19325%0.248CC..Hα-helixtrans-61.5-44.4174.3-173.956.1000110.7Y34 K40 L41 N42 R52Y34-D38 HydrophobicContact CE1-CB 4.31Å; Y34-D38 HydrophobicContact CE2-CB 4.49Å; Y34-D38 PolarHBondContact O-N 3.46Å; D38-K40 PolarHBondContact O-N 3.22Å; D38-L41 CarbonylContact O-C 3.35Å; D38-L41 PolarHBondContact O-N 2.81Å; D38-N42 WeakPolarHBondContact O-CB 3.47Å; D38-N42 PolarHBondContact O-N 3.36Å; D38-R52 IonicContact OD1-CZ 3.24Å; D38-R52 VanDerWaalsContact OD1-CZ 3.24Å; D38-R52 IonicContact OD1-NE 2.78Å; D38-R52 PolarHBondContact OD1-NE 3.22Å; D38-R52 IonicContact OD1-NH2 2.79Å; D38-R52 PolarHBondContact OD1-NH2 3.34Å; D38-R52 IonicContact OD2-NH2 2.77Å; D38-R52 PolarHBondContact OD2-NH2 2.99Å
39Y92.1Very high91.1Very high55 Ų5548.8 Ų48.822%0.21625%0.249CC..Hα-helixtrans-57.1-47.5174.2161.9-102.1000112.7E35 Y36 F37 L41 N42 Q185 I188 I189E35-Y39 VanDerWaalsContact O-CB 3.25Å; E35-Y39 WeakPolarHBondContact O-CB 3.44Å; E35-Y39 PolarHBondContact O-N 3.01Å; Y36-Y39 PolarHBondContact O-N 3.32Å; F37-Y39 VanDerWaalsContact C-N 3.34Å; F37-Y39 PolarHBondContact O-N 3.18Å; Y39-L41 VanDerWaalsContact C-N 3.31Å; Y39-L41 PolarHBondContact O-N 3.11Å; Y39-N42 PolarHBondContact O-N 3.38Å; Y39-Q185 HydrophobicContact CE1-CG 4.15Å; Y39-Q185 HydrophobicContact CE2-CB 4.32Å; Y39-Q185 HydrophobicContact CE2-CG 3.74Å; Y39-Q185 VanDerWaalsContact CZ-CG 3.45Å; Y39-Q185 VanDerWaalsContact OH-CG 3.28Å; Y39-Q185 WeakPolarHBondContact OH-CG 3.49Å; Y39-Q185 PolarHBondContact OH-NE2 3.02Å; Y39-I188 HydrophobicContact CD1-CG2 4.41Å; Y39-I188 HydrophobicContact CG-CG2 4.44Å; Y39-I189 HydrophobicContact CE1-CD1 4.07Å; Y39-I189 HydrophobicContact CE1-CG1 4.12Å
40K93.7Very high91.3Very high10 Ų1052.3 Ų52.34%0.04327%0.267CS..Hα-helixtrans-67-29.9179-76-75.4-170175.10113.3Y36 F37 D38 A108 I110 F119Y36-K40 HydrophobicContact CD2-CG 4.12Å; Y36-K40 HydrophobicContact CE2-CD 4.26Å; Y36-K40 HydrophobicContact CE2-CG 3.59Å; Y36-K40 PolarHBondContact O-N 2.92Å; F37-K40 PolarHBondContact O-N 3.08Å; D38-K40 PolarHBondContact O-N 3.22Å; K40-A108 WeakPolarHBondContact CE-O 3.43Å; K40-A108 PolarHBondContact NZ-O 2.87Å; K40-I110 PolarHBondContact NZ-O 3.38Å; K40-F119 HydrophobicContact CB-CD1 4.16Å; K40-F119 HydrophobicContact CB-CE1 3.55Å; K40-F119 HydrophobicContact CB-CE2 4.43Å; K40-F119 HydrophobicContact CB-CZ 3.71Å; K40-F119 HydrophobicContact CD-CE2 4.48Å; K40-F119 HydrophobicContact CD-CZ 4.49Å; K40-F119 HydrophobicContact CG-CE1 4.22Å; K40-F119 HydrophobicContact CG-CE2 4.3Å; K40-F119 HydrophobicContact CG-CZ 3.84Å
41L95.2Very high91.4Very high1 Ų154.7 Ų54.71%0.00528%0.277CS..Hα-helixtrans-95.2-11-178.2-63.6174.1000113.1F37 D38 Y39 T43 S46 Y51 R52 L55 P116 F119 F120F37-L41 VanDerWaalsContact O-CB 3.32Å; F37-L41 WeakPolarHBondContact O-CB 3.46Å; F37-L41 WeakPolarHBondContact O-CG 3.46Å; F37-L41 PolarHBondContact O-N 3.24Å; D38-L41 CarbonylContact O-C 3.35Å; D38-L41 PolarHBondContact O-N 2.81Å; Y39-L41 VanDerWaalsContact C-N 3.31Å; Y39-L41 PolarHBondContact O-N 3.11Å; L41-T43 VanDerWaalsContact C-N 3.31Å; L41-T43 PolarHBondContact O-N 3.3Å; L41-S46 WeakPolarHBondContact O-CB 3.47Å; L41-S46 PolarHBondContact O-OG 3.2Å; L41-Y51 HydrophobicContact CD1-CD2 4.48Å; L41-Y51 HydrophobicContact CD2-CD2 4.32Å; L41-Y51 HydrophobicContact CD2-CE2 3.96Å; L41-R52 HydrophobicContact CB-CB 4.27Å; L41-R52 HydrophobicContact CB-CG 3.94Å; L41-L55 HydrophobicContact CD1-CD1 3.85Å; L41-L55 HydrophobicContact CD1-CD2 4.1Å; L41-P116 HydrophobicContact CD2-CB 4.43Å; L41-F119 HydrophobicContact CD2-CD1 3.68Å; L41-F119 HydrophobicContact CD2-CE1 4.1Å; L41-F119 HydrophobicContact CG-CD1 4.32Å; L41-F119 HydrophobicContact CG-CE1 4.26Å; L41-F120 HydrophobicContact CD1-CD2 4.22Å; L41-F120 HydrophobicContact CD2-CB 3.92Å
42N93Very high91.7Very high86 Ų8654.4 Ų54.446%0.4627%0.272SS..  trans-84.674177.6-170.211.8000110.9D38 Y39 R52D38-N42 WeakPolarHBondContact O-CB 3.47Å; D38-N42 PolarHBondContact O-N 3.36Å; Y39-N42 PolarHBondContact O-N 3.38Å; N42-R52 PolarHBondContact ND2-NH2 3.48Å; N42-R52 PolarHBondContact OD1-NH1 3.05Å
43T92.5Very high91.9Very high21 Ų2158 Ų5813%0.12929%0.291CS..SBendtrans-113.9170.9177.781.70000110.8L41 T45 S46 S47 P116L41-T43 VanDerWaalsContact C-N 3.31Å; L41-T43 PolarHBondContact O-N 3.3Å; T43-T45 PolarHBondContact O-N 3.21Å; T43-T45 PolarHBondContact OG1-N 3.17Å; T43-T45 PolarHBondContact OG1-OG1 2.86Å; T43-T45 VanDerWaalsContact OG1-OG1 3.12Å; T43-S46 PolarHBondContact N-OG 2.85Å; T43-S46 PolarHBondContact O-N 2.93Å; T43-S46 PolarHBondContact OG1-N 2.97Å; T43-S46 PolarHBondContact OG1-OG 3.24Å; T43-S47 WeakPolarHBondContact O-CA 3.43Å; T43-S47 WeakPolarHBondContact O-CB 3.18Å; T43-S47 PolarHBondContact O-N 3.13Å; T43-P116 HydrophobicContact CG2-CB 4.08Å; T43-P116 HydrophobicContact CG2-CG 4.28Å
44K90.2Very high92.2Very high209 Ų20960.9 Ų60.991%0.90930%0.304SS*.THydrogen-bonded Turntrans-57.1-31.4176.5-66.5-177.2-179.7179.10113.2
45T90.8Very high92.4Very high112 Ų11255.8 Ų55.869%0.68728%0.284SS*.THydrogen-bonded Turntrans-92-19.2-176.954.80000113.1T43 P116T43-T45 PolarHBondContact O-N 3.21Å; T43-T45 PolarHBondContact OG1-N 3.17Å; T43-T45 PolarHBondContact OG1-OG1 2.86Å; T43-T45 VanDerWaalsContact OG1-OG1 3.12Å; T45-P116 WeakPolarHBondContact OG1-CG 3.34Å
46S92.2Very high92.6Very high0 Ų056.4 Ų56.40%029%0.289CS..THydrogen-bonded Turntrans-124.13.8-171.158.40000114.6L41 T43 N48 A49 Y51 R52 P116L41-S46 WeakPolarHBondContact O-CB 3.47Å; L41-S46 PolarHBondContact O-OG 3.2Å; T43-S46 PolarHBondContact N-OG 2.85Å; T43-S46 PolarHBondContact O-N 2.93Å; T43-S46 PolarHBondContact OG1-N 2.97Å; T43-S46 PolarHBondContact OG1-OG 3.24Å; S46-N48 VanDerWaalsContact C-N 3.27Å; S46-N48 PolarHBondContact O-N 3Å; S46-A49 WeakPolarHBondContact O-CB 3.46Å; S46-A49 PolarHBondContact O-N 3.21Å; S46-A49 VanDerWaalsContact O-N 3.07Å; S46-Y51 WeakPolarHBondContact CB-OH 3.38Å; S46-R52 WeakPolarHBondContact O-CD 3.29Å; S46-P116 WeakPolarHBondContact OG-CB 3.35Å; S46-P116 WeakPolarHBondContact OG-CG 3.39Å
47S89.2Confident92.5Very high37 Ų3758.5 Ų58.526%0.25931%0.305SS..THydrogen-bonded Turntrans-52.8-43.3-179.455.90000112.6T43 R52T43-S47 WeakPolarHBondContact O-CA 3.43Å; T43-S47 WeakPolarHBondContact O-CB 3.18Å; T43-S47 PolarHBondContact O-N 3.13Å; S47-R52 PolarHBondContact O-NH1 3.05Å
48N91Very high92.4Very high137 Ų13762.8 Ų62.873%0.73332%0.322SS*.THydrogen-bonded Turntrans-107.115.3178.9-62.2-29.6000112.8S46S46-N48 VanDerWaalsContact C-N 3.27Å; S46-N48 PolarHBondContact O-N 3Å
49A93.3Very high92.5Very high21 Ų2161.2 Ų61.217%0.17431%0.313CS..  trans-69138.4-179.900000110.9S46 Y51 R52 I53S46-A49 WeakPolarHBondContact O-CB 3.46Å; S46-A49 PolarHBondContact O-N 3.21Å; S46-A49 VanDerWaalsContact O-N 3.07Å; A49-Y51 VanDerWaalsContact C-N 3.26Å; A49-Y51 HydrophobicContact CB-CD1 3.83Å; A49-Y51 HydrophobicContact CB-CD2 4.26Å; A49-Y51 HydrophobicContact CB-CE1 3.41Å; A49-Y51 VanDerWaalsContact CB-CE1 3.41Å; A49-Y51 HydrophobicContact CB-CE2 3.85Å; A49-Y51 HydrophobicContact CB-CG 4.24Å; A49-Y51 VanDerWaalsContact CB-CZ 3.42Å; A49-Y51 PolarHBondContact O-N 3.39Å; A49-R52 WeakPolarHBondContact O-CB 3.44Å; A49-R52 PolarHBondContact O-N 2.98Å; A49-I53 PolarHBondContact O-N 3.46Å
50D94.7Very high92.5Very high83 Ų8359.2 Ų59.244%0.44431%0.31SS..Hα-helixtrans-55.1-40.7-178.2179.356.8000112.6R52 I53 N54 Y58D50-R52 PolarHBondContact O-N 3.46Å; D50-I53 PolarHBondContact O-N 2.92Å; D50-N54 WeakPolarHBondContact O-CB 3.19Å; D50-N54 PolarHBondContact O-N 3.37Å; D50-N54 PolarHBondContact OD1-ND2 3.12Å; D50-Y58 PolarHBondContact OD2-OH 2.89Å
51Y93.8Very high92.4Very high49 Ų4962.8 Ų62.819%0.19233%0.325CS..Hα-helixtrans-63.4-24.6177.859.8-106.1000114.6L41 S46 A49 L55 F120L41-Y51 HydrophobicContact CD1-CD2 4.48Å; L41-Y51 HydrophobicContact CD2-CD2 4.32Å; L41-Y51 HydrophobicContact CD2-CE2 3.96Å; S46-Y51 WeakPolarHBondContact CB-OH 3.38Å; A49-Y51 VanDerWaalsContact C-N 3.26Å; A49-Y51 HydrophobicContact CB-CD1 3.83Å; A49-Y51 HydrophobicContact CB-CD2 4.26Å; A49-Y51 HydrophobicContact CB-CE1 3.41Å; A49-Y51 VanDerWaalsContact CB-CE1 3.41Å; A49-Y51 HydrophobicContact CB-CE2 3.85Å; A49-Y51 HydrophobicContact CB-CG 4.24Å; A49-Y51 VanDerWaalsContact CB-CZ 3.42Å; A49-Y51 PolarHBondContact O-N 3.39Å; Y51-L55 VanDerWaalsContact O-CA 3.27Å; Y51-L55 WeakPolarHBondContact O-CA 3.49Å; Y51-L55 WeakPolarHBondContact O-CB 3.41Å; Y51-L55 PolarHBondContact O-N 3.02Å; Y51-F120 VanDerWaalsContact CB-CZ 3.5Å; Y51-F120 HydrophobicContact CD2-CB 4.11Å; Y51-F120 HydrophobicContact CD2-CD1 4.26Å; Y51-F120 AromaticContact CD2-CD2 3.98Å; Y51-F120 HydrophobicContact CD2-CD2 3.98Å; Y51-F120 AromaticContact CD2-CG 3.84Å; Y51-F120 HydrophobicContact CD2-CG 3.84Å; Y51-F120 HydrophobicContact CE2-CB 4.34Å; Y51-F120 AromaticContact CG-CD1 3.97Å; Y51-F120 HydrophobicContact CG-CD1 3.97Å; Y51-F120 HydrophobicContact CG-CD2 4.3Å; Y51-F120 HydrophobicContact CG-CE1 4.2Å; Y51-F120 HydrophobicContact CG-CG 4.02Å; Y51-F120 HydrophobicContact CG-CZ 4.47Å
52R94.1Very high92.4Very high42 Ų4263.2 Ų63.216%0.15833%0.329CS..Hα-helixtrans-80.8-48.3175.4-178.4-168.8170.4-141.4-3.4110.2D38 L41 N42 S46 S47 A49 D50 N54 L55D38-R52 IonicContact OD1-CZ 3.24Å; D38-R52 VanDerWaalsContact OD1-CZ 3.24Å; D38-R52 IonicContact OD1-NE 2.78Å; D38-R52 PolarHBondContact OD1-NE 3.22Å; D38-R52 IonicContact OD1-NH2 2.79Å; D38-R52 PolarHBondContact OD1-NH2 3.34Å; D38-R52 IonicContact OD2-NH2 2.77Å; D38-R52 PolarHBondContact OD2-NH2 2.99Å; L41-R52 HydrophobicContact CB-CB 4.27Å; L41-R52 HydrophobicContact CB-CG 3.94Å; N42-R52 PolarHBondContact ND2-NH2 3.48Å; N42-R52 PolarHBondContact OD1-NH1 3.05Å; S46-R52 WeakPolarHBondContact O-CD 3.29Å; S47-R52 PolarHBondContact O-NH1 3.05Å; A49-R52 WeakPolarHBondContact O-CB 3.44Å; A49-R52 PolarHBondContact O-N 2.98Å; D50-R52 PolarHBondContact O-N 3.46Å; R52-N54 VanDerWaalsContact C-N 3.34Å; R52-N54 PolarHBondContact O-N 3.23Å; R52-L55 VanDerWaalsContact O-CB 3.31Å; R52-L55 WeakPolarHBondContact O-CB 3.23Å; R52-L55 PolarHBondContact O-N 3.05Å
53I92.7Very high92.5Very high113 Ų11359.1 Ų59.158%0.57931%0.307SS*.Hα-helixtrans-61.2-45.7-179-63.1171.4000110.2A49 D50A49-I53 PolarHBondContact O-N 3.46Å; D50-I53 PolarHBondContact O-N 2.92Å
54N91.8Very high92.5Very high67 Ų6759.3 Ų59.336%0.35831%0.307SS..THydrogen-bonded Turntrans-97.820.9-177.2-70.3-54.5000113.4D50 R52 L56 S57 Y58D50-N54 WeakPolarHBondContact O-CB 3.19Å; D50-N54 PolarHBondContact O-N 3.37Å; D50-N54 PolarHBondContact OD1-ND2 3.12Å; R52-N54 VanDerWaalsContact C-N 3.34Å; R52-N54 PolarHBondContact O-N 3.23Å; N54-L56 PolarHBondContact O-N 3.04Å; N54-S57 WeakPolarHBondContact O-CA 3.26Å; N54-S57 VanDerWaalsContact O-CB 3.32Å; N54-S57 WeakPolarHBondContact O-CB 3.49Å; N54-S57 PolarHBondContact O-N 2.67Å; N54-Y58 HydrophobicContact CB-CD2 4.11Å; N54-Y58 HydrophobicContact CB-CE2 3.96Å; N54-Y58 VanDerWaalsContact O-CD2 3.32Å; N54-Y58 WeakPolarHBondContact O-CD2 3.42Å; N54-Y58 PolarHBondContact O-N 3.28Å
55L93.7Very high92.8Very high1 Ų154.9 Ų54.91%0.00529%0.287CS..Hα-helixtrans-50.8-49.5-173178.666000113.6Y34 F37 L41 Y51 R52 S57 Y58 F59 F120Y34-L55 HydrophobicContact CD2-CD2 4.07Å; Y34-L55 HydrophobicContact CE2-CD2 4.19Å; F37-L55 HydrophobicContact CB-CD2 3.5Å; F37-L55 HydrophobicContact CG-CD2 4.43Å; L41-L55 HydrophobicContact CD1-CD1 3.85Å; L41-L55 HydrophobicContact CD1-CD2 4.1Å; Y51-L55 VanDerWaalsContact O-CA 3.27Å; Y51-L55 WeakPolarHBondContact O-CA 3.49Å; Y51-L55 WeakPolarHBondContact O-CB 3.41Å; Y51-L55 PolarHBondContact O-N 3.02Å; R52-L55 VanDerWaalsContact O-CB 3.31Å; R52-L55 WeakPolarHBondContact O-CB 3.23Å; R52-L55 PolarHBondContact O-N 3.05Å; L55-S57 VanDerWaalsContact C-N 3.28Å; L55-S57 PolarHBondContact O-N 3.07Å; L55-Y58 WeakPolarHBondContact O-CB 3.22Å; L55-Y58 PolarHBondContact O-N 2.9Å; L55-F59 HydrophobicContact CD1-CD1 4.02Å; L55-F59 HydrophobicContact CD1-CE1 3.51Å; L55-F59 HydrophobicContact CD1-CE2 4.22Å; L55-F59 HydrophobicContact CD1-CZ 3.63Å; L55-F59 HydrophobicContact CD2-CE2 4.4Å; L55-F59 HydrophobicContact CD2-CZ 4.42Å; L55-F59 HydrophobicContact CG-CD2 4.49Å; L55-F59 HydrophobicContact CG-CE1 4.31Å; L55-F59 HydrophobicContact CG-CE2 4.21Å; L55-F59 HydrophobicContact CG-CZ 4.12Å; L55-F59 PolarHBondContact O-N 3.33Å; L55-F120 HydrophobicContact CD1-CD2 4.01Å; L55-F120 HydrophobicContact CD1-CE2 3.71Å
56L90.9Very high93.1Very high95 Ų9550.1 Ų50.150%0.49726%0.259SS..Hα-helixtrans-66.2-32.3-177.6-174.359.9000112.1I31 N54 G60I31-L56 HydrophobicContact CG1-CD1 4.29Å; I31-L56 HydrophobicContact CG2-CD1 4.01Å; N54-L56 PolarHBondContact O-N 3.04Å; L56-G60 PolarHBondContact O-N 2.91Å
57S90.2Very high93.3Very high50 Ų5050.4 Ų50.435%0.3526%0.26SS..Hα-helixtrans-64.3-49.4172.3-71.40000110.5N54 L55 F59 G60 F61N54-S57 WeakPolarHBondContact O-CA 3.26Å; N54-S57 VanDerWaalsContact O-CB 3.32Å; N54-S57 WeakPolarHBondContact O-CB 3.49Å; N54-S57 PolarHBondContact O-N 2.67Å; L55-S57 VanDerWaalsContact C-N 3.28Å; L55-S57 PolarHBondContact O-N 3.07Å; S57-F59 VanDerWaalsContact C-N 3.35Å; S57-F59 PolarHBondContact O-N 2.89Å; S57-G60 PolarHBondContact O-N 3.01Å; S57-G60 VanDerWaalsContact O-N 3.12Å; S57-F61 VanDerWaalsContact O-CD2 3.25Å; S57-F61 WeakPolarHBondContact O-CD2 3.48Å; S57-F61 PolarHBondContact O-N 3.48Å
58Y94Very high93.7Very high93 Ų9349.7 Ų49.737%0.36525%0.254SS..Hα-helixtrans-57.7-45.5176.6-79.4-68.2000112.3D50 N54 L55 G60 F61 A62 F120D50-Y58 PolarHBondContact OD2-OH 2.89Å; N54-Y58 HydrophobicContact CB-CD2 4.11Å; N54-Y58 HydrophobicContact CB-CE2 3.96Å; N54-Y58 VanDerWaalsContact O-CD2 3.32Å; N54-Y58 WeakPolarHBondContact O-CD2 3.42Å; N54-Y58 PolarHBondContact O-N 3.28Å; L55-Y58 WeakPolarHBondContact O-CB 3.22Å; L55-Y58 PolarHBondContact O-N 2.9Å; Y58-G60 VanDerWaalsContact C-N 3.33Å; Y58-G60 PolarHBondContact O-N 3.46Å; Y58-F61 PolarHBondContact O-N 3.1Å; Y58-A62 VanDerWaalsContact O-CB 3.24Å; Y58-A62 WeakPolarHBondContact O-CB 3.21Å; Y58-A62 PolarHBondContact O-N 3.49Å; Y58-F120 HydrophobicContact CD1-CZ 4.43Å; Y58-F120 HydrophobicContact CD2-CZ 4.13Å; Y58-F120 AromaticContact CG-CZ 3.96Å; Y58-F120 HydrophobicContact CG-CZ 3.96Å
59F93.9Very high94Very high3 Ų345.7 Ų45.71%0.01324%0.236CC..Hα-helixtrans-58-46.3173.9-77.23.8000111.4W27 F30 F37 L55 S57 F61 A62 A63 T123 I124 V127W27-F59 VanDerWaalsContact CH2-C 3.46Å; W27-F59 HydrophobicContact CH2-CB 3.9Å; W27-F59 WeakPolarHBondContact CH2-O 3.47Å; W27-F59 HydrophobicContact CZ3-CB 4.14Å; F30-F59 HydrophobicContact CB-CD2 4.22Å; F30-F59 HydrophobicContact CB-CE2 4.22Å; F37-F59 HydrophobicContact CD1-CE2 4.39Å; F37-F59 AromaticContact CD1-CZ 3.89Å; F37-F59 HydrophobicContact CD1-CZ 3.89Å; F37-F59 AromaticContact CD2-CE2 3.69Å; F37-F59 HydrophobicContact CD2-CE2 3.69Å; F37-F59 HydrophobicContact CD2-CZ 4.04Å; F37-F59 HydrophobicContact CE1-CE2 4.48Å; F37-F59 HydrophobicContact CE1-CZ 4.01Å; F37-F59 AromaticContact CE2-CE2 3.83Å; F37-F59 HydrophobicContact CE2-CE2 3.83Å; F37-F59 HydrophobicContact CE2-CZ 4.19Å; F37-F59 HydrophobicContact CG-CE2 4.01Å; F37-F59 AromaticContact CG-CZ 3.91Å; F37-F59 HydrophobicContact CG-CZ 3.91Å; F37-F59 HydrophobicContact CZ-CE2 4.22Å; F37-F59 HydrophobicContact CZ-CZ 4.16Å; L55-F59 HydrophobicContact CD1-CD1 4.02Å; L55-F59 HydrophobicContact CD1-CE1 3.51Å; L55-F59 HydrophobicContact CD1-CE2 4.22Å; L55-F59 HydrophobicContact CD1-CZ 3.63Å; L55-F59 HydrophobicContact CD2-CE2 4.4Å; L55-F59 HydrophobicContact CD2-CZ 4.42Å; L55-F59 HydrophobicContact CG-CD2 4.49Å; L55-F59 HydrophobicContact CG-CE1 4.31Å; L55-F59 HydrophobicContact CG-CE2 4.21Å; L55-F59 HydrophobicContact CG-CZ 4.12Å; L55-F59 PolarHBondContact O-N 3.33Å; S57-F59 VanDerWaalsContact C-N 3.35Å; S57-F59 PolarHBondContact O-N 2.89Å; F59-F61 PolarHBondContact O-N 3.37Å; F59-A62 PolarHBondContact O-N 2.92Å; F59-A63 VanDerWaalsContact O-CB 3.24Å; F59-A63 WeakPolarHBondContact O-CB 3.3Å; F59-A63 PolarHBondContact O-N 3.48Å; F59-T123 HydrophobicContact CE1-CG2 3.88Å; F59-T123 HydrophobicContact CZ-CG2 3.82Å; F59-I124 HydrophobicContact CD1-CD1 3.67Å; F59-I124 HydrophobicContact CE1-CD1 3.88Å; F59-V127 HydrophobicContact CD1-CG2 4.34Å; F59-V127 HydrophobicContact CE1-CG2 4.37Å
60G92.1Very high94.1Very high14 Ų1448 Ų4814%0.14424%0.242CC..Hα-helixtrans-56.9-45.7177.500000113L56 S57 Y58 A63 Q64L56-G60 PolarHBondContact O-N 2.91Å; S57-G60 PolarHBondContact O-N 3.01Å; S57-G60 VanDerWaalsContact O-N 3.12Å; Y58-G60 VanDerWaalsContact C-N 3.33Å; Y58-G60 PolarHBondContact O-N 3.46Å; G60-A63 PolarHBondContact O-N 3.22Å; G60-Q64 WeakPolarHBondContact O-CB 3.44Å; G60-Q64 VanDerWaalsContact O-CG 3.3Å; G60-Q64 WeakPolarHBondContact O-CG 3.39Å; G60-Q64 PolarHBondContact O-N 2.99Å
61F90.6Very high94.2Very high85 Ų8544 Ų4437%0.37322%0.221SC..Hα-helixtrans-65-49.4176-84.5-85.4000112.5S57 Y58 F59 A63 F65 Y549 R552S57-F61 VanDerWaalsContact O-CD2 3.25Å; S57-F61 WeakPolarHBondContact O-CD2 3.48Å; S57-F61 PolarHBondContact O-N 3.48Å; Y58-F61 PolarHBondContact O-N 3.1Å; F59-F61 PolarHBondContact O-N 3.37Å; F61-A63 PolarHBondContact O-N 3.48Å; F61-A63 VanDerWaalsContact O-N 3.16Å; F61-F65 PolarHBondContact O-N 3.16Å; F61-Y549 HydrophobicContact CD1-CE1 4.12Å; F61-Y549 AromaticContact CD1-CZ 3.93Å; F61-Y549 WeakPolarHBondContact CD1-OH 3.21Å; F61-Y549 AromaticContact CE1-CE1 3.26Å; F61-Y549 HydrophobicContact CE1-CE1 3.26Å; F61-Y549 AromaticContact CE1-CZ 3.54Å; F61-Y549 WeakPolarHBondContact CE1-OH 3.32Å; F61-Y549 AromaticContact CZ-CE1 3.56Å; F61-Y549 HydrophobicContact CZ-CE1 3.56Å; F61-R552 VanDerWaalsContact CE2-CZ 3.47Å
62A95.2Very high94.3Very high10 Ų1042.9 Ų42.98%0.08322%0.221CC..Hα-helixtrans-61.3-21.6179.200000112.4Y58 F59 P66 I124 V127 V128Y58-A62 VanDerWaalsContact O-CB 3.24Å; Y58-A62 WeakPolarHBondContact O-CB 3.21Å; Y58-A62 PolarHBondContact O-N 3.49Å; F59-A62 PolarHBondContact O-N 2.92Å; A62-P66 VanDerWaalsContact O-CD 3.24Å; A62-P66 WeakPolarHBondContact O-CD 3.49Å; A62-P66 WeakPolarHBondContact O-CG 3.37Å; A62-I124 HydrophobicContact CB-CD1 4.28Å; A62-I124 HydrophobicContact CB-CG2 4.17Å; A62-V127 HydrophobicContact CB-CB 4.22Å; A62-V127 HydrophobicContact CB-CG1 3.7Å; A62-V128 HydrophobicContact CB-CG2 3.91Å; A62-V128 WeakPolarHBondContact O-CA 3.29Å
63A95.1Very high94.2Very high0 Ų047 Ų470%024%0.237CC..Hα-helixtrans-91.7-55.8176.500000113.9W27 F59 G60 F61 S67 V127 N131W27-A63 HydrophobicContact CD2-CB 3.74Å; W27-A63 HydrophobicContact CE3-CB 3.51Å; W27-A63 HydrophobicContact CH2-CB 3.3Å; W27-A63 HydrophobicContact CZ2-CB 3.48Å; W27-A63 VanDerWaalsContact CZ2-CB 3.48Å; W27-A63 HydrophobicContact CZ3-CB 3.32Å; F59-A63 VanDerWaalsContact O-CB 3.24Å; F59-A63 WeakPolarHBondContact O-CB 3.3Å; F59-A63 PolarHBondContact O-N 3.48Å; G60-A63 PolarHBondContact O-N 3.22Å; F61-A63 PolarHBondContact O-N 3.48Å; F61-A63 VanDerWaalsContact O-N 3.16Å; A63-S67 VanDerWaalsContact O-CB 3.29Å; A63-S67 WeakPolarHBondContact O-CB 3.43Å; A63-S67 PolarHBondContact O-N 2.94Å; A63-V127 HydrophobicContact CB-CG1 4.22Å; A63-N131 WeakPolarHBondContact CA-ND2 3.36Å; A63-N131 HydrophobicContact CB-CB 4.2Å; A63-N131 VanDerWaalsContact CB-ND2 3.29Å; A63-N131 WeakPolarHBondContact CB-ND2 3.48Å; A63-N131 WeakPolarHBondContact CB-OD1 3.34Å; A63-N131 VanDerWaalsContact O-CB 3.25Å; A63-N131 WeakPolarHBondContact O-CB 2.97Å
64Q93.9Very high94.2Very high25 Ų2541.7 Ų41.712%0.11721%0.21CC..Hα-helixtrans-71.4-39.2-168.3-61.1-52.3-34.700112.5G60 L68 F545G60-Q64 WeakPolarHBondContact O-CB 3.44Å; G60-Q64 VanDerWaalsContact O-CG 3.3Å; G60-Q64 WeakPolarHBondContact O-CG 3.39Å; G60-Q64 PolarHBondContact O-N 2.99Å; Q64-L68 WeakPolarHBondContact O-CB 3.37Å; Q64-L68 PolarHBondContact O-N 3.48Å; Q64-F545 HydrophobicContact CB-CD2 4.13Å
65F95Very high94.2Very high115 Ų11538.5 Ų38.550%0.50419%0.193SC..Hα-helixtrans-67.4-50.3-177.7-179-97.9000112.3F61 S67 L68 C69 F545F61-F65 PolarHBondContact O-N 3.16Å; F65-S67 PolarHBondContact O-N 3.17Å; F65-L68 PolarHBondContact O-N 2.86Å; F65-C69 PolarHBondContact O-N 2.99Å; F65-C69 PolarHBondContact O-SG 3.06Å; F65-C69 VanDerWaalsContact O-SG 3.35Å; F65-F545 HydrophobicContact CB-CE2 4.07Å; F65-F545 AromaticContact CD2-CE2 3.85Å; F65-F545 HydrophobicContact CD2-CE2 3.85Å; F65-F545 HydrophobicContact CD2-CZ 4.19Å; F65-F545 HydrophobicContact CG-CE2 4.48Å
66P96.7Very high94Very high13 Ų1340.9 Ų40.98%0.08420%0.203CC..Hα-helixtrans-64.3-38.9176.8-24.638.1000113.2A62 L68 C69 F70 V128 S132A62-P66 VanDerWaalsContact O-CD 3.24Å; A62-P66 WeakPolarHBondContact O-CD 3.49Å; A62-P66 WeakPolarHBondContact O-CG 3.37Å; P66-L68 VanDerWaalsContact C-N 3.32Å; P66-L68 PolarHBondContact O-N 3.14Å; P66-C69 PolarHBondContact O-N 3.4Å; P66-F70 WeakPolarHBondContact O-CB 3.44Å; P66-F70 WeakPolarHBondContact O-CD2 3.38Å; P66-F70 PolarHBondContact O-N 3.35Å; P66-V128 HydrophobicContact CB-CG1 4.17Å; P66-V128 HydrophobicContact CG-CB 4.23Å; P66-V128 HydrophobicContact CG-CG1 3.79Å; P66-V128 HydrophobicContact CG-CG2 4.13Å; P66-S132 WeakPolarHBondContact CB-OG 3.21Å
67S97Very high93.5Very high5 Ų539.6 Ų39.64%0.03519%0.192CC..Hα-helixtrans-57-45.9174.7-178.50000111.4A63 F65 A71 N131A63-S67 VanDerWaalsContact O-CB 3.29Å; A63-S67 WeakPolarHBondContact O-CB 3.43Å; A63-S67 PolarHBondContact O-N 2.94Å; F65-S67 PolarHBondContact O-N 3.17Å; S67-A71 WeakPolarHBondContact O-CB 3.34Å; S67-A71 PolarHBondContact O-N 3.41Å; S67-N131 VanDerWaalsContact CA-O 3.26Å; S67-N131 WeakPolarHBondContact CA-O 3.47Å; S67-N131 WeakPolarHBondContact CB-O 3.5Å
68L97.5Very high92.7Very high22 Ų2239.3 Ų39.312%0.11519%0.185CC..Hα-helixtrans-62.1-47.9175.9-179.163.2000112.3Q64 F65 P66 F70 A71 A72 F538 I541 L542 F545Q64-L68 WeakPolarHBondContact O-CB 3.37Å; Q64-L68 PolarHBondContact O-N 3.48Å; F65-L68 PolarHBondContact O-N 2.86Å; P66-L68 VanDerWaalsContact C-N 3.32Å; P66-L68 PolarHBondContact O-N 3.14Å; L68-F70 PolarHBondContact O-N 3.06Å; L68-A71 PolarHBondContact O-N 3.47Å; L68-A72 WeakPolarHBondContact O-CB 3.25Å; L68-A72 PolarHBondContact O-N 3.48Å; L68-F538 HydrophobicContact CD1-CD2 4.17Å; L68-F538 HydrophobicContact CD1-CE2 3.62Å; L68-F538 HydrophobicContact CD1-CZ 4.41Å; L68-I541 HydrophobicContact CB-CG2 4.02Å; L68-I541 HydrophobicContact CD1-CG2 4.12Å; L68-L542 HydrophobicContact CD1-CB 4.08Å; L68-L542 HydrophobicContact CD1-CD1 4.14Å; L68-L542 HydrophobicContact CD2-CD1 4.17Å; L68-F545 HydrophobicContact CD2-CB 4.09Å; L68-F545 HydrophobicContact CD2-CD1 3.8Å; L68-F545 HydrophobicContact CD2-CD2 3.91Å; L68-F545 HydrophobicContact CD2-CE1 4.2Å; L68-F545 HydrophobicContact CD2-CE2 4.3Å; L68-F545 HydrophobicContact CD2-CG 3.66Å; L68-F545 HydrophobicContact CD2-CZ 4.44Å
69C97.2Very high90.8Very high53 Ų5336.4 Ų36.436%0.35818%0.178SC..Hα-helixtrans-60.4-45.8-179.7-69.50000112.1F65 P66 A72 W73F65-C69 PolarHBondContact O-N 2.99Å; F65-C69 PolarHBondContact O-SG 3.06Å; F65-C69 VanDerWaalsContact O-SG 3.35Å; P66-C69 PolarHBondContact O-N 3.4Å; C69-A72 WeakPolarHBondContact O-CB 3.48Å; C69-A72 PolarHBondContact O-N 2.94Å; C69-W73 PolarHBondContact O-N 3.19Å
70F96.6Very high88.8Confident69 Ų6938 Ų3830%0.30320%0.196SC..Hα-helixtrans-78.8-28.8-177.9-81.9-105000112.7P66 L68 W73 N74 S132 I136P66-F70 WeakPolarHBondContact O-CB 3.44Å; P66-F70 WeakPolarHBondContact O-CD2 3.38Å; P66-F70 PolarHBondContact O-N 3.35Å; L68-F70 PolarHBondContact O-N 3.06Å; F70-W73 AromaticContact CD1-CE3 3.61Å; F70-W73 HydrophobicContact CD1-CE3 3.61Å; F70-W73 AromaticContact CD1-CZ3 3.93Å; F70-W73 HydrophobicContact CD1-CZ3 3.93Å; F70-W73 AromaticContact CE1-CE3 3.65Å; F70-W73 HydrophobicContact CE1-CE3 3.65Å; F70-W73 AromaticContact CE1-CZ3 3.54Å; F70-W73 HydrophobicContact CE1-CZ3 3.54Å; F70-W73 HydrophobicContact CG-CE3 4.42Å; F70-W73 HydrophobicContact CZ-CE3 4.46Å; F70-W73 HydrophobicContact CZ-CZ3 4.39Å; F70-W73 PolarHBondContact O-N 3.36Å; F70-N74 VanDerWaalsContact O-CB 3.27Å; F70-N74 WeakPolarHBondContact O-CB 3.18Å; F70-N74 PolarHBondContact O-N 3.08Å; F70-S132 WeakPolarHBondContact CB-O 3.35Å; F70-S132 WeakPolarHBondContact CD2-OG 3.37Å; F70-S132 WeakPolarHBondContact CE2-OG 3.14Å; F70-I136 HydrophobicContact CB-CD1 4.47Å; F70-I136 HydrophobicContact CB-CG1 4.17Å; F70-I136 HydrophobicContact CD1-CD1 3.84Å; F70-I136 HydrophobicContact CD1-CG1 4.44Å
71A96.6Very high86.2Confident0 Ų039.3 Ų39.30%020%0.203CC..Hα-helixtrans-63.7-42.716700000111.7S67 L68 N74 T75 T139 F538 I541S67-A71 WeakPolarHBondContact O-CB 3.34Å; S67-A71 PolarHBondContact O-N 3.41Å; L68-A71 PolarHBondContact O-N 3.47Å; A71-N74 PolarHBondContact O-N 3.37Å; A71-T75 VanDerWaalsContact O-CB 3.27Å; A71-T75 WeakPolarHBondContact O-CB 3.12Å; A71-T75 PolarHBondContact O-N 3.02Å; A71-T75 PolarHBondContact O-OG1 3.49Å; A71-T139 HydrophobicContact CB-CG2 3.75Å; A71-F538 HydrophobicContact CB-CD2 4.43Å; A71-I541 HydrophobicContact CB-CD1 3.45Å; A71-I541 VanDerWaalsContact CB-CD1 3.45Å
72A95.5Very high83.8Confident25 Ų2541.2 Ų41.221%0.20722%0.221CC..Hα-helixtrans-62.4-48.6173.500000110.6L68 C69 N74 T75 F76 F538L68-A72 WeakPolarHBondContact O-CB 3.25Å; L68-A72 PolarHBondContact O-N 3.48Å; C69-A72 WeakPolarHBondContact O-CB 3.48Å; C69-A72 PolarHBondContact O-N 2.94Å; A72-N74 VanDerWaalsContact C-N 3.29Å; A72-N74 PolarHBondContact O-N 3.18Å; A72-T75 PolarHBondContact O-N 2.85Å; A72-F76 HydrophobicContact CB-CD2 4.26Å; A72-F76 WeakPolarHBondContact O-CB 3.33Å; A72-F76 VanDerWaalsContact O-CD2 3.27Å; A72-F76 WeakPolarHBondContact O-CD2 3.3Å; A72-F76 PolarHBondContact O-N 2.78Å; A72-F538 HydrophobicContact CB-CD2 4.16Å; A72-F538 HydrophobicContact CB-CE2 3.71Å
73W92.6Very high80.9Confident130 Ų13045.8 Ų45.849%0.49225%0.248SC..Hα-helixtrans-56.8-44.8176.5-177.725.8000111.3C69 F70 Y77C69-W73 PolarHBondContact O-N 3.19Å; F70-W73 AromaticContact CD1-CE3 3.61Å; F70-W73 HydrophobicContact CD1-CE3 3.61Å; F70-W73 AromaticContact CD1-CZ3 3.93Å; F70-W73 HydrophobicContact CD1-CZ3 3.93Å; F70-W73 AromaticContact CE1-CE3 3.65Å; F70-W73 HydrophobicContact CE1-CE3 3.65Å; F70-W73 AromaticContact CE1-CZ3 3.54Å; F70-W73 HydrophobicContact CE1-CZ3 3.54Å; F70-W73 HydrophobicContact CG-CE3 4.42Å; F70-W73 HydrophobicContact CZ-CE3 4.46Å; F70-W73 HydrophobicContact CZ-CZ3 4.39Å; F70-W73 PolarHBondContact O-N 3.36Å; W73-Y77 AromaticContact CD1-CD2 3.57Å; W73-Y77 AromaticContact CD1-CG 3.79Å; W73-Y77 WeakPolarHBondContact O-CA 3.23Å; W73-Y77 VanDerWaalsContact O-CB 3.25Å; W73-Y77 WeakPolarHBondContact O-CB 3.47Å; W73-Y77 PolarHBondContact O-N 3.38Å
74N92.2Very high78.6Confident0 Ų048.1 Ų48.10%026%0.264CS..Hα-helixtrans-66.1-40.8179-17171.2000114.2F70 A71 A72 R89 I136 T139F70-N74 VanDerWaalsContact O-CB 3.27Å; F70-N74 WeakPolarHBondContact O-CB 3.18Å; F70-N74 PolarHBondContact O-N 3.08Å; A71-N74 PolarHBondContact O-N 3.37Å; A72-N74 VanDerWaalsContact C-N 3.29Å; A72-N74 PolarHBondContact O-N 3.18Å; N74-R89 PolarHBondContact OD1-NE 3.38Å; N74-R89 PolarHBondContact OD1-NH1 3.34Å; N74-R89 VanDerWaalsContact OD1-NH1 3.15Å; N74-R89 PolarHBondContact OD1-NH2 3.15Å; N74-I136 HydrophobicContact CB-CG1 4.2Å; N74-T139 PolarHBondContact ND2-OG1 3.49Å
75T92.4Very high77.4Confident0 Ų048.7 Ų48.70%027%0.27CS..Hα-helixtrans-71.6-53.1-177.9-58.20000111A71 A72 Q78 Y384 M534 F535 F538A71-T75 VanDerWaalsContact O-CB 3.27Å; A71-T75 WeakPolarHBondContact O-CB 3.12Å; A71-T75 PolarHBondContact O-N 3.02Å; A71-T75 PolarHBondContact O-OG1 3.49Å; A72-T75 PolarHBondContact O-N 2.85Å; T75-Q78 PolarHBondContact O-NE2 2.9Å; T75-Y384 VanDerWaalsContact O-CE1 3.29Å; T75-Y384 WeakPolarHBondContact O-CE1 3.41Å; T75-Y384 PolarHBondContact O-OH 3.35Å; T75-M534 HydrophobicContact CG2-CB 3.95Å; T75-F535 HydrophobicContact CG2-CD1 3.47Å; T75-F535 VanDerWaalsContact CG2-CD1 3.47Å; T75-F535 HydrophobicContact CG2-CE1 3.7Å; T75-F535 HydrophobicContact CG2-CG 4.26Å; T75-F538 HydrophobicContact CG2-CB 4.42Å
76F89Confident76.6Confident52 Ų5246.6 Ų46.623%0.22827%0.268CS..Hα-helixtrans-82.7-17.3-172.6-67.2-75.4000114.5A72 Y380 W381 Y384 F535 F538A72-F76 HydrophobicContact CB-CD2 4.26Å; A72-F76 WeakPolarHBondContact O-CB 3.33Å; A72-F76 VanDerWaalsContact O-CD2 3.27Å; A72-F76 WeakPolarHBondContact O-CD2 3.3Å; A72-F76 PolarHBondContact O-N 2.78Å; F76-Y380 PolarHBondContact O-OH 3.32Å; F76-W381 HydrophobicContact CD1-CZ3 4.39Å; F76-Y384 HydrophobicContact CD1-CD1 4.06Å; F76-Y384 HydrophobicContact CD1-CE1 4.4Å; F76-Y384 PolarHBondContact O-OH 2.91Å; F76-F535 HydrophobicContact CD1-CE1 4.13Å; F76-F535 AromaticContact CE1-CE1 3.5Å; F76-F535 HydrophobicContact CE1-CE1 3.5Å; F76-F535 VanDerWaalsContact CE1-CE1 3.5Å; F76-F535 HydrophobicContact CE1-CZ 4.18Å; F76-F535 HydrophobicContact CZ-CD1 4.39Å; F76-F535 AromaticContact CZ-CE1 3.77Å; F76-F535 HydrophobicContact CZ-CE1 3.77Å; F76-F538 HydrophobicContact CE2-CD1 4.2Å; F76-F538 AromaticContact CE2-CE1 3.95Å; F76-F538 HydrophobicContact CE2-CE1 3.95Å; F76-F538 HydrophobicContact CE2-CE2 4.47Å; F76-F538 HydrophobicContact CE2-CZ 4.09Å; F76-F538 HydrophobicContact CZ-CD1 4.48Å; F76-F538 HydrophobicContact CZ-CE1 4.23Å
77Y80.7Confident75.9Confident67 Ų6752.7 Ų52.726%0.26329%0.289SS..  trans-120.478.8179-57.6-91.9000110.7W73 R89 F359W73-Y77 AromaticContact CD1-CD2 3.57Å; W73-Y77 AromaticContact CD1-CG 3.79Å; W73-Y77 WeakPolarHBondContact O-CA 3.23Å; W73-Y77 VanDerWaalsContact O-CB 3.25Å; W73-Y77 WeakPolarHBondContact O-CB 3.47Å; W73-Y77 PolarHBondContact O-N 3.38Å; Y77-R89 PolarHBondContact O-NH1 2.71Å; Y77-F359 HydrophobicContact CD1-CB 4.39Å; Y77-F359 HydrophobicContact CE1-CB 3.85Å; Y77-F359 AromaticContact CE1-CD2 3.5Å; Y77-F359 HydrophobicContact CE1-CD2 3.5Å; Y77-F359 VanDerWaalsContact CE1-CD2 3.5Å; Y77-F359 HydrophobicContact CE1-CE2 4.25Å; Y77-F359 AromaticContact CE1-CG 3.8Å; Y77-F359 HydrophobicContact CE1-CG 3.8Å; Y77-F359 AromaticContact CZ-CD2 3.78Å; Y77-F359 VanDerWaalsContact OH-CD2 3.25Å; Y77-F359 WeakPolarHBondContact OH-CD2 3.41Å; Y77-F359 VanDerWaalsContact OH-CE2 3.24Å; Y77-F359 WeakPolarHBondContact OH-CE2 3.43Å
78Q73.4Confident75.4Confident45 Ų4558.6 Ų58.621%0.2131%0.314CS..  trans-96.4109.2168.6-64.8177.639.500108T75 G80 Y384 M534T75-Q78 PolarHBondContact O-NE2 2.9Å; Q78-G80 PolarHBondContact O-N 2.79Å; Q78-Y384 PolarHBondContact N-OH 3.14Å; Q78-M534 HydrophobicContact CG-SD 4.46Å; Q78-M534 PolarHBondContact NE2-SD 3.31Å
79S52.8Low75Confident31 Ų3159.4 Ų59.422%0.21732%0.316CS..  trans-67120.5176.1-163.80000109.5S81 S354S79-S81 PolarHBondContact O-N 2.81Å; S79-S81 WeakPolarHBondContact OG-CB 3.49Å; S79-S81 PolarHBondContact OG-N 2.67Å; S79-S354 WeakPolarHBondContact OG-CB 3.34Å
80G51.9Low74.7Confident37 Ų3757 Ų5738%0.38130%0.299SS..  trans-70.9-1.8161.300000113.2Q78 V82Q78-G80 PolarHBondContact O-N 2.79Å; G80-V82 PolarHBondContact O-N 3.28Å
81S38.1Very low74.5Confident42 Ų4256.1 Ų56.129%0.29430%0.297SS..SBendtrans-67.4130.3176.2-172.30000110.3S79 T83 S84S79-S81 PolarHBondContact O-N 2.81Å; S79-S81 WeakPolarHBondContact OG-CB 3.49Å; S79-S81 PolarHBondContact OG-N 2.67Å; S81-T83 PolarHBondContact O-N 2.87Å; S81-T83 PolarHBondContact OG-OG1 2.84Å; S81-S84 PolarHBondContact O-N 3.49Å; S81-S84 VanDerWaalsContact O-N 3.17Å
82V39.9Very low74.3Confident125 Ų12557.8 Ų57.876%0.75832%0.315SS*.THydrogen-bonded Turntrans-44.2-25.6173.7-172.90000113.3G80G80-V82 PolarHBondContact O-N 3.28Å
83T34.3Very low74.3Confident106 Ų10657 Ų5765%0.6531%0.308SS*.THydrogen-bonded Turntrans-87.8-29.7-17551.80000116.3S81S81-T83 PolarHBondContact O-N 2.87Å; S81-T83 PolarHBondContact OG-OG1 2.84Å
84S47Very low74.3Confident48 Ų4850.8 Ų50.834%0.33628%0.284SS..SBendtrans-111.673.2-178.8-1700000110.4S81S81-S84 PolarHBondContact O-N 3.49Å; S81-S84 VanDerWaalsContact O-N 3.17Å
85T69.7Low74.5Confident38 Ų3854.9 Ų54.923%0.23331%0.305CS..  trans-75.6149.117668.80000110.4R87 F88 R89T85-R87 PolarHBondContact O-N 3.08Å; T85-F88 HydrophobicContact CG2-CD2 4.49Å; T85-F88 PolarHBondContact O-N 2.91Å; T85-F88 WeakPolarHBondContact OG1-CD2 3.43Å; T85-R89 PolarHBondContact O-N 3.29Å
86P77.5Confident74.7Confident70 Ų7057.3 Ų57.346%0.45532%0.32SS..Hα-helixtrans-47.2-27.3170.5-31.837000114.4F90 L140P86-F90 WeakPolarHBondContact O-CB 3.07Å; P86-F90 PolarHBondContact O-N 2.97Å; P86-L140 HydrophobicContact CB-CD2 3.99Å
87R82.5Confident75Confident141 Ų14154.9 Ų54.953%0.53231%0.309SS..Hα-helixtrans-65-47.4176.1-57.1-175.9177.3121-0.2113.3T85 R89 F90 L91 F210T85-R87 PolarHBondContact O-N 3.08Å; R87-R89 VanDerWaalsContact C-N 3.3Å; R87-R89 PolarHBondContact O-N 3.49Å; R87-F90 PolarHBondContact O-N 3.29Å; R87-L91 WeakPolarHBondContact O-CB 3.32Å; R87-L91 PolarHBondContact O-N 3.43Å; R87-F210 HydrophobicContact CB-CE1 4.3Å; R87-F210 HydrophobicContact CB-CZ 4.38Å; R87-F210 HydrophobicContact CG-CE1 4.48Å; R87-F210 HydrophobicContact CG-CZ 4.34Å
88F86.4Confident75.8Confident129 Ų12953.4 Ų53.457%0.56631%0.306SS*.Hα-helixtrans-65.9-37.4179.4-71.7-60.7000111.6T85 L91 G92T85-F88 HydrophobicContact CG2-CD2 4.49Å; T85-F88 PolarHBondContact O-N 2.91Å; T85-F88 WeakPolarHBondContact OG1-CD2 3.43Å; F88-L91 PolarHBondContact O-N 3.13Å; F88-G92 PolarHBondContact O-N 3.5Å
89R89.2Confident76.9Confident39 Ų3956.4 Ų56.415%0.14732%0.322CS..Hα-helixtrans-63.3-47.2176-60.6175.369.1158.422.4111.3N74 Y77 T85 R87 G92 C93 L140N74-R89 PolarHBondContact OD1-NE 3.38Å; N74-R89 PolarHBondContact OD1-NH1 3.34Å; N74-R89 VanDerWaalsContact OD1-NH1 3.15Å; N74-R89 PolarHBondContact OD1-NH2 3.15Å; Y77-R89 PolarHBondContact O-NH1 2.71Å; T85-R89 PolarHBondContact O-N 3.29Å; R87-R89 VanDerWaalsContact C-N 3.3Å; R87-R89 PolarHBondContact O-N 3.49Å; R89-G92 PolarHBondContact O-N 2.77Å; R89-C93 PolarHBondContact O-N 2.88Å; R89-C93 VanDerWaalsContact O-N 3.07Å; R89-C93 PolarHBondContact O-SG 3.25Å; R89-C93 VanDerWaalsContact O-SG 3.33Å; R89-L140 HydrophobicContact CB-CD1 3.99Å
90F90.4Very high79.1Confident2 Ų255.3 Ų55.31%0.00931%0.314CS..Hα-helixtrans-58.4-49.9176.5-165.7-81000111.8H19 P86 R87 G92 C93 M94 H137 L140 F210H19-F90 AromaticContact CE1-CZ 3.39Å; H19-F90 WeakPolarHBondContact CE1-CZ 3.4Å; H19-F90 AromaticContact ND1-CZ 3.63Å; P86-F90 WeakPolarHBondContact O-CB 3.07Å; P86-F90 PolarHBondContact O-N 2.97Å; R87-F90 PolarHBondContact O-N 3.29Å; F90-G92 PolarHBondContact O-N 3.07Å; F90-C93 PolarHBondContact O-N 3.02Å; F90-M94 HydrophobicContact CD1-CG 3.88Å; F90-M94 HydrophobicContact CE1-CE 3.68Å; F90-M94 HydrophobicContact CE1-CG 3.68Å; F90-M94 HydrophobicContact CE1-SD 4.03Å; F90-M94 HydrophobicContact CZ-CE 3.67Å; F90-M94 VanDerWaalsContact O-CG 3.29Å; F90-M94 WeakPolarHBondContact O-CG 3.33Å; F90-M94 PolarHBondContact O-N 3.31Å; F90-M94 VanDerWaalsContact O-N 3.09Å; F90-H137 AromaticContact CE2-CD2 3.29Å; F90-H137 WeakPolarHBondContact CE2-CD2 3.49Å; F90-H137 AromaticContact CE2-NE2 3.78Å; F90-H137 AromaticContact CZ-CD2 3.53Å; F90-H137 AromaticContact CZ-NE2 3.61Å; F90-L140 HydrophobicContact CB-CD1 3.85Å; F90-L140 HydrophobicContact CD2-CB 4.05Å; F90-L140 HydrophobicContact CD2-CD1 4.08Å; F90-L140 HydrophobicContact CG-CD1 4.46Å; F90-F210 HydrophobicContact CB-CD2 4.5Å; F90-F210 HydrophobicContact CB-CE1 4Å; F90-F210 HydrophobicContact CB-CE2 3.85Å; F90-F210 HydrophobicContact CB-CZ 3.55Å; F90-F210 HydrophobicContact CD1-CB 4Å; F90-F210 AromaticContact CD1-CD1 3.65Å; F90-F210 HydrophobicContact CD1-CD1 3.65Å; F90-F210 AromaticContact CD1-CD2 3.49Å; F90-F210 HydrophobicContact CD1-CD2 3.49Å; F90-F210 VanDerWaalsContact CD1-CD2 3.49Å; F90-F210 AromaticContact CD1-CE1 3.89Å; F90-F210 HydrophobicContact CD1-CE1 3.89Å; F90-F210 AromaticContact CD1-CE2 3.72Å; F90-F210 HydrophobicContact CD1-CE2 3.72Å; F90-F210 AromaticContact CD1-CG 3.43Å; F90-F210 HydrophobicContact CD1-CG 3.43Å; F90-F210 VanDerWaalsContact CD1-CG 3.43Å; F90-F210 AromaticContact CD1-CZ 3.9Å; F90-F210 HydrophobicContact CD1-CZ 3.9Å; F90-F210 AromaticContact CD2-CD2 3.75Å; F90-F210 HydrophobicContact CD2-CD2 3.75Å; F90-F210 AromaticContact CD2-CE2 3.51Å; F90-F210 HydrophobicContact CD2-CE2 3.51Å; F90-F210 HydrophobicContact CD2-CZ 4.15Å; F90-F210 HydrophobicContact CE1-CB 3.5Å; F90-F210 HydrophobicContact CE1-CD1 4.09Å; F90-F210 AromaticContact CE1-CD2 3.48Å; F90-F210 HydrophobicContact CE1-CD2 3.48Å; F90-F210 VanDerWaalsContact CE1-CD2 3.48Å; F90-F210 HydrophobicContact CE1-CE2 4.15Å; F90-F210 AromaticContact CE1-CG 3.42Å; F90-F210 HydrophobicContact CE1-CG 3.42Å; F90-F210 VanDerWaalsContact CE1-CG 3.42Å; F90-F210 AromaticContact CE2-CD2 3.7Å; F90-F210 HydrophobicContact CE2-CD2 3.7Å; F90-F210 AromaticContact CE2-CE2 3.92Å; F90-F210 HydrophobicContact CE2-CE2 3.92Å; F90-F210 HydrophobicContact CE2-CG 4.48Å; F90-F210 HydrophobicContact CG-CD1 4.23Å; F90-F210 AromaticContact CG-CD2 3.64Å; F90-F210 HydrophobicContact CG-CD2 3.64Å; F90-F210 HydrophobicContact CG-CE1 4.03Å; F90-F210 AromaticContact CG-CE2 3.39Å; F90-F210 HydrophobicContact CG-CE2 3.39Å; F90-F210 HydrophobicContact CG-CG 4.04Å; F90-F210 AromaticContact CG-CZ 3.6Å; F90-F210 HydrophobicContact CG-CZ 3.6Å; F90-F210 HydrophobicContact CZ-CB 4.05Å; F90-F210 AromaticContact CZ-CD2 3.59Å; F90-F210 HydrophobicContact CZ-CD2 3.59Å; F90-F210 HydrophobicContact CZ-CE2 4.24Å; F90-F210 AromaticContact CZ-CG 3.99Å; F90-F210 HydrophobicContact CZ-CG 3.99Å
91L91.6Very high81.2Confident51 Ų5153.6 Ų53.627%0.26730%0.296SS..Hα-helixtrans-63.4-42.3-179.9-177.463.1000112.1R87 F88 C93 M94 I95 T207 F211R87-L91 WeakPolarHBondContact O-CB 3.32Å; R87-L91 PolarHBondContact O-N 3.43Å; F88-L91 PolarHBondContact O-N 3.13Å; L91-C93 PolarHBondContact O-N 2.68Å; L91-M94 PolarHBondContact O-N 3.26Å; L91-I95 HydrophobicContact CD1-CD1 4.18Å; L91-I95 HydrophobicContact CD1-CG1 4.44Å; L91-I95 HydrophobicContact CG-CD1 3.93Å; L91-I95 WeakPolarHBondContact O-CG1 3.48Å; L91-I95 PolarHBondContact O-N 3.47Å; L91-T207 HydrophobicContact CD1-CG2 4.18Å; L91-F211 HydrophobicContact CD1-CE2 4.01Å; L91-F211 HydrophobicContact CD1-CZ 4.01Å; L91-F211 HydrophobicContact CD2-CZ 4.19Å
92G93.1Very high84Confident35 Ų3554.7 Ų54.736%0.36130%0.301SS..Hα-helixtrans-58.9-45.5176.800000112.2F88 R89 F90 I95 V96F88-G92 PolarHBondContact O-N 3.5Å; R89-G92 PolarHBondContact O-N 2.77Å; F90-G92 PolarHBondContact O-N 3.07Å; G92-I95 PolarHBondContact O-N 2.61Å; G92-V96 VanDerWaalsContact O-CG2 3.3Å; G92-V96 WeakPolarHBondContact O-CG2 3.25Å; G92-V96 PolarHBondContact O-N 3.37Å
93C95Very high86.7Confident9 Ų952 Ų526%0.06128%0.281CS..Hα-helixtrans-63.2-44.9177.2-68.80000112.5R89 F90 L91 I95 V96 E97 C133 I136R89-C93 PolarHBondContact O-N 2.88Å; R89-C93 VanDerWaalsContact O-N 3.07Å; R89-C93 PolarHBondContact O-SG 3.25Å; R89-C93 VanDerWaalsContact O-SG 3.33Å; F90-C93 PolarHBondContact O-N 3.02Å; L91-C93 PolarHBondContact O-N 2.68Å; C93-I95 VanDerWaalsContact C-N 3.33Å; C93-I95 PolarHBondContact O-N 3.42Å; C93-V96 PolarHBondContact O-N 3.32Å; C93-E97 WeakPolarHBondContact O-CG 3.45Å; C93-E97 PolarHBondContact O-N 3.27Å; C93-C133 HydrophobicContact CB-CB 3.93Å; C93-I136 VanDerWaalsContact SG-CB 3.55Å; C93-I136 WeakPolarHBondContact SG-CD1 3.37Å; C93-I136 WeakPolarHBondContact SG-CG2 3.11Å
94M93.6Very high89.6Confident0 Ų047.1 Ų47.10%025%0.252CS..Hα-helixtrans-58.4-43.9177-69.8-83.1140.400112.2F90 L91 E97 I98 H137 I203 C206 T207F90-M94 HydrophobicContact CD1-CG 3.88Å; F90-M94 HydrophobicContact CE1-CE 3.68Å; F90-M94 HydrophobicContact CE1-CG 3.68Å; F90-M94 HydrophobicContact CE1-SD 4.03Å; F90-M94 HydrophobicContact CZ-CE 3.67Å; F90-M94 VanDerWaalsContact O-CG 3.29Å; F90-M94 WeakPolarHBondContact O-CG 3.33Å; F90-M94 PolarHBondContact O-N 3.31Å; F90-M94 VanDerWaalsContact O-N 3.09Å; L91-M94 PolarHBondContact O-N 3.26Å; M94-E97 PolarHBondContact O-N 3.02Å; M94-I98 WeakPolarHBondContact O-CG1 3.49Å; M94-I98 PolarHBondContact O-N 3.38Å; M94-I98 VanDerWaalsContact O-N 3.07Å; M94-H137 HydrophobicContact CE-CB 4.45Å; M94-H137 WeakPolarHBondContact CE-CE1 3.39Å; M94-H137 WeakPolarHBondContact CE-ND1 3.29Å; M94-I203 HydrophobicContact SD-CG2 3.74Å; M94-C206 HydrophobicContact CE-CB 4.05Å; M94-C206 HydrophobicContact SD-CB 3.93Å; M94-T207 WeakPolarHBondContact CB-OG1 3.32Å; M94-T207 PolarHBondContact SD-OG1 3.1Å
95I96Very high91.9Very high85 Ų8546.1 Ų46.144%0.43624%0.243SC..Hα-helixtrans-63.7-45.4177.7-68.7167000110.6L91 G92 C93 I98 I99L91-I95 HydrophobicContact CD1-CD1 4.18Å; L91-I95 HydrophobicContact CD1-CG1 4.44Å; L91-I95 HydrophobicContact CG-CD1 3.93Å; L91-I95 WeakPolarHBondContact O-CG1 3.48Å; L91-I95 PolarHBondContact O-N 3.47Å; G92-I95 PolarHBondContact O-N 2.61Å; C93-I95 VanDerWaalsContact C-N 3.33Å; C93-I95 PolarHBondContact O-N 3.42Å; I95-I98 PolarHBondContact O-N 3.47Å; I95-I99 HydrophobicContact CG2-CD1 3.8Å; I95-I99 HydrophobicContact CG2-CG1 4.48Å; I95-I99 VanDerWaalsContact O-CG1 3.32Å; I95-I99 WeakPolarHBondContact O-CG1 3.34Å; I95-I99 PolarHBondContact O-N 2.85Å
96V97.2Very high93.2Very high52 Ų5248.3 Ų48.332%0.31525%0.252SS..Hα-helixtrans-63.3-42.3178.81720000111.2G92 C93 I98 I99 V100 I129 C133G92-V96 VanDerWaalsContact O-CG2 3.3Å; G92-V96 WeakPolarHBondContact O-CG2 3.25Å; G92-V96 PolarHBondContact O-N 3.37Å; C93-V96 PolarHBondContact O-N 3.32Å; V96-I98 PolarHBondContact O-N 2.95Å; V96-I99 PolarHBondContact O-N 3.34Å; V96-V100 HydrophobicContact CG1-CG2 4.36Å; V96-V100 WeakPolarHBondContact O-CG2 3.46Å; V96-V100 PolarHBondContact O-N 3.47Å; V96-I129 HydrophobicContact CG1-CG2 3.43Å; V96-I129 VanDerWaalsContact CG1-CG2 3.43Å; V96-C133 VanDerWaalsContact CG1-SG 3.52Å
97E95.7Very high94Very high0 Ų045.7 Ų45.70%023%0.234CC..Hα-helixtrans-58.7-45.5175.2-74.7172.1179.600111.8C93 M94 V100 L101 I130 C133 V134 I203C93-E97 WeakPolarHBondContact O-CG 3.45Å; C93-E97 PolarHBondContact O-N 3.27Å; M94-E97 PolarHBondContact O-N 3.02Å; E97-V100 PolarHBondContact O-N 2.9Å; E97-L101 WeakPolarHBondContact O-CB 3.41Å; E97-L101 VanDerWaalsContact O-CG 3.26Å; E97-L101 WeakPolarHBondContact O-CG 3.39Å; E97-L101 PolarHBondContact O-N 3.46Å; E97-I130 HydrophobicContact CG-CG1 4.07Å; E97-C133 HydrophobicContact CG-CB 3.57Å; E97-C133 VanDerWaalsContact OE1-CB 3.26Å; E97-C133 WeakPolarHBondContact OE1-CB 3.29Å; E97-V134 PolarHBondContact OE1-N 2.99Å; E97-I203 HydrophobicContact CB-CG2 4.35Å; E97-I203 WeakPolarHBondContact OE2-CD1 3.28Å
98I96.4Very high94.5Very high37 Ų3739 Ų3919%0.1921%0.209CC..Hα-helixtrans-61.4-46.4176.6-67.6165000110.9M94 I95 V96 V100 L101 V102 I203 L204M94-I98 WeakPolarHBondContact O-CG1 3.49Å; M94-I98 PolarHBondContact O-N 3.38Å; M94-I98 VanDerWaalsContact O-N 3.07Å; I95-I98 PolarHBondContact O-N 3.47Å; V96-I98 PolarHBondContact O-N 2.95Å; I98-V100 VanDerWaalsContact C-N 3.34Å; I98-V100 PolarHBondContact O-N 3.41Å; I98-L101 PolarHBondContact O-N 3.01Å; I98-V102 HydrophobicContact CG2-CG2 4.36Å; I98-V102 WeakPolarHBondContact O-CG2 3.34Å; I98-V102 PolarHBondContact O-N 2.98Å; I98-I203 HydrophobicContact CD1-CG2 4.01Å; I98-I203 HydrophobicContact CG1-CB 4.35Å; I98-I203 HydrophobicContact CG1-CG2 3.62Å; I98-L204 HydrophobicContact CD1-CD2 3.7Å; I98-L204 HydrophobicContact CD1-CG 4.28Å
99I97.5Very high94.8Very high107 Ų10738.5 Ų38.555%0.54921%0.211SC..Hα-helixtrans-59.8-45.7179.6-69.5167000110.7I95 V96 V102 L103I95-I99 HydrophobicContact CG2-CD1 3.8Å; I95-I99 HydrophobicContact CG2-CG1 4.48Å; I95-I99 VanDerWaalsContact O-CG1 3.32Å; I95-I99 WeakPolarHBondContact O-CG1 3.34Å; I95-I99 PolarHBondContact O-N 2.85Å; V96-I99 PolarHBondContact O-N 3.34Å; I99-V102 PolarHBondContact O-N 2.86Å; I99-L103 WeakPolarHBondContact O-CB 3.48Å; I99-L103 PolarHBondContact O-N 2.82Å
100V97.4Very high95Very high9 Ų940.8 Ų40.86%0.05523%0.226CC..Hα-helixtrans-65.1-41.4179.1174.30000111.2V96 E97 I98 L103 T104 C126 I129 I130V96-V100 HydrophobicContact CG1-CG2 4.36Å; V96-V100 WeakPolarHBondContact O-CG2 3.46Å; V96-V100 PolarHBondContact O-N 3.47Å; E97-V100 PolarHBondContact O-N 2.9Å; I98-V100 VanDerWaalsContact C-N 3.34Å; I98-V100 PolarHBondContact O-N 3.41Å; V100-L103 WeakPolarHBondContact O-CB 3.43Å; V100-L103 PolarHBondContact O-N 3.21Å; V100-T104 WeakPolarHBondContact O-CG2 3.48Å; V100-T104 PolarHBondContact O-N 3.43Å; V100-C126 HydrophobicContact CG1-CB 3.64Å; V100-I129 HydrophobicContact CG2-CB 4.28Å; V100-I129 HydrophobicContact CG2-CG2 3.75Å; V100-I130 HydrophobicContact CG1-CB 4.24Å; V100-I130 HydrophobicContact CG1-CD1 4.26Å
101L96.3Very high95Very high0 Ų046.1 Ų46.10%025%0.254CS..Hα-helixtrans-67.2-35.7177.2-71.3169.3000112.9V29 E97 I98 L103 T104 I105 I130 F196 A199 I200 I203V29-L101 HydrophobicContact CG2-CD2 4.22Å; E97-L101 WeakPolarHBondContact O-CB 3.41Å; E97-L101 VanDerWaalsContact O-CG 3.26Å; E97-L101 WeakPolarHBondContact O-CG 3.39Å; E97-L101 PolarHBondContact O-N 3.46Å; I98-L101 PolarHBondContact O-N 3.01Å; L101-L103 VanDerWaalsContact C-N 3.34Å; L101-T104 WeakPolarHBondContact CA-OG1 3.32Å; L101-T104 PolarHBondContact O-N 2.54Å; L101-T104 PolarHBondContact O-OG1 2.93Å; L101-I105 WeakPolarHBondContact O-CG1 3.46Å; L101-I105 PolarHBondContact O-N 3.17Å; L101-I105 VanDerWaalsContact O-N 3.11Å; L101-I130 HydrophobicContact CD2-CD1 3.87Å; L101-I130 HydrophobicContact CG-CD1 3.96Å; L101-F196 HydrophobicContact CD2-CD1 4.13Å; L101-A199 HydrophobicContact CD1-CB 3.83Å; L101-A199 HydrophobicContact CD2-CB 4.09Å; L101-I200 HydrophobicContact CB-CD1 3.94Å; L101-I200 HydrophobicContact CB-CG1 3.53Å; L101-I200 HydrophobicContact CD1-CG1 3.93Å; L101-I200 HydrophobicContact CG-CG1 4.36Å; L101-I203 HydrophobicContact CD1-CG1 4.37Å
102V97Very high95.1Very high65 Ų6544 Ų4439%0.39424%0.243SC..Hα-helixtrans-65-42.5172170.50000110.2I98 I99 T104 I105 I106 I200I98-V102 HydrophobicContact CG2-CG2 4.36Å; I98-V102 WeakPolarHBondContact O-CG2 3.34Å; I98-V102 PolarHBondContact O-N 2.98Å; I99-V102 PolarHBondContact O-N 2.86Å; V102-T104 VanDerWaalsContact C-N 3.34Å; V102-T104 PolarHBondContact O-N 3.47Å; V102-I105 PolarHBondContact O-N 2.86Å; V102-I106 HydrophobicContact CG1-CD1 3.98Å; V102-I106 WeakPolarHBondContact O-CG1 3.29Å; V102-I106 PolarHBondContact O-N 2.76Å; V102-I200 HydrophobicContact CG2-CD1 3.86Å
103L96.9Very high95Very high68 Ų6844.6 Ų44.636%0.35624%0.242SC..Hα-helixtrans-60.2-41.9175177.161.9000111.8I99 V100 L101 I105 I106 L107I99-L103 WeakPolarHBondContact O-CB 3.48Å; I99-L103 PolarHBondContact O-N 2.82Å; V100-L103 WeakPolarHBondContact O-CB 3.43Å; V100-L103 PolarHBondContact O-N 3.21Å; L101-L103 VanDerWaalsContact C-N 3.34Å; L103-I105 VanDerWaalsContact C-N 3.33Å; L103-I105 PolarHBondContact O-N 3Å; L103-I106 PolarHBondContact O-N 3.01Å; L103-L107 HydrophobicContact CD1-CD1 4.41Å; L103-L107 HydrophobicContact CD1-CG 4.31Å; L103-L107 HydrophobicContact CG-CD1 4.15Å; L103-L107 HydrophobicContact CG-CG 4.5Å; L103-L107 WeakPolarHBondContact O-CG 3.5Å; L103-L107 PolarHBondContact O-N 2.93Å
104T95.3Very high94.9Very high5 Ų551.2 Ų51.23%0.03128%0.277CS..Hα-helixtrans-66.9-33.5177.556.30000112.9F30 V100 L101 V102 L107 A108 C126 F196F30-T104 HydrophobicContact CE1-CG2 3.87Å; F30-T104 HydrophobicContact CZ-CG2 3.73Å; V100-T104 WeakPolarHBondContact O-CG2 3.48Å; V100-T104 PolarHBondContact O-N 3.43Å; L101-T104 WeakPolarHBondContact CA-OG1 3.32Å; L101-T104 PolarHBondContact O-N 2.54Å; L101-T104 PolarHBondContact O-OG1 2.93Å; V102-T104 VanDerWaalsContact C-N 3.34Å; V102-T104 PolarHBondContact O-N 3.47Å; T104-L107 PolarHBondContact O-N 2.79Å; T104-A108 WeakPolarHBondContact O-CB 3.18Å; T104-A108 PolarHBondContact O-N 2.87Å; T104-C126 HydrophobicContact CG2-CB 4.27Å; T104-F196 WeakPolarHBondContact OG1-CD1 3.32Å
105I95.7Very high94.9Very high27 Ų2755.5 Ų55.514%0.13830%0.299CS..Hα-helixtrans-63.7-46.1171.1-68.4170.2000110.5L101 V102 L103 L107 A108 L109 V193 F196 L197 I200L101-I105 WeakPolarHBondContact O-CG1 3.46Å; L101-I105 PolarHBondContact O-N 3.17Å; L101-I105 VanDerWaalsContact O-N 3.11Å; V102-I105 PolarHBondContact O-N 2.86Å; L103-I105 VanDerWaalsContact C-N 3.33Å; L103-I105 PolarHBondContact O-N 3Å; I105-L107 VanDerWaalsContact C-N 3.34Å; I105-L107 PolarHBondContact O-N 3.21Å; I105-A108 WeakPolarHBondContact O-CB 3.3Å; I105-A108 PolarHBondContact O-N 3.06Å; I105-A108 VanDerWaalsContact O-N 3.14Å; I105-L109 HydrophobicContact CG2-CD1 4.36Å; I105-L109 WeakPolarHBondContact O-CG 3.32Å; I105-L109 PolarHBondContact O-N 2.93Å; I105-V193 HydrophobicContact CG2-CG1 4.34Å; I105-F196 HydrophobicContact CD1-CB 3.96Å; I105-F196 HydrophobicContact CG1-CB 3.48Å; I105-F196 VanDerWaalsContact CG1-CB 3.48Å; I105-F196 HydrophobicContact CG1-CD2 4.49Å; I105-F196 HydrophobicContact CG1-CG 4.31Å; I105-L197 HydrophobicContact CD1-CB 4.49Å; I105-I200 HydrophobicContact CD1-CD1 3.51Å
106I96.4Very high94.9Very high83 Ų8351.7 Ų51.743%0.42628%0.28SS..Hα-helixtrans-59.7-46.2177.5-67.5166.2000110.4V102 L103 A108 L109 I110V102-I106 HydrophobicContact CG1-CD1 3.98Å; V102-I106 WeakPolarHBondContact O-CG1 3.29Å; V102-I106 PolarHBondContact O-N 2.76Å; L103-I106 PolarHBondContact O-N 3.01Å; I106-A108 VanDerWaalsContact C-N 3.27Å; I106-A108 PolarHBondContact O-N 3.42Å; I106-L109 PolarHBondContact O-N 3.31Å; I106-L109 VanDerWaalsContact O-N 3.13Å; I106-I110 HydrophobicContact CG2-CD1 3.61Å; I106-I110 HydrophobicContact CG2-CG1 4.33Å; I106-I110 WeakPolarHBondContact O-CG1 3.48Å; I106-I110 PolarHBondContact O-N 2.84Å
107L95.2Very high94.8Very high16 Ų1650.8 Ų50.88%0.08428%0.28CS..Hα-helixtrans-62-33.3176.4-70.2170.7000112.9L103 T104 I105 L109 F119 I122L103-L107 HydrophobicContact CD1-CD1 4.41Å; L103-L107 HydrophobicContact CD1-CG 4.31Å; L103-L107 HydrophobicContact CG-CD1 4.15Å; L103-L107 HydrophobicContact CG-CG 4.5Å; L103-L107 WeakPolarHBondContact O-CG 3.5Å; L103-L107 PolarHBondContact O-N 2.93Å; T104-L107 PolarHBondContact O-N 2.79Å; I105-L107 VanDerWaalsContact C-N 3.34Å; I105-L107 PolarHBondContact O-N 3.21Å; L107-L109 VanDerWaalsContact C-N 3.3Å; L107-L109 PolarHBondContact O-N 3.09Å; L107-F119 HydrophobicContact CB-CE2 4.32Å; L107-I122 HydrophobicContact CD1-CG2 3.58Å; L107-I122 HydrophobicContact CD2-CG2 4.36Å
108A92.4Very high94.8Very high0 Ų054.1 Ų54.10%030%0.301CS..Hα-helixtrans-64.5-36.9175.500000112.1Y36 K40 T104 I105 I106 V193Y36-A108 HydrophobicContact CE2-CB 3.78Å; Y36-A108 WeakPolarHBondContact OH-CA 3.3Å; Y36-A108 PolarHBondContact OH-N 3.43Å; K40-A108 WeakPolarHBondContact CE-O 3.43Å; K40-A108 PolarHBondContact NZ-O 2.87Å; T104-A108 WeakPolarHBondContact O-CB 3.18Å; T104-A108 PolarHBondContact O-N 2.87Å; I105-A108 WeakPolarHBondContact O-CB 3.3Å; I105-A108 PolarHBondContact O-N 3.06Å; I105-A108 VanDerWaalsContact O-N 3.14Å; I106-A108 VanDerWaalsContact C-N 3.27Å; I106-A108 PolarHBondContact O-N 3.42Å; A108-V193 HydrophobicContact CB-CG2 4.12Å
109L92.9Very high94.8Very high118 Ų11852.6 Ų52.662%0.61829%0.293SS*.Hα-helixtrans-81.7-28.6-178.5-62.1176.1000113.7I105 I106 L107 I189 V193I105-L109 HydrophobicContact CG2-CD1 4.36Å; I105-L109 WeakPolarHBondContact O-CG 3.32Å; I105-L109 PolarHBondContact O-N 2.93Å; I106-L109 PolarHBondContact O-N 3.31Å; I106-L109 VanDerWaalsContact O-N 3.13Å; L107-L109 VanDerWaalsContact C-N 3.3Å; L107-L109 PolarHBondContact O-N 3.09Å; L109-I189 HydrophobicContact CD2-CG2 4.38Å; L109-V193 HydrophobicContact CD2-CG2 4.09Å
110I93.3Very high94.7Very high88 Ų8848.8 Ų48.845%0.45127%0.272SS..SBendtrans-75.7135.8177.7-66.7170.4000110.5K40 I106 T112K40-I110 PolarHBondContact NZ-O 3.38Å; I106-I110 HydrophobicContact CG2-CD1 3.61Å; I106-I110 HydrophobicContact CG2-CG1 4.33Å; I106-I110 WeakPolarHBondContact O-CG1 3.48Å; I106-I110 PolarHBondContact O-N 2.84Å; I110-T112 HydrophobicContact CG2-CG2 4.17Å; I110-T112 PolarHBondContact O-N 3Å
111D91.1Very high94.7Very high114 Ų11453.3 Ų53.361%0.6130%0.296SS*.  trans-74.4115.6170.9-174.211.5000110.9S113D111-S113 VanDerWaalsContact OD1-CB 3.25Å; D111-S113 WeakPolarHBondContact OD1-CB 3.38Å; D111-S113 PolarHBondContact OD1-N 3.27Å; D111-S113 PolarHBondContact OD1-OG 3.24Å
112T92.4Very high94.8Very high6 Ų656 Ų564%0.03731%0.31CS..  trans-113.116.9-179.757.10000112.5I110 N114 I115 F119I110-T112 HydrophobicContact CG2-CG2 4.17Å; I110-T112 PolarHBondContact O-N 3Å; T112-N114 PolarHBondContact O-N 3Å; T112-N114 VanDerWaalsContact O-N 3.12Å; T112-I115 CarbonylContact O-C 3.46Å; T112-I115 PolarHBondContact O-N 2.88Å; T112-F119 HydrophobicContact CG2-CB 4.17Å; T112-F119 HydrophobicContact CG2-CD2 3.99Å; T112-F119 HydrophobicContact CG2-CG 4.44Å
113S90.8Very high94.7Very high47 Ų4753.1 Ų53.133%0.32929%0.292SS..THydrogen-bonded Turntrans-58.4-27.8-174.8-59.50000114D111D111-S113 VanDerWaalsContact OD1-CB 3.25Å; D111-S113 WeakPolarHBondContact OD1-CB 3.38Å; D111-S113 PolarHBondContact OD1-N 3.27Å; D111-S113 PolarHBondContact OD1-OG 3.24Å
114N93.3Very high94.8Very high148 Ų14851.3 Ų51.379%0.79128%0.282SS*.THydrogen-bonded Turntrans-85.6-18.2179.4-63.3-40.4000113.5T112 P116T112-N114 PolarHBondContact O-N 3Å; T112-N114 VanDerWaalsContact O-N 3.12Å; N114-P116 VanDerWaalsContact C-CD 3.45Å
115I94.8Very high94.9Very high91 Ų9155.1 Ų55.147%0.46730%0.302SS..  trans-133.652.8-173.554.7166.1000112.3T112 G117 T118 F119T112-I115 CarbonylContact O-C 3.46Å; T112-I115 PolarHBondContact O-N 2.88Å; I115-G117 VanDerWaalsContact C-N 3.28Å; I115-G117 PolarHBondContact O-N 3.1Å; I115-T118 HydrophobicContact CD1-CG2 4.47Å; I115-T118 PolarHBondContact O-N 3.41Å; I115-T118 VanDerWaalsContact O-N 3.13Å; I115-F119 PolarHBondContact O-N 3.08Å; I115-F119 VanDerWaalsContact O-N 3.08Å
116P95.2Very high95Very high5 Ų554 Ų543%0.03230%0.297CS..Hα-helixtrans-61-34.7-174.826.6-37.1000112.9L41 T43 T45 S46 N114 F119 F120L41-P116 HydrophobicContact CD2-CB 4.43Å; T43-P116 HydrophobicContact CG2-CB 4.08Å; T43-P116 HydrophobicContact CG2-CG 4.28Å; T45-P116 WeakPolarHBondContact OG1-CG 3.34Å; S46-P116 WeakPolarHBondContact OG-CB 3.35Å; S46-P116 WeakPolarHBondContact OG-CG 3.39Å; N114-P116 VanDerWaalsContact C-CD 3.45Å; P116-F119 PolarHBondContact O-N 2.83Å; P116-F120 WeakPolarHBondContact O-CB 3.46Å; P116-F120 PolarHBondContact O-N 3.01Å
117G94.9Very high95Very high32 Ų3250.1 Ų50.133%0.3328%0.276SS..Hα-helixtrans-64.8-38.9176.900000113.1I115 F120 L121I115-G117 VanDerWaalsContact C-N 3.28Å; I115-G117 PolarHBondContact O-N 3.1Å; G117-F120 PolarHBondContact O-N 2.48Å; G117-L121 WeakPolarHBondContact O-CB 3.45Å; G117-L121 PolarHBondContact O-N 3.3Å
118T95.5Very high95.1Very high71 Ų7151.9 Ų51.944%0.43629%0.288SS..Hα-helixtrans-68.7-42.4175.3-530000111I115 F120 L121 I122I115-T118 HydrophobicContact CD1-CG2 4.47Å; I115-T118 PolarHBondContact O-N 3.41Å; I115-T118 VanDerWaalsContact O-N 3.13Å; T118-F120 VanDerWaalsContact C-N 3.34Å; T118-F120 PolarHBondContact O-N 3.04Å; T118-L121 PolarHBondContact O-N 3.26Å; T118-I122 HydrophobicContact CG2-CD1 3.92Å; T118-I122 HydrophobicContact CG2-CG1 4.46Å; T118-I122 VanDerWaalsContact O-CG1 3.31Å; T118-I122 WeakPolarHBondContact O-CG1 3.43Å; T118-I122 PolarHBondContact O-N 2.68Å
119F96.5Very high95.4Very high4 Ų455.1 Ų55.12%0.01830%0.304CS..Hα-helixtrans-58.4-45.9173.6168.3-94.4000111.7Y36 F37 K40 L41 L107 T112 I115 P116 I122 T123Y36-F119 HydrophobicContact CE1-CZ 4.3Å; Y36-F119 WeakPolarHBondContact OH-CE2 3.5Å; Y36-F119 WeakPolarHBondContact OH-CZ 3.34Å; F37-F119 HydrophobicContact CD1-CE1 4.24Å; F37-F119 HydrophobicContact CD1-CZ 4.08Å; F37-F119 HydrophobicContact CE1-CZ 4.44Å; K40-F119 HydrophobicContact CB-CD1 4.16Å; K40-F119 HydrophobicContact CB-CE1 3.55Å; K40-F119 HydrophobicContact CB-CE2 4.43Å; K40-F119 HydrophobicContact CB-CZ 3.71Å; K40-F119 HydrophobicContact CD-CE2 4.48Å; K40-F119 HydrophobicContact CD-CZ 4.49Å; K40-F119 HydrophobicContact CG-CE1 4.22Å; K40-F119 HydrophobicContact CG-CE2 4.3Å; K40-F119 HydrophobicContact CG-CZ 3.84Å; L41-F119 HydrophobicContact CD2-CD1 3.68Å; L41-F119 HydrophobicContact CD2-CE1 4.1Å; L41-F119 HydrophobicContact CG-CD1 4.32Å; L41-F119 HydrophobicContact CG-CE1 4.26Å; L107-F119 HydrophobicContact CB-CE2 4.32Å; T112-F119 HydrophobicContact CG2-CB 4.17Å; T112-F119 HydrophobicContact CG2-CD2 3.99Å; T112-F119 HydrophobicContact CG2-CG 4.44Å; I115-F119 PolarHBondContact O-N 3.08Å; I115-F119 VanDerWaalsContact O-N 3.08Å; P116-F119 PolarHBondContact O-N 2.83Å; F119-I122 PolarHBondContact O-N 3Å; F119-T123 WeakPolarHBondContact O-CB 3.37Å; F119-T123 PolarHBondContact O-N 3.41Å; F119-T123 PolarHBondContact O-OG1 3Å
120F96.5Very high95.6Very high27 Ų2749.5 Ų49.512%0.11828%0.275CS..Hα-helixtrans-58.7-49.4175.6175.6-102.2000111.5L41 Y51 L55 Y58 P116 G117 T118 I122 T123 I124L41-F120 HydrophobicContact CD1-CD2 4.22Å; L41-F120 HydrophobicContact CD2-CB 3.92Å; Y51-F120 VanDerWaalsContact CB-CZ 3.5Å; Y51-F120 HydrophobicContact CD2-CB 4.11Å; Y51-F120 HydrophobicContact CD2-CD1 4.26Å; Y51-F120 AromaticContact CD2-CD2 3.98Å; Y51-F120 HydrophobicContact CD2-CD2 3.98Å; Y51-F120 AromaticContact CD2-CG 3.84Å; Y51-F120 HydrophobicContact CD2-CG 3.84Å; Y51-F120 HydrophobicContact CE2-CB 4.34Å; Y51-F120 AromaticContact CG-CD1 3.97Å; Y51-F120 HydrophobicContact CG-CD1 3.97Å; Y51-F120 HydrophobicContact CG-CD2 4.3Å; Y51-F120 HydrophobicContact CG-CE1 4.2Å; Y51-F120 HydrophobicContact CG-CG 4.02Å; Y51-F120 HydrophobicContact CG-CZ 4.47Å; L55-F120 HydrophobicContact CD1-CD2 4.01Å; L55-F120 HydrophobicContact CD1-CE2 3.71Å; Y58-F120 HydrophobicContact CD1-CZ 4.43Å; Y58-F120 HydrophobicContact CD2-CZ 4.13Å; Y58-F120 AromaticContact CG-CZ 3.96Å; Y58-F120 HydrophobicContact CG-CZ 3.96Å; P116-F120 WeakPolarHBondContact O-CB 3.46Å; P116-F120 PolarHBondContact O-N 3.01Å; G117-F120 PolarHBondContact O-N 2.48Å; T118-F120 VanDerWaalsContact C-N 3.34Å; T118-F120 PolarHBondContact O-N 3.04Å; F120-I122 PolarHBondContact O-N 2.95Å; F120-T123 WeakPolarHBondContact O-CB 3.37Å; F120-T123 PolarHBondContact O-N 3.47Å; F120-I124 HydrophobicContact CD1-CG1 4.29Å; F120-I124 HydrophobicContact CD2-CG1 4.26Å; F120-I124 HydrophobicContact CE1-CG1 3.79Å; F120-I124 HydrophobicContact CE2-CD1 3.89Å; F120-I124 HydrophobicContact CE2-CG1 3.76Å; F120-I124 HydrophobicContact CZ-CD1 3.79Å; F120-I124 HydrophobicContact CZ-CG1 3.49Å; F120-I124 VanDerWaalsContact CZ-CG1 3.49Å; F120-I124 WeakPolarHBondContact O-CG1 3.44Å; F120-I124 PolarHBondContact O-N 2.67Å
121L96.9Very high95.8Very high104 Ų10445.4 Ų45.455%0.54525%0.254SS..Hα-helixtrans-59.6-48-179.5179.563.1000112.2G117 T118 T123 I124 I125G117-L121 WeakPolarHBondContact O-CB 3.45Å; G117-L121 PolarHBondContact O-N 3.3Å; T118-L121 PolarHBondContact O-N 3.26Å; L121-T123 VanDerWaalsContact C-N 3.28Å; L121-T123 PolarHBondContact O-N 3.22Å; L121-I124 PolarHBondContact O-N 3Å; L121-I125 HydrophobicContact CD1-CD1 4.33Å; L121-I125 HydrophobicContact CG-CD1 4.13Å; L121-I125 WeakPolarHBondContact O-CG1 3.11Å; L121-I125 PolarHBondContact O-N 3.24Å
122I97.2Very high96.1Very high58 Ų5840.4 Ų40.430%0.29723%0.228SC..Hα-helixtrans-61.3-41.4177.6-64.7168.9000110.2L107 T118 F119 F120 I125 C126L107-I122 HydrophobicContact CD1-CG2 3.58Å; L107-I122 HydrophobicContact CD2-CG2 4.36Å; T118-I122 HydrophobicContact CG2-CD1 3.92Å; T118-I122 HydrophobicContact CG2-CG1 4.46Å; T118-I122 VanDerWaalsContact O-CG1 3.31Å; T118-I122 WeakPolarHBondContact O-CG1 3.43Å; T118-I122 PolarHBondContact O-N 2.68Å; F119-I122 PolarHBondContact O-N 3Å; F120-I122 PolarHBondContact O-N 2.95Å; I122-I125 PolarHBondContact O-N 2.89Å; I122-C126 PolarHBondContact O-N 3.12Å; I122-C126 PolarHBondContact O-SG 3.12Å
123T96.5Very high96.3Very high4 Ų440.6 Ų40.63%0.02523%0.229CC..Hα-helixtrans-61.5-45.4177.2-59.70000111.4F30 F37 F59 F119 F120 L121 I125 C126 V127F30-T123 HydrophobicContact CD1-CG2 4.46Å; F30-T123 HydrophobicContact CE1-CG2 4.38Å; F37-T123 HydrophobicContact CD1-CG2 4.08Å; F37-T123 HydrophobicContact CE1-CG2 3.5Å; F37-T123 HydrophobicContact CZ-CG2 4.3Å; F59-T123 HydrophobicContact CE1-CG2 3.88Å; F59-T123 HydrophobicContact CZ-CG2 3.82Å; F119-T123 WeakPolarHBondContact O-CB 3.37Å; F119-T123 PolarHBondContact O-N 3.41Å; F119-T123 PolarHBondContact O-OG1 3Å; F120-T123 WeakPolarHBondContact O-CB 3.37Å; F120-T123 PolarHBondContact O-N 3.47Å; L121-T123 VanDerWaalsContact C-N 3.28Å; L121-T123 PolarHBondContact O-N 3.22Å; T123-I125 VanDerWaalsContact C-N 3.35Å; T123-I125 PolarHBondContact O-N 3.17Å; T123-C126 WeakPolarHBondContact O-CB 3.29Å; T123-C126 PolarHBondContact O-N 3.38Å; T123-C126 VanDerWaalsContact O-N 3.16Å; T123-V127 WeakPolarHBondContact O-CG2 3.2Å; T123-V127 PolarHBondContact O-N 2.83Å
124I97.2Very high96.6Very high29 Ų2938.6 Ų38.615%0.14922%0.215CC..Hα-helixtrans-62.6-41.6177-68.6-64.3000111.4F59 A62 F120 L121 C126 V127 V128F59-I124 HydrophobicContact CD1-CD1 3.67Å; F59-I124 HydrophobicContact CE1-CD1 3.88Å; A62-I124 HydrophobicContact CB-CD1 4.28Å; A62-I124 HydrophobicContact CB-CG2 4.17Å; F120-I124 HydrophobicContact CD1-CG1 4.29Å; F120-I124 HydrophobicContact CD2-CG1 4.26Å; F120-I124 HydrophobicContact CE1-CG1 3.79Å; F120-I124 HydrophobicContact CE2-CD1 3.89Å; F120-I124 HydrophobicContact CE2-CG1 3.76Å; F120-I124 HydrophobicContact CZ-CD1 3.79Å; F120-I124 HydrophobicContact CZ-CG1 3.49Å; F120-I124 VanDerWaalsContact CZ-CG1 3.49Å; F120-I124 WeakPolarHBondContact O-CG1 3.44Å; F120-I124 PolarHBondContact O-N 2.67Å; L121-I124 PolarHBondContact O-N 3Å; I124-C126 VanDerWaalsContact C-N 3.29Å; I124-C126 PolarHBondContact O-N 3.43Å; I124-V127 PolarHBondContact O-N 3.32Å; I124-V128 HydrophobicContact CG2-CG2 4.48Å; I124-V128 WeakPolarHBondContact O-CG2 3.32Å; I124-V128 PolarHBondContact O-N 3.47Å
125I97.9Very high96.7Very high86 Ų8631.6 Ų31.644%0.44118%0.178SC..Hα-helixtrans-59.4-43.1174.4-68166.2000110.4L121 I122 T123 V128 I129L121-I125 HydrophobicContact CD1-CD1 4.33Å; L121-I125 HydrophobicContact CG-CD1 4.13Å; L121-I125 WeakPolarHBondContact O-CG1 3.11Å; L121-I125 PolarHBondContact O-N 3.24Å; I122-I125 PolarHBondContact O-N 2.89Å; T123-I125 VanDerWaalsContact C-N 3.35Å; T123-I125 PolarHBondContact O-N 3.17Å; I125-V128 PolarHBondContact O-N 3.34Å; I125-I129 HydrophobicContact CG2-CD1 3.77Å; I125-I129 HydrophobicContact CG2-CG1 4.49Å; I125-I129 VanDerWaalsContact O-CG1 3.3Å; I125-I129 WeakPolarHBondContact O-CG1 3.41Å; I125-I129 PolarHBondContact O-N 2.89Å
126C97.3Very high96.8Very high4 Ų428 Ų283%0.02716%0.159CC..Hα-helixtrans-60-46.4174.7-660000111.8V100 T104 I122 T123 I124 V128 I129 I130V100-C126 HydrophobicContact CG1-CB 3.64Å; T104-C126 HydrophobicContact CG2-CB 4.27Å; I122-C126 PolarHBondContact O-N 3.12Å; I122-C126 PolarHBondContact O-SG 3.12Å; T123-C126 WeakPolarHBondContact O-CB 3.29Å; T123-C126 PolarHBondContact O-N 3.38Å; T123-C126 VanDerWaalsContact O-N 3.16Å; I124-C126 VanDerWaalsContact C-N 3.29Å; I124-C126 PolarHBondContact O-N 3.43Å; C126-V128 VanDerWaalsContact C-N 3.33Å; C126-V128 PolarHBondContact O-N 3.26Å; C126-I129 PolarHBondContact O-N 2.86Å; C126-I130 WeakPolarHBondContact O-CB 3.44Å; C126-I130 PolarHBondContact O-N 3.49Å
127V97.1Very high96.8Very high0 Ų027.8 Ų27.80%016%0.158CC..Hα-helixtrans-61.6-39.9178.4174.40000111.6W27 F30 F59 A62 A63 T123 I124 I130 N131W27-V127 HydrophobicContact CE3-CG1 4.36Å; W27-V127 HydrophobicContact CZ3-CG1 3.87Å; F30-V127 HydrophobicContact CB-CG2 4.44Å; F30-V127 HydrophobicContact CD1-CG2 3.43Å; F30-V127 VanDerWaalsContact CD1-CG2 3.43Å; F30-V127 HydrophobicContact CD2-CG2 4.33Å; F30-V127 HydrophobicContact CE1-CG2 3.62Å; F30-V127 HydrophobicContact CE2-CG2 4.49Å; F30-V127 HydrophobicContact CG-CG2 3.82Å; F30-V127 HydrophobicContact CZ-CG2 4.14Å; F59-V127 HydrophobicContact CD1-CG2 4.34Å; F59-V127 HydrophobicContact CE1-CG2 4.37Å; A62-V127 HydrophobicContact CB-CB 4.22Å; A62-V127 HydrophobicContact CB-CG1 3.7Å; A63-V127 HydrophobicContact CB-CG1 4.22Å; T123-V127 WeakPolarHBondContact O-CG2 3.2Å; T123-V127 PolarHBondContact O-N 2.83Å; I124-V127 PolarHBondContact O-N 3.32Å; V127-I130 WeakPolarHBondContact O-CG2 3.41Å; V127-N131 WeakPolarHBondContact O-CB 3.36Å; V127-N131 PolarHBondContact O-N 3.35Å; V127-N131 VanDerWaalsContact O-N 3.11Å; V127-N131 PolarHBondContact O-ND2 3.25Å
128V98.1Very high96.8Very high53 Ų5326.8 Ų26.832%0.32114%0.144SC..Hα-helixtrans-64.2-47.8176.3167.20000111.4A62 P66 I124 I125 C126 S132A62-V128 HydrophobicContact CB-CG2 3.91Å; A62-V128 WeakPolarHBondContact O-CA 3.29Å; P66-V128 HydrophobicContact CB-CG1 4.17Å; P66-V128 HydrophobicContact CG-CB 4.23Å; P66-V128 HydrophobicContact CG-CG1 3.79Å; P66-V128 HydrophobicContact CG-CG2 4.13Å; I124-V128 HydrophobicContact CG2-CG2 4.48Å; I124-V128 WeakPolarHBondContact O-CG2 3.32Å; I124-V128 PolarHBondContact O-N 3.47Å; I125-V128 PolarHBondContact O-N 3.34Å; C126-V128 VanDerWaalsContact C-N 3.33Å; C126-V128 PolarHBondContact O-N 3.26Å; V128-S132 WeakPolarHBondContact O-CB 3.42Å; V128-S132 PolarHBondContact O-N 3.02Å; V128-S132 PolarHBondContact O-OG 2.88Å
129I98Very high96.9Very high68 Ų6823.4 Ų23.435%0.34912%0.124SC..Hα-helixtrans-65.9-45-177.9-66.7169.1000110.7V96 V100 I125 C126 N131 S132 C133V96-I129 HydrophobicContact CG1-CG2 3.43Å; V96-I129 VanDerWaalsContact CG1-CG2 3.43Å; V100-I129 HydrophobicContact CG2-CB 4.28Å; V100-I129 HydrophobicContact CG2-CG2 3.75Å; I125-I129 HydrophobicContact CG2-CD1 3.77Å; I125-I129 HydrophobicContact CG2-CG1 4.49Å; I125-I129 VanDerWaalsContact O-CG1 3.3Å; I125-I129 WeakPolarHBondContact O-CG1 3.41Å; I125-I129 PolarHBondContact O-N 2.89Å; C126-I129 PolarHBondContact O-N 2.86Å; I129-N131 PolarHBondContact O-N 3.46Å; I129-S132 WeakPolarHBondContact O-CB 3.5Å; I129-S132 PolarHBondContact O-N 3.09Å; I129-C133 PolarHBondContact O-N 3.36Å; I129-C133 PolarHBondContact O-SG 2.84Å; I129-C133 VanDerWaalsContact O-SG 3.35Å
130I96.8Very high96.8Very high0 Ų023.4 Ų23.40%012%0.124CC..Hα-helixtrans-65.5-42.3-177.7-150.2169.7000111P26 F30 E97 V100 L101 C126 V127 S132 C133 V134P26-I130 HydrophobicContact CB-CD1 3.5Å; P26-I130 HydrophobicContact CB-CG1 3.82Å; F30-I130 HydrophobicContact CE2-CD1 3.92Å; F30-I130 HydrophobicContact CE2-CG2 3.94Å; E97-I130 HydrophobicContact CG-CG1 4.07Å; V100-I130 HydrophobicContact CG1-CB 4.24Å; V100-I130 HydrophobicContact CG1-CD1 4.26Å; L101-I130 HydrophobicContact CD2-CD1 3.87Å; L101-I130 HydrophobicContact CG-CD1 3.96Å; C126-I130 WeakPolarHBondContact O-CB 3.44Å; C126-I130 PolarHBondContact O-N 3.49Å; V127-I130 WeakPolarHBondContact O-CG2 3.41Å; I130-S132 VanDerWaalsContact C-N 3.33Å; I130-S132 PolarHBondContact O-N 3.48Å; I130-C133 WeakPolarHBondContact O-CB 3.42Å; I130-C133 PolarHBondContact O-N 3.04Å; I130-C133 VanDerWaalsContact O-N 3.1Å; I130-V134 WeakPolarHBondContact O-CG2 3.14Å; I130-V134 PolarHBondContact O-N 3.1Å
131N97.1Very high96.7Very high3 Ų322.2 Ų22.22%0.01612%0.119CC..Hα-helixtrans-73.5-25.6179.7-78.5-82.6000113.3A63 S67 V127 I129 C133 V134 G135A63-N131 WeakPolarHBondContact CA-ND2 3.36Å; A63-N131 HydrophobicContact CB-CB 4.2Å; A63-N131 VanDerWaalsContact CB-ND2 3.29Å; A63-N131 WeakPolarHBondContact CB-ND2 3.48Å; A63-N131 WeakPolarHBondContact CB-OD1 3.34Å; A63-N131 VanDerWaalsContact O-CB 3.25Å; A63-N131 WeakPolarHBondContact O-CB 2.97Å; S67-N131 VanDerWaalsContact CA-O 3.26Å; S67-N131 WeakPolarHBondContact CA-O 3.47Å; S67-N131 WeakPolarHBondContact CB-O 3.5Å; V127-N131 WeakPolarHBondContact O-CB 3.36Å; V127-N131 PolarHBondContact O-N 3.35Å; V127-N131 VanDerWaalsContact O-N 3.11Å; V127-N131 PolarHBondContact O-ND2 3.25Å; I129-N131 PolarHBondContact O-N 3.46Å; N131-C133 VanDerWaalsContact C-N 3.28Å; N131-V134 PolarHBondContact O-N 2.85Å; N131-G135 PolarHBondContact O-N 3.25Å
132S97.5Very high96.6Very high8 Ų817.4 Ų17.46%0.0569%0.094CC..Hα-helixtrans-61-41.4167.8-580000111P66 F70 V128 I129 I130 I136P66-S132 WeakPolarHBondContact CB-OG 3.21Å; F70-S132 WeakPolarHBondContact CB-O 3.35Å; F70-S132 WeakPolarHBondContact CD2-OG 3.37Å; F70-S132 WeakPolarHBondContact CE2-OG 3.14Å; V128-S132 WeakPolarHBondContact O-CB 3.42Å; V128-S132 PolarHBondContact O-N 3.02Å; V128-S132 PolarHBondContact O-OG 2.88Å; I129-S132 WeakPolarHBondContact O-CB 3.5Å; I129-S132 PolarHBondContact O-N 3.09Å; I130-S132 VanDerWaalsContact C-N 3.33Å; I130-S132 PolarHBondContact O-N 3.48Å; S132-I136 PolarHBondContact O-N 3.41Å
133C97.2Very high96.5Very high10 Ų1014.8 Ų14.87%0.0688%0.081CC..Hα-helixtrans-68.5-42.5175.8-62.60000111.9C93 V96 E97 I129 I130 N131 G135 I136 H137C93-C133 HydrophobicContact CB-CB 3.93Å; V96-C133 VanDerWaalsContact CG1-SG 3.52Å; E97-C133 HydrophobicContact CG-CB 3.57Å; E97-C133 VanDerWaalsContact OE1-CB 3.26Å; E97-C133 WeakPolarHBondContact OE1-CB 3.29Å; I129-C133 PolarHBondContact O-N 3.36Å; I129-C133 PolarHBondContact O-SG 2.84Å; I129-C133 VanDerWaalsContact O-SG 3.35Å; I130-C133 WeakPolarHBondContact O-CB 3.42Å; I130-C133 PolarHBondContact O-N 3.04Å; I130-C133 VanDerWaalsContact O-N 3.1Å; N131-C133 VanDerWaalsContact C-N 3.28Å; C133-G135 VanDerWaalsContact C-N 3.32Å; C133-G135 PolarHBondContact O-N 3.37Å; C133-I136 PolarHBondContact O-N 3.04Å; C133-I136 VanDerWaalsContact O-N 3.07Å; C133-H137 WeakPolarHBondContact O-CB 3.39Å; C133-H137 PolarHBondContact O-N 3.04Å
134V96.4Very high96.2Very high6 Ų616.4 Ų16.44%0.0369%0.089CC..Hα-helixtrans-54.6-46.3174.3167.70000111.5F23 P26 E97 I130 N131 I136 H137 Q138F23-V134 HydrophobicContact CB-CG1 4.35Å; F23-V134 WeakPolarHBondContact O-CG1 3.43Å; F23-V134 VanDerWaalsContact O-CG2 3.29Å; F23-V134 WeakPolarHBondContact O-CG2 3.48Å; P26-V134 HydrophobicContact CB-CG2 4.49Å; E97-V134 PolarHBondContact OE1-N 2.99Å; I130-V134 WeakPolarHBondContact O-CG2 3.14Å; I130-V134 PolarHBondContact O-N 3.1Å; N131-V134 PolarHBondContact O-N 2.85Å; V134-I136 VanDerWaalsContact C-N 3.29Å; V134-I136 PolarHBondContact O-N 3.4Å; V134-H137 PolarHBondContact O-N 3.41Å; V134-Q138 VanDerWaalsContact O-CB 3.24Å; V134-Q138 WeakPolarHBondContact O-CB 3Å; V134-Q138 PolarHBondContact O-N 3.07Å
135G96.8Very high96.1Very high0 Ų015 Ų150%08%0.082CC..Hα-helixtrans-59.8-37.7177.700000113.3N131 C133 T139N131-G135 PolarHBondContact O-N 3.25Å; C133-G135 VanDerWaalsContact C-N 3.32Å; C133-G135 PolarHBondContact O-N 3.37Å; G135-T139 WeakPolarHBondContact O-CG2 3.45Å; G135-T139 PolarHBondContact O-N 3.08Å; G135-T139 PolarHBondContact O-OG1 3.29Å
136I95.5Very high95.9Very high15 Ų1511 Ų118%0.0776%0.062CC..Hα-helixtrans-71.3-49.7174.5-64.7169.1000110.9F70 N74 C93 S132 C133 V134 Q138 T139 L140F70-I136 HydrophobicContact CB-CD1 4.47Å; F70-I136 HydrophobicContact CB-CG1 4.17Å; F70-I136 HydrophobicContact CD1-CD1 3.84Å; F70-I136 HydrophobicContact CD1-CG1 4.44Å; N74-I136 HydrophobicContact CB-CG1 4.2Å; C93-I136 VanDerWaalsContact SG-CB 3.55Å; C93-I136 WeakPolarHBondContact SG-CD1 3.37Å; C93-I136 WeakPolarHBondContact SG-CG2 3.11Å; S132-I136 PolarHBondContact O-N 3.41Å; C133-I136 PolarHBondContact O-N 3.04Å; C133-I136 VanDerWaalsContact O-N 3.07Å; V134-I136 VanDerWaalsContact C-N 3.29Å; V134-I136 PolarHBondContact O-N 3.4Å; I136-Q138 VanDerWaalsContact C-N 3.35Å; I136-Q138 PolarHBondContact O-N 3.14Å; I136-T139 PolarHBondContact O-N 3.34Å; I136-T139 PolarHBondContact O-OG1 3.48Å; I136-T139 VanDerWaalsContact O-OG1 3.05Å; I136-L140 HydrophobicContact CG2-CD1 3.58Å; I136-L140 HydrophobicContact CG2-CG 4.11Å; I136-L140 WeakPolarHBondContact O-CB 3.46Å; I136-L140 VanDerWaalsContact O-CG 3.27Å; I136-L140 WeakPolarHBondContact O-CG 3.43Å; I136-L140 PolarHBondContact O-N 3.04Å
137H95.5Very high95.4Very high1 Ų112.4 Ų12.41%0.0057%0.071CC..Hα-helixtrans-58.8-47.4-178.4177.9-163.2000110.5H19 F23 F90 M94 C133 V134 L140 T141H19-H137 AromaticContact ND1-NE2 3.34Å; H19-H137 PolarHBondContact ND1-NE2 3.27Å; F23-H137 HydrophobicContact CB-CB 4.33Å; F23-H137 WeakPolarHBondContact CB-ND1 3.3Å; F23-H137 PolarHBondContact N-CE1 3.47Å; F90-H137 AromaticContact CE2-CD2 3.29Å; F90-H137 WeakPolarHBondContact CE2-CD2 3.49Å; F90-H137 AromaticContact CE2-NE2 3.78Å; F90-H137 AromaticContact CZ-CD2 3.53Å; F90-H137 AromaticContact CZ-NE2 3.61Å; M94-H137 HydrophobicContact CE-CB 4.45Å; M94-H137 WeakPolarHBondContact CE-CE1 3.39Å; M94-H137 WeakPolarHBondContact CE-ND1 3.29Å; C133-H137 WeakPolarHBondContact O-CB 3.39Å; C133-H137 PolarHBondContact O-N 3.04Å; V134-H137 PolarHBondContact O-N 3.41Å; H137-L140 PolarHBondContact O-N 2.88Å; H137-T141 PolarHBondContact CD2-OG1 3.36Å; H137-T141 PolarHBondContact NE2-OG1 3.33Å; H137-T141 WeakPolarHBondContact O-CB 3.25Å; H137-T141 PolarHBondContact O-N 2.75Å; H137-T141 PolarHBondContact O-OG1 3.03Å
138Q96.3Very high95.1Very high11 Ų1112.4 Ų12.45%0.0517%0.071CC..Hα-helixtrans-60.7-50.6179.4-171.617410.400111.8F23 V134 I136 L140 T141 F142 L540F23-Q138 HydrophobicContact CB-CB 4.4Å; F23-Q138 HydrophobicContact CD1-CB 4.14Å; F23-Q138 HydrophobicContact CD1-CG 4.21Å; F23-Q138 HydrophobicContact CD2-CB 4.22Å; F23-Q138 HydrophobicContact CD2-CG 4.08Å; F23-Q138 HydrophobicContact CE1-CB 4.48Å; F23-Q138 HydrophobicContact CE1-CG 4.07Å; F23-Q138 HydrophobicContact CE2-CG 3.96Å; F23-Q138 HydrophobicContact CG-CB 4.02Å; F23-Q138 HydrophobicContact CG-CG 4.24Å; F23-Q138 HydrophobicContact CZ-CG 3.97Å; V134-Q138 VanDerWaalsContact O-CB 3.24Å; V134-Q138 WeakPolarHBondContact O-CB 3Å; V134-Q138 PolarHBondContact O-N 3.07Å; I136-Q138 VanDerWaalsContact C-N 3.35Å; I136-Q138 PolarHBondContact O-N 3.14Å; Q138-L140 PolarHBondContact O-N 3.03Å; Q138-T141 PolarHBondContact O-N 3.22Å; Q138-F142 HydrophobicContact CG-CD2 4.11Å; Q138-F142 HydrophobicContact CG-CE2 4.07Å; Q138-F142 WeakPolarHBondContact O-CD2 3.43Å; Q138-F142 PolarHBondContact O-N 3.13Å; Q138-F142 VanDerWaalsContact O-N 3.1Å; Q138-L540 VanDerWaalsContact NE2-CD2 3.29Å
139T95.8Very high94.8Very high0 Ų010 Ų100%06%0.057CC..Hα-helixtrans-63.6-42.9-179.947.80000112.1A71 N74 G135 I136 T141 F142 G143 M534 A537 I541A71-T139 HydrophobicContact CB-CG2 3.75Å; N74-T139 PolarHBondContact ND2-OG1 3.49Å; G135-T139 WeakPolarHBondContact O-CG2 3.45Å; G135-T139 PolarHBondContact O-N 3.08Å; G135-T139 PolarHBondContact O-OG1 3.29Å; I136-T139 PolarHBondContact O-N 3.34Å; I136-T139 PolarHBondContact O-OG1 3.48Å; I136-T139 VanDerWaalsContact O-OG1 3.05Å; T139-T141 VanDerWaalsContact C-N 3.34Å; T139-T141 PolarHBondContact O-N 3.42Å; T139-F142 PolarHBondContact O-N 3.17Å; T139-G143 PolarHBondContact O-N 3.12Å; T139-M534 VanDerWaalsContact O-CG 3.3Å; T139-M534 WeakPolarHBondContact O-CG 3.4Å; T139-A537 HydrophobicContact CG2-CB 3.87Å; T139-I541 HydrophobicContact CG2-CD1 4.48Å
140L94.3Very high94.5Very high5 Ų57.8 Ų7.83%0.0265%0.045CC..Hα-helixtrans-61.9-40.2175.3-70.5177.8000112.7P86 R89 F90 I136 H137 Q138 G143 I144 M534P86-L140 HydrophobicContact CB-CD2 3.99Å; R89-L140 HydrophobicContact CB-CD1 3.99Å; F90-L140 HydrophobicContact CB-CD1 3.85Å; F90-L140 HydrophobicContact CD2-CB 4.05Å; F90-L140 HydrophobicContact CD2-CD1 4.08Å; F90-L140 HydrophobicContact CG-CD1 4.46Å; I136-L140 HydrophobicContact CG2-CD1 3.58Å; I136-L140 HydrophobicContact CG2-CG 4.11Å; I136-L140 WeakPolarHBondContact O-CB 3.46Å; I136-L140 VanDerWaalsContact O-CG 3.27Å; I136-L140 WeakPolarHBondContact O-CG 3.43Å; I136-L140 PolarHBondContact O-N 3.04Å; H137-L140 PolarHBondContact O-N 2.88Å; Q138-L140 PolarHBondContact O-N 3.03Å; L140-G143 PolarHBondContact O-N 2.8Å; L140-I144 WeakPolarHBondContact O-CG1 3.27Å; L140-I144 PolarHBondContact O-N 3.3Å; L140-M534 HydrophobicContact CD2-CE 3.92Å
141T95.2Very high94.2Very high2 Ų211.9 Ų11.91%0.0126%0.063CC..Hα-helixtrans-62.2-48.6179.1-58.90000111.1L16 H19 H137 Q138 T139 G143 I144 A145 V156L16-T141 HydrophobicContact CD2-CG2 4.09Å; H19-T141 HydrophobicContact CB-CG2 3.63Å; H137-T141 PolarHBondContact CD2-OG1 3.36Å; H137-T141 PolarHBondContact NE2-OG1 3.33Å; H137-T141 WeakPolarHBondContact O-CB 3.25Å; H137-T141 PolarHBondContact O-N 2.75Å; H137-T141 PolarHBondContact O-OG1 3.03Å; Q138-T141 PolarHBondContact O-N 3.22Å; T139-T141 VanDerWaalsContact C-N 3.34Å; T139-T141 PolarHBondContact O-N 3.42Å; T141-G143 VanDerWaalsContact C-N 3.31Å; T141-G143 PolarHBondContact O-N 3.44Å; T141-I144 PolarHBondContact O-N 3.43Å; T141-A145 WeakPolarHBondContact O-CB 3.27Å; T141-A145 PolarHBondContact O-N 2.94Å; T141-V156 HydrophobicContact CG2-CB 4.49Å; T141-V156 HydrophobicContact CG2-CG1 3.79Å; T141-V156 HydrophobicContact CG2-CG2 3.77Å
142F95.8Very high94Very high3 Ų311.7 Ų11.71%0.0136%0.062CC..Hα-helixtrans-66-33.2175.8-82-73.8000112.8F23 Q138 T139 I144 A145 A146 V156 I157 L517 G533 A537F23-F142 HydrophobicContact CZ-CE2 4.42Å; Q138-F142 HydrophobicContact CG-CD2 4.11Å; Q138-F142 HydrophobicContact CG-CE2 4.07Å; Q138-F142 WeakPolarHBondContact O-CD2 3.43Å; Q138-F142 PolarHBondContact O-N 3.13Å; Q138-F142 VanDerWaalsContact O-N 3.1Å; T139-F142 PolarHBondContact O-N 3.17Å; F142-I144 VanDerWaalsContact C-N 3.33Å; F142-I144 PolarHBondContact O-N 3.45Å; F142-A145 PolarHBondContact O-N 3.22Å; F142-A146 WeakPolarHBondContact O-CB 3.36Å; F142-A146 PolarHBondContact O-N 3.06Å; F142-V156 HydrophobicContact CD2-CG1 4.33Å; F142-V156 HydrophobicContact CE1-CB 4.02Å; F142-V156 HydrophobicContact CE1-CG1 4.06Å; F142-V156 HydrophobicContact CE2-CG1 3.8Å; F142-V156 HydrophobicContact CZ-CB 4.03Å; F142-V156 HydrophobicContact CZ-CG1 3.65Å; F142-I157 HydrophobicContact CE1-CD1 4.29Å; F142-I157 HydrophobicContact CE1-CG1 3.82Å; F142-I157 HydrophobicContact CZ-CG1 3.75Å; F142-L517 HydrophobicContact CD1-CD2 4.05Å; F142-L517 HydrophobicContact CE1-CB 4.41Å; F142-L517 HydrophobicContact CE1-CD1 3.98Å; F142-L517 HydrophobicContact CE1-CD2 3.93Å; F142-L517 HydrophobicContact CE1-CG 4.33Å; F142-L517 HydrophobicContact CZ-CD1 3.99Å; F142-L517 HydrophobicContact CZ-CD2 4.37Å; F142-G533 WeakPolarHBondContact CB-O 3.38Å; F142-A537 HydrophobicContact CB-CB 3.87Å; F142-A537 HydrophobicContact CD2-CB 3.55Å; F142-A537 HydrophobicContact CE2-CB 4.41Å; F142-A537 HydrophobicContact CG-CB 3.96Å
143G93.4Very high93.9Very high3 Ų311.4 Ų11.43%0.0316%0.06CC..Hα-helixtrans-61.3-40172.700000113T139 L140 T141 P530T139-G143 PolarHBondContact O-N 3.12Å; L140-G143 PolarHBondContact O-N 2.8Å; T141-G143 VanDerWaalsContact C-N 3.31Å; T141-G143 PolarHBondContact O-N 3.44Å; G143-P530 WeakPolarHBondContact CA-O 3.46Å; G143-P530 WeakPolarHBondContact O-CA 3.26Å; G143-P530 VanDerWaalsContact O-CB 3.25Å; G143-P530 WeakPolarHBondContact O-CB 3.48Å
144I91.7Very high93.9Very high38 Ų3811 Ų1120%0.1956%0.057CC..Hα-helixtrans-70.6-48.3174.6-66.7168.3000110.4L140 T141 F142 A146 S147 F210 L213L140-I144 WeakPolarHBondContact O-CG1 3.27Å; L140-I144 PolarHBondContact O-N 3.3Å; T141-I144 PolarHBondContact O-N 3.43Å; F142-I144 VanDerWaalsContact C-N 3.33Å; F142-I144 PolarHBondContact O-N 3.45Å; I144-A146 PolarHBondContact O-N 2.88Å; I144-S147 WeakPolarHBondContact O-CB 3.32Å; I144-S147 PolarHBondContact O-N 3.31Å; I144-S147 PolarHBondContact O-OG 3.47Å; I144-F210 HydrophobicContact CD1-CD2 4.29Å; I144-F210 HydrophobicContact CD1-CE2 3.62Å; I144-L213 HydrophobicContact CG2-CD2 4Å
145A94.2Very high93.9Very high0 Ų010.7 Ų10.70%06%0.055CC..Hα-helixtrans-59.6-36.7-178.700000112.4L16 T141 F142 S147 L148 V156L16-A145 HydrophobicContact CD1-CB 4.01Å; L16-A145 HydrophobicContact CD2-CB 4.19Å; T141-A145 WeakPolarHBondContact O-CB 3.27Å; T141-A145 PolarHBondContact O-N 2.94Å; F142-A145 PolarHBondContact O-N 3.22Å; A145-S147 PolarHBondContact O-N 3.07Å; A145-L148 WeakPolarHBondContact O-CB 3.26Å; A145-L148 PolarHBondContact O-N 3.36Å; A145-V156 HydrophobicContact CB-CG2 3.95Å
146A93.5Very high93.9Very high2 Ų210.7 Ų10.72%0.0176%0.055CC..THydrogen-bonded Turntrans-65.2-19.1176.400000114.5F142 I144 P521 A529F142-A146 WeakPolarHBondContact O-CB 3.36Å; F142-A146 PolarHBondContact O-N 3.06Å; I144-A146 PolarHBondContact O-N 2.88Å; A146-P521 HydrophobicContact CB-CB 3.73Å; A146-P521 HydrophobicContact CB-CG 3.45Å; A146-P521 VanDerWaalsContact CB-CG 3.45Å; A146-A529 VanDerWaalsContact CB-O 3.29Å; A146-A529 WeakPolarHBondContact CB-O 3.36Å
147S88Confident93.9Very high32 Ų3210 Ų1022%0.2245%0.052CC..THydrogen-bonded Turntrans-78.3-10.7172.472.30000113.5I144 A145I144-S147 WeakPolarHBondContact O-CB 3.32Å; I144-S147 PolarHBondContact O-N 3.31Å; I144-S147 PolarHBondContact O-OG 3.47Å; A145-S147 PolarHBondContact O-N 3.07Å
148L90.8Very high94Very high0 Ų010.2 Ų10.20%05%0.053CC..SBendtrans-108.3170.3-177.9-56.3177.9000110L16 A145 Y152 F218 V219 Y222 R522L16-L148 HydrophobicContact CD1-CD1 3.89Å; A145-L148 WeakPolarHBondContact O-CB 3.26Å; A145-L148 PolarHBondContact O-N 3.36Å; L148-Y152 HydrophobicContact CB-CD2 3.69Å; L148-Y152 HydrophobicContact CB-CE2 4.45Å; L148-Y152 HydrophobicContact CB-CG 3.9Å; L148-Y152 HydrophobicContact CD1-CD1 4.29Å; L148-Y152 HydrophobicContact CD1-CD2 4.48Å; L148-Y152 HydrophobicContact CD1-CG 4.07Å; L148-F218 HydrophobicContact CD1-CE1 4.33Å; L148-F218 HydrophobicContact CD2-CD1 4.37Å; L148-F218 HydrophobicContact CD2-CE1 3.91Å; L148-V219 HydrophobicContact CD1-CG2 4.29Å; L148-V219 HydrophobicContact CD2-CG2 4.21Å; L148-Y222 HydrophobicContact CD2-CD2 4.32Å; L148-Y222 HydrophobicContact CD2-CG 4.2Å; L148-R522 PolarHBondContact O-NH2 3.2Å
149P90.8Very high94Very high2 Ų29.7 Ų9.71%0.0135%0.051CC..  trans-46.6148.4170.7-32.238.7000113.6K151 Y152 F218 Y222P149-K151 HydrophobicContact CB-CG 4.33Å; P149-K151 PolarHBondContact O-N 3.19Å; P149-Y152 HydrophobicContact CB-CD2 3.84Å; P149-Y152 HydrophobicContact CB-CE2 3.95Å; P149-Y152 HydrophobicContact CG-CD2 4.16Å; P149-Y152 HydrophobicContact CG-CE2 3.96Å; P149-Y152 WeakPolarHBondContact O-CB 3.43Å; P149-Y152 VanDerWaalsContact O-CD2 3.3Å; P149-Y152 WeakPolarHBondContact O-CD2 3.33Å; P149-Y152 PolarHBondContact O-N 3.48Å; P149-F218 HydrophobicContact CG-CZ 4.18Å; P149-Y222 HydrophobicContact CG-CE1 3.82Å; P149-Y222 HydrophobicContact CG-CE2 4.12Å; P149-Y222 VanDerWaalsContact CG-CZ 3.46Å; P149-Y222 WeakPolarHBondContact CG-OH 3.38Å
150M91.7Very high94Very high22 Ų2210.5 Ų10.511%0.1086%0.057CC..Hα-helixtrans-53.7-34.6-170.9-69-173.8-72.800114Y152 S153 N154 M518 Y519 R522M150-Y152 PolarHBondContact O-N 3.36Å; M150-S153 PolarHBondContact O-N 3.37Å; M150-N154 PolarHBondContact O-N 2.94Å; M150-M518 HydrophobicContact CB-CB 4.04Å; M150-M518 HydrophobicContact CB-CE 3.62Å; M150-M518 HydrophobicContact CB-CG 4.18Å; M150-M518 HydrophobicContact CG-CB 4.34Å; M150-M518 HydrophobicContact SD-CB 4.22Å; M150-Y519 HydrophobicContact SD-CD1 4.14Å; M150-Y519 HydrophobicContact SD-CE1 4.49Å; M150-R522 HydrophobicContact CG-CG 3.58Å; M150-R522 HydrophobicContact SD-CG 3.67Å
151K91.4Very high94.1Very high86 Ų8610.9 Ų10.937%0.3746%0.059SC..Hα-helixtrans-54.3-26.8177.466.9-179.1-179.1-179.10113.8Y13 P149 N154 A155Y13-K151 WeakPolarHBondContact CE2-O 3.5Å; P149-K151 HydrophobicContact CB-CG 4.33Å; P149-K151 PolarHBondContact O-N 3.19Å; K151-N154 PolarHBondContact O-N 3.43Å; K151-A155 PolarHBondContact O-N 3.43Å
152Y93.1Very high94.1Very high0 Ų011.1 Ų11.10%06%0.061CC..Hα-helixtrans-78.6-33.7179.7-68-78.5000112.5Y9 A12 Y13 L16 L148 P149 M150 N154 A155 F218Y9-Y152 PolarHBondContact O-OH 3.33Å; A12-Y152 HydrophobicContact CB-CD1 4.28Å; A12-Y152 HydrophobicContact CB-CE1 3.68Å; Y13-Y152 HydrophobicContact CD2-CD1 4.44Å; L16-Y152 HydrophobicContact CD1-CD1 3.98Å; L16-Y152 HydrophobicContact CD1-CG 4.23Å; L148-Y152 HydrophobicContact CB-CD2 3.69Å; L148-Y152 HydrophobicContact CB-CE2 4.45Å; L148-Y152 HydrophobicContact CB-CG 3.9Å; L148-Y152 HydrophobicContact CD1-CD1 4.29Å; L148-Y152 HydrophobicContact CD1-CD2 4.48Å; L148-Y152 HydrophobicContact CD1-CG 4.07Å; P149-Y152 HydrophobicContact CB-CD2 3.84Å; P149-Y152 HydrophobicContact CB-CE2 3.95Å; P149-Y152 HydrophobicContact CG-CD2 4.16Å; P149-Y152 HydrophobicContact CG-CE2 3.96Å; P149-Y152 WeakPolarHBondContact O-CB 3.43Å; P149-Y152 VanDerWaalsContact O-CD2 3.3Å; P149-Y152 WeakPolarHBondContact O-CD2 3.33Å; P149-Y152 PolarHBondContact O-N 3.48Å; M150-Y152 PolarHBondContact O-N 3.36Å; Y152-N154 VanDerWaalsContact C-N 3.3Å; Y152-A155 WeakPolarHBondContact O-CB 3.35Å; Y152-A155 PolarHBondContact O-N 3.42Å; Y152-F218 HydrophobicContact CD2-CE1 4.31Å; Y152-F218 HydrophobicContact CD2-CZ 4.4Å; Y152-F218 HydrophobicContact CE1-CE1 4.09Å; Y152-F218 AromaticContact CE2-CE1 3.52Å; Y152-F218 HydrophobicContact CE2-CE1 3.52Å; Y152-F218 AromaticContact CE2-CZ 3.4Å; Y152-F218 HydrophobicContact CE2-CZ 3.4Å; Y152-F218 AromaticContact CZ-CE1 3.36Å; Y152-F218 AromaticContact CZ-CZ 3.54Å; Y152-F218 VanDerWaalsContact OH-CE1 3.26Å; Y152-F218 WeakPolarHBondContact OH-CE1 3.42Å; Y152-F218 VanDerWaalsContact OH-CZ 3.23Å; Y152-F218 WeakPolarHBondContact OH-CZ 3.44Å
153S95.3Very high94.1Very high2 Ų211.1 Ų11.11%0.0146%0.061CC..Hα-helixtrans-62.9-41.4167.3-63.30000110.7M150 A155 V156M150-S153 PolarHBondContact O-N 3.37Å; S153-A155 VanDerWaalsContact C-N 3.34Å; S153-A155 PolarHBondContact O-N 3.22Å; S153-V156 PolarHBondContact O-N 3.49Å
154N95.6Very high94.1Very high0 Ų011.4 Ų11.40%06%0.064CC..Hα-helixtrans-63.7-38.7175.7-167.832.8000112.4M150 K151 Y152 V156 I157 V158 C447 N451 S514 M518M150-N154 PolarHBondContact O-N 2.94Å; K151-N154 PolarHBondContact O-N 3.43Å; Y152-N154 VanDerWaalsContact C-N 3.3Å; N154-V156 PolarHBondContact O-N 3.14Å; N154-I157 WeakPolarHBondContact O-CA 3.44Å; N154-I157 WeakPolarHBondContact O-CB 3.32Å; N154-I157 PolarHBondContact O-N 3.23Å; N154-V158 WeakPolarHBondContact O-CG2 3.36Å; N154-V158 PolarHBondContact O-N 3.44Å; N154-C447 PolarHBondContact ND2-O 3.36Å; N154-C447 PolarHBondContact OD1-O 3.08Å; N154-N451 VanDerWaalsContact ND2-CG 3.3Å; N154-N451 PolarHBondContact ND2-ND2 2.94Å; N154-N451 PolarHBondContact ND2-OD1 2.95Å; N154-S514 VanDerWaalsContact OD1-CB 3.25Å; N154-S514 WeakPolarHBondContact OD1-CB 3.2Å; N154-S514 PolarHBondContact OD1-OG 3.44Å; N154-S514 VanDerWaalsContact OD1-OG 3.1Å; N154-M518 HydrophobicContact CB-CE 4.49Å; N154-M518 HydrophobicContact CB-CG 4.09Å; N154-M518 HydrophobicContact CB-SD 3.73Å
155A96.6Very high94.3Very high0 Ų010.2 Ų10.20%06%0.06CC..Hα-helixtrans-51.8-42177.300000112.6Y13 L16 F17 K151 Y152 S153 I157 V158 G159Y13-A155 HydrophobicContact CD1-CB 4.13Å; Y13-A155 HydrophobicContact CD2-CB 3.62Å; Y13-A155 HydrophobicContact CE1-CB 3.98Å; Y13-A155 HydrophobicContact CE2-CB 3.47Å; Y13-A155 VanDerWaalsContact CE2-CB 3.47Å; Y13-A155 HydrophobicContact CG-CB 3.95Å; L16-A155 HydrophobicContact CB-CB 4.22Å; F17-A155 WeakPolarHBondContact CA-O 3.41Å; K151-A155 PolarHBondContact O-N 3.43Å; Y152-A155 WeakPolarHBondContact O-CB 3.35Å; Y152-A155 PolarHBondContact O-N 3.42Å; S153-A155 VanDerWaalsContact C-N 3.34Å; S153-A155 PolarHBondContact O-N 3.22Å; A155-I157 VanDerWaalsContact C-N 3.31Å; A155-I157 PolarHBondContact O-N 2.77Å; A155-V158 PolarHBondContact O-N 2.79Å; A155-G159 PolarHBondContact O-N 2.69Å
156V97.7Very high94.3Very high0 Ų014.9 Ų14.90%08%0.084CC..Hα-helixtrans-61-40.5177.1-175.50000111.5L16 G20 F23 T141 F142 A145 S153 N154 G159 S160L16-V156 HydrophobicContact CB-CG2 3.92Å; L16-V156 HydrophobicContact CD2-CG2 4.08Å; L16-V156 HydrophobicContact CG-CG2 4.49Å; G20-V156 VanDerWaalsContact CA-O 3.23Å; G20-V156 WeakPolarHBondContact CA-O 3.43Å; F23-V156 HydrophobicContact CE1-CG1 3.56Å; F23-V156 HydrophobicContact CZ-CG1 3.93Å; T141-V156 HydrophobicContact CG2-CB 4.49Å; T141-V156 HydrophobicContact CG2-CG1 3.79Å; T141-V156 HydrophobicContact CG2-CG2 3.77Å; F142-V156 HydrophobicContact CD2-CG1 4.33Å; F142-V156 HydrophobicContact CE1-CB 4.02Å; F142-V156 HydrophobicContact CE1-CG1 4.06Å; F142-V156 HydrophobicContact CE2-CG1 3.8Å; F142-V156 HydrophobicContact CZ-CB 4.03Å; F142-V156 HydrophobicContact CZ-CG1 3.65Å; A145-V156 HydrophobicContact CB-CG2 3.95Å; S153-V156 PolarHBondContact O-N 3.49Å; N154-V156 PolarHBondContact O-N 3.14Å; V156-G159 PolarHBondContact O-N 3.41Å; V156-S160 PolarHBondContact O-N 2.82Å
157I96.2Very high94.3Very high1 Ų116 Ų161%0.0059%0.089CC..Hα-helixtrans-74.5-41.9-178.6-51.4165000110.6F142 N154 A155 G159 S160 N161 C447 L517F142-I157 HydrophobicContact CE1-CD1 4.29Å; F142-I157 HydrophobicContact CE1-CG1 3.82Å; F142-I157 HydrophobicContact CZ-CG1 3.75Å; N154-I157 WeakPolarHBondContact O-CA 3.44Å; N154-I157 WeakPolarHBondContact O-CB 3.32Å; N154-I157 PolarHBondContact O-N 3.23Å; A155-I157 VanDerWaalsContact C-N 3.31Å; A155-I157 PolarHBondContact O-N 2.77Å; I157-G159 VanDerWaalsContact C-N 3.26Å; I157-G159 PolarHBondContact O-N 3.31Å; I157-S160 WeakPolarHBondContact O-CB 3.47Å; I157-S160 PolarHBondContact O-N 3.42Å; I157-S160 VanDerWaalsContact O-N 3.16Å; I157-N161 PolarHBondContact O-N 3.09Å; I157-C447 VanDerWaalsContact CG2-SG 3.57Å; I157-L517 HydrophobicContact CD1-CB 3.59Å; I157-L517 HydrophobicContact CD1-CD1 3.33Å; I157-L517 HydrophobicContact CD1-CG 4.08Å; I157-L517 HydrophobicContact CG1-CD1 3.77Å
158V96.7Very high94.6Very high5 Ų514.7 Ų14.73%0.038%0.08CC..Hα-helixtrans-57.7-43.7173.3-176.90000109.6F17 N154 A155 N161 A162 M444 C447 I448F17-V158 HydrophobicContact CD2-CB 4.25Å; F17-V158 HydrophobicContact CD2-CG1 4.11Å; F17-V158 HydrophobicContact CE2-CB 4.46Å; F17-V158 HydrophobicContact CE2-CG1 3.91Å; N154-V158 WeakPolarHBondContact O-CG2 3.36Å; N154-V158 PolarHBondContact O-N 3.44Å; A155-V158 PolarHBondContact O-N 2.79Å; V158-N161 PolarHBondContact O-N 3.03Å; V158-A162 VanDerWaalsContact O-CB 3.29Å; V158-A162 WeakPolarHBondContact O-CB 3.28Å; V158-A162 PolarHBondContact O-N 3.46Å; V158-M444 HydrophobicContact CG1-CG 4.11Å; V158-C447 HydrophobicContact CB-CB 4.44Å; V158-C447 HydrophobicContact CG2-CB 3.55Å; V158-I448 HydrophobicContact CG1-CD1 4.23Å; V158-I448 HydrophobicContact CG1-CG1 3.77Å; V158-I448 HydrophobicContact CG2-CG1 4.23Å
159G96.8Very high94.8Very high0 Ų019 Ų190%010%0.102CC..Hα-helixtrans-60.5-44174.400000113.4F17 I21 A155 V156 I157 N161 A162 C163F17-G159 VanDerWaalsContact CD2-CA 3.42Å; F17-G159 VanDerWaalsContact CE2-CA 3.47Å; F17-G159 WeakPolarHBondContact O-CA 3.49Å; I21-G159 WeakPolarHBondContact CG1-O 3.47Å; A155-G159 PolarHBondContact O-N 2.69Å; V156-G159 PolarHBondContact O-N 3.41Å; I157-G159 VanDerWaalsContact C-N 3.26Å; I157-G159 PolarHBondContact O-N 3.31Å; G159-N161 PolarHBondContact O-N 3.17Å; G159-A162 PolarHBondContact O-N 3.44Å; G159-C163 PolarHBondContact O-N 3.26Å
160S95.7Very high94.9Very high18 Ų1821.1 Ų21.113%0.12612%0.116CC..Hα-helixtrans-57.9-46.5175.3158.20000112.2G20 L24 V156 I157 C163 G164G20-S160 WeakPolarHBondContact O-CA 2.95Å; L24-S160 VanDerWaalsContact CD1-O 3.29Å; L24-S160 WeakPolarHBondContact CD1-O 3.37Å; L24-S160 VanDerWaalsContact CD1-OG 3.23Å; L24-S160 WeakPolarHBondContact CD1-OG 3.44Å; V156-S160 PolarHBondContact O-N 2.82Å; I157-S160 WeakPolarHBondContact O-CB 3.47Å; I157-S160 PolarHBondContact O-N 3.42Å; I157-S160 VanDerWaalsContact O-N 3.16Å; S160-C163 WeakPolarHBondContact O-CB 3.44Å; S160-C163 PolarHBondContact O-N 3.46Å; S160-G164 PolarHBondContact O-N 3.35Å
161N95.2Very high94.9Very high13 Ų1322.3 Ų22.37%0.0712%0.122CC..Hα-helixtrans-73.3-33178.3-67.9-18.1000112.7I157 V158 G159 C163 G164 A165 A443 M444 C447I157-N161 PolarHBondContact O-N 3.09Å; V158-N161 PolarHBondContact O-N 3.03Å; G159-N161 PolarHBondContact O-N 3.17Å; N161-C163 VanDerWaalsContact C-N 3.32Å; N161-C163 PolarHBondContact O-N 3.17Å; N161-G164 PolarHBondContact O-N 3.1Å; N161-A165 PolarHBondContact O-N 3.21Å; N161-A443 PolarHBondContact ND2-O 3.46Å; N161-M444 HydrophobicContact CB-CB 3.82Å; N161-M444 HydrophobicContact CB-CG 4.45Å; N161-C447 PolarHBondContact ND2-SG 2.97Å
162A95.2Very high95Very high7 Ų719.8 Ų19.86%0.05811%0.113CC..Hα-helixtrans-61.3-41.6172.600000111.5F17 V158 G159 G164 A165 I166 M444F17-A162 HydrophobicContact CE2-CB 3.83Å; F17-A162 HydrophobicContact CZ-CB 3.64Å; V158-A162 VanDerWaalsContact O-CB 3.29Å; V158-A162 WeakPolarHBondContact O-CB 3.28Å; V158-A162 PolarHBondContact O-N 3.46Å; G159-A162 PolarHBondContact O-N 3.44Å; A162-G164 VanDerWaalsContact C-N 3.35Å; A162-G164 PolarHBondContact O-N 3.21Å; A162-A165 PolarHBondContact O-N 2.97Å; A162-I166 VanDerWaalsContact O-CG1 3.27Å; A162-I166 WeakPolarHBondContact O-CG1 3.39Å; A162-I166 PolarHBondContact O-N 2.97Å; A162-M444 HydrophobicContact CB-SD 3.66Å
163C96.1Very high95Very high2 Ų223.9 Ų23.91%0.01413%0.133CC..Hα-helixtrans-55-50.2173-179.80000111.4I21 L24 I25 G159 S160 N161 A165 I166 I167I21-C163 HydrophobicContact CB-CB 4.33Å; I21-C163 HydrophobicContact CG1-CB 4.18Å; I21-C163 HydrophobicContact CG2-CB 4.14Å; L24-C163 HydrophobicContact CB-CB 4.4Å; L24-C163 HydrophobicContact CD1-CB 4.36Å; I25-C163 WeakPolarHBondContact CG1-SG 2.93Å; G159-C163 PolarHBondContact O-N 3.26Å; S160-C163 WeakPolarHBondContact O-CB 3.44Å; S160-C163 PolarHBondContact O-N 3.46Å; N161-C163 VanDerWaalsContact C-N 3.32Å; N161-C163 PolarHBondContact O-N 3.17Å; C163-A165 VanDerWaalsContact C-N 3.3Å; C163-A165 PolarHBondContact O-N 2.95Å; C163-I166 PolarHBondContact O-N 2.66Å; C163-I167 WeakPolarHBondContact O-CB 3.43Å; C163-I167 WeakPolarHBondContact O-CD1 3.37Å; C163-I167 VanDerWaalsContact O-CG1 3.28Å; C163-I167 WeakPolarHBondContact O-CG1 3.24Å; C163-I167 PolarHBondContact O-N 3.5Å; C163-I167 VanDerWaalsContact SG-CD1 3.52Å
164G94.6Very high94.7Very high9 Ų925.5 Ų25.59%0.09314%0.144CC..Hα-helixtrans-61.8-36177.700000113.4S160 N161 A162 S168 N440S160-G164 PolarHBondContact O-N 3.35Å; N161-G164 PolarHBondContact O-N 3.1Å; A162-G164 VanDerWaalsContact C-N 3.35Å; A162-G164 PolarHBondContact O-N 3.21Å; G164-S168 WeakPolarHBondContact O-CB 3.43Å; G164-S168 PolarHBondContact O-N 2.87Å; G164-S168 PolarHBondContact O-OG 3.36Å; G164-N440 VanDerWaalsContact C-CB 3.49Å; G164-N440 WeakPolarHBondContact CA-OD1 3.36Å; G164-N440 PolarHBondContact O-ND2 3.41Å
165A95.4Very high94.4Very high13 Ų1328.2 Ų28.211%0.10716%0.155CC..Hα-helixtrans-68.8-44.5177.600000111.4N161 A162 C163 I167 S168 L169 N440 V441N161-A165 PolarHBondContact O-N 3.21Å; A162-A165 PolarHBondContact O-N 2.97Å; C163-A165 VanDerWaalsContact C-N 3.3Å; C163-A165 PolarHBondContact O-N 2.95Å; A165-I167 VanDerWaalsContact C-N 3.34Å; A165-I167 PolarHBondContact O-N 2.87Å; A165-S168 PolarHBondContact O-N 3.36Å; A165-L169 PolarHBondContact O-N 2.95Å; A165-N440 HydrophobicContact CB-CB 3.98Å; A165-V441 HydrophobicContact CB-CG2 4.17Å
166I94.4Very high94.1Very high98 Ų9830.8 Ų30.850%0.50317%0.174SC..Hα-helixtrans-58-48.8174.6-68.9164000110A162 C163 S168 L169 V170A162-I166 VanDerWaalsContact O-CG1 3.27Å; A162-I166 WeakPolarHBondContact O-CG1 3.39Å; A162-I166 PolarHBondContact O-N 2.97Å; C163-I166 PolarHBondContact O-N 2.66Å; I166-S168 PolarHBondContact O-N 3.45Å; I166-L169 PolarHBondContact O-N 3.18Å; I166-V170 HydrophobicContact CG2-CG2 4.43Å; I166-V170 VanDerWaalsContact O-CG2 3.3Å; I166-V170 WeakPolarHBondContact O-CG2 3.25Å; I166-V170 PolarHBondContact O-N 3.18Å
167I93.4Very high93.7Very high25 Ų2535.7 Ų35.713%0.12820%0.199CC..Hα-helixtrans-60.7-45.5179-73.1161.4000111.6N28 N32 C163 A165 L169 V170 N171N28-I167 HydrophobicContact CB-CD1 3.33Å; N28-I167 HydrophobicContact CB-CG1 4.48Å; N32-I167 VanDerWaalsContact CG-CG2 3.42Å; N32-I167 WeakPolarHBondContact ND2-CG2 3.34Å; N32-I167 WeakPolarHBondContact OD1-CG2 3.42Å; C163-I167 WeakPolarHBondContact O-CB 3.43Å; C163-I167 WeakPolarHBondContact O-CD1 3.37Å; C163-I167 VanDerWaalsContact O-CG1 3.28Å; C163-I167 WeakPolarHBondContact O-CG1 3.24Å; C163-I167 PolarHBondContact O-N 3.5Å; C163-I167 VanDerWaalsContact SG-CD1 3.52Å; A165-I167 VanDerWaalsContact C-N 3.34Å; A165-I167 PolarHBondContact O-N 2.87Å; I167-L169 VanDerWaalsContact C-N 3.3Å; I167-L169 PolarHBondContact O-N 3.32Å; I167-V170 PolarHBondContact O-N 3.42Å; I167-N171 PolarHBondContact O-N 3.47Å
168S94.6Very high93.1Very high6 Ų637.2 Ų37.24%0.04221%0.209CC..Hα-helixtrans-61.3-40.9179.7-580000111.4G164 A165 I166 N171 I172 F436 N440G164-S168 WeakPolarHBondContact O-CB 3.43Å; G164-S168 PolarHBondContact O-N 2.87Å; G164-S168 PolarHBondContact O-OG 3.36Å; A165-S168 PolarHBondContact O-N 3.36Å; I166-S168 PolarHBondContact O-N 3.45Å; S168-N171 PolarHBondContact O-N 3.16Å; S168-I172 WeakPolarHBondContact O-CG1 3.12Å; S168-I172 PolarHBondContact O-N 2.93Å; S168-I172 VanDerWaalsContact O-N 3.09Å; S168-F436 PolarHBondContact OG-O 3.21Å; S168-N440 PolarHBondContact OG-ND2 3.07Å
169L95Very high92.6Very high89 Ų8941.9 Ų41.947%0.46623%0.233SC..Hα-helixtrans-66-43.6175.6-177.761.5000111.8A165 I166 I167 N171 I172 I173A165-L169 PolarHBondContact O-N 2.95Å; I166-L169 PolarHBondContact O-N 3.18Å; I167-L169 VanDerWaalsContact C-N 3.3Å; I167-L169 PolarHBondContact O-N 3.32Å; L169-N171 VanDerWaalsContact C-N 3.29Å; L169-N171 PolarHBondContact O-N 2.74Å; L169-I172 PolarHBondContact O-N 3.44Å; L169-I173 HydrophobicContact CD1-CD1 4.23Å; L169-I173 HydrophobicContact CD1-CG1 4.45Å; L169-I173 HydrophobicContact CG-CD1 3.94Å; L169-I173 WeakPolarHBondContact O-CG1 3.29Å; L169-I173 PolarHBondContact O-N 3.44Å
170V92.2Very high92.1Very high48 Ų4846.6 Ų46.629%0.29127%0.265SS..Hα-helixtrans-60.9-39.3176.5171.90000111.1I166 I167 I173 T174 F195I166-V170 HydrophobicContact CG2-CG2 4.43Å; I166-V170 VanDerWaalsContact O-CG2 3.3Å; I166-V170 WeakPolarHBondContact O-CG2 3.25Å; I166-V170 PolarHBondContact O-N 3.18Å; I167-V170 PolarHBondContact O-N 3.42Å; V170-I173 PolarHBondContact O-N 2.94Å; V170-T174 VanDerWaalsContact O-CB 3.25Å; V170-T174 WeakPolarHBondContact O-CB 3.35Å; V170-T174 PolarHBondContact O-N 3.49Å; V170-T174 PolarHBondContact O-OG1 3.36Å; V170-F195 HydrophobicContact CG1-CE1 3.53Å; V170-F195 HydrophobicContact CG1-CZ 3.52Å
171N91.3Very high91.4Very high47 Ų4749.7 Ų49.725%0.25128%0.284SS..Hα-helixtrans-65.1-41.5175.8-72.1-13.6000112.4N32 I167 S168 L169 T174 K175N32-N171 PolarHBondContact OD1-ND2 3.27Å; I167-N171 PolarHBondContact O-N 3.47Å; S168-N171 PolarHBondContact O-N 3.16Å; L169-N171 VanDerWaalsContact C-N 3.29Å; L169-N171 PolarHBondContact O-N 2.74Å; N171-T174 PolarHBondContact O-N 3.15Å; N171-K175 VanDerWaalsContact O-CB 3.27Å; N171-K175 WeakPolarHBondContact O-CB 3.23Å; N171-K175 PolarHBondContact O-N 3.46Å
172I94.3Very high90.6Very high33 Ų3356 Ų5617%0.16932%0.322CS..Hα-helixtrans-61.9-47.2175.7-71.1169.1000110.6S168 L169 K175 S176 W429 D432 V433 L437S168-I172 WeakPolarHBondContact O-CG1 3.12Å; S168-I172 PolarHBondContact O-N 2.93Å; S168-I172 VanDerWaalsContact O-N 3.09Å; L169-I172 PolarHBondContact O-N 3.44Å; I172-K175 PolarHBondContact O-N 2.84Å; I172-S176 WeakPolarHBondContact O-CB 3.27Å; I172-S176 PolarHBondContact O-N 3.48Å; I172-W429 HydrophobicContact CG2-CZ3 4.17Å; I172-D432 HydrophobicContact CD1-CB 4.47Å; I172-D432 HydrophobicContact CG1-CB 4.02Å; I172-V433 HydrophobicContact CD1-CG2 4.48Å; I172-L437 HydrophobicContact CD1-CB 4.06Å; I172-L437 HydrophobicContact CD1-CD2 3.88Å; I172-L437 HydrophobicContact CD1-CG 4.41Å
173I91.8Very high89.7Confident85 Ų8559.8 Ų59.844%0.43634%0.337SS..Hα-helixtrans-61.2-47.3177.3-67167.7000110.2L169 V170 K175 S176 L177L169-I173 HydrophobicContact CD1-CD1 4.23Å; L169-I173 HydrophobicContact CD1-CG1 4.45Å; L169-I173 HydrophobicContact CG-CD1 3.94Å; L169-I173 WeakPolarHBondContact O-CG1 3.29Å; L169-I173 PolarHBondContact O-N 3.44Å; V170-I173 PolarHBondContact O-N 2.94Å; I173-K175 VanDerWaalsContact C-N 3.34Å; I173-K175 PolarHBondContact O-N 3.01Å; I173-S176 PolarHBondContact O-N 3.2Å; I173-L177 HydrophobicContact CG2-CD1 3.89Å; I173-L177 HydrophobicContact CG2-CG 4.35Å; I173-L177 WeakPolarHBondContact O-CG 3.29Å; I173-L177 PolarHBondContact O-N 3.07Å
174T89Confident89.2Confident37 Ų3762.6 Ų62.623%0.22736%0.357CS..Hα-helixtrans-60.5-43.4179.7-59.20000111.5V170 N171 T178V170-T174 VanDerWaalsContact O-CB 3.25Å; V170-T174 WeakPolarHBondContact O-CB 3.35Å; V170-T174 PolarHBondContact O-N 3.49Å; V170-T174 PolarHBondContact O-OG1 3.36Å; N171-T174 PolarHBondContact O-N 3.15Å; T174-T178 WeakPolarHBondContact O-CB 3.19Å; T174-T178 PolarHBondContact O-N 3.36Å; T174-T178 PolarHBondContact O-OG1 3.41Å
175K89.5Confident88.8Confident56 Ų5667.8 Ų67.824%0.24338%0.379CS..Hα-helixtrans-65-41175.6-178.6172.5168.4177.70111.7N171 I172 I173 T178 L179 L428 W429 D432N171-K175 VanDerWaalsContact O-CB 3.27Å; N171-K175 WeakPolarHBondContact O-CB 3.23Å; N171-K175 PolarHBondContact O-N 3.46Å; I172-K175 PolarHBondContact O-N 2.84Å; I173-K175 VanDerWaalsContact C-N 3.34Å; I173-K175 PolarHBondContact O-N 3.01Å; K175-T178 WeakPolarHBondContact O-CB 3.29Å; K175-T178 PolarHBondContact O-N 2.8Å; K175-L179 HydrophobicContact CG-CD1 4.22Å; K175-L179 VanDerWaalsContact O-CG 3.28Å; K175-L179 WeakPolarHBondContact O-CG 3.38Å; K175-L179 PolarHBondContact O-N 2.82Å; K175-L428 PolarHBondContact NZ-O 3.46Å; K175-W429 HydrophobicContact CB-CH2 4Å; K175-W429 HydrophobicContact CB-CZ3 3.86Å; K175-W429 HydrophobicContact CD-CE3 4.12Å; K175-W429 HydrophobicContact CD-CH2 4.03Å; K175-W429 HydrophobicContact CD-CZ3 3.54Å; K175-W429 HydrophobicContact CG-CH2 3.66Å; K175-W429 HydrophobicContact CG-CZ3 3.64Å; K175-D432 IonicContact NZ-OD2 3.22Å; K175-D432 PolarHBondContact NZ-OD2 3.21Å
176S91.1Very high88.5Confident55 Ų5576.3 Ų76.339%0.38541%0.408SS..Hα-helixtrans-64.8-45.3178.9177.60000112I172 I173 T178 L179 S180I172-S176 WeakPolarHBondContact O-CB 3.27Å; I172-S176 PolarHBondContact O-N 3.48Å; I173-S176 PolarHBondContact O-N 3.2Å; S176-T178 VanDerWaalsContact C-N 3.34Å; S176-T178 PolarHBondContact O-N 3.44Å; S176-L179 PolarHBondContact O-N 3.37Å; S176-S180 PolarHBondContact O-N 2.95Å; S176-S180 PolarHBondContact O-OG 3.43Å
177L88.1Confident88.2Confident103 Ų10374.7 Ų74.754%0.53941%0.406SS..Hα-helixtrans-63.6-41.3174.9-67.5174.2000111.3I173 L179 S180 T181I173-L177 HydrophobicContact CG2-CD1 3.89Å; I173-L177 HydrophobicContact CG2-CG 4.35Å; I173-L177 WeakPolarHBondContact O-CG 3.29Å; I173-L177 PolarHBondContact O-N 3.07Å; L177-L179 PolarHBondContact O-N 3.18Å; L177-S180 PolarHBondContact O-N 3.41Å; L177-T181 WeakPolarHBondContact O-CB 3.38Å; L177-T181 WeakPolarHBondContact O-CG2 3.5Å; L177-T181 PolarHBondContact O-N 3.23Å; L177-T181 VanDerWaalsContact O-N 3.09Å; L177-T181 PolarHBondContact O-OG1 3.15Å
178T83.8Confident88Confident33 Ų3375 Ų7520%0.20241%0.408CS..Hα-helixtrans-60.3-43.1176.1-72.90000112.4T174 K175 S176 S180 T181 K183T174-T178 WeakPolarHBondContact O-CB 3.19Å; T174-T178 PolarHBondContact O-N 3.36Å; T174-T178 PolarHBondContact O-OG1 3.41Å; K175-T178 WeakPolarHBondContact O-CB 3.29Å; K175-T178 PolarHBondContact O-N 2.8Å; S176-T178 VanDerWaalsContact C-N 3.34Å; S176-T178 PolarHBondContact O-N 3.44Å; T178-S180 PolarHBondContact O-N 3.14Å; T178-T181 PolarHBondContact O-N 3.28Å; T178-K183 HydrophobicContact CG2-CD 3.74Å; T178-K183 HydrophobicContact CG2-CG 4.15Å; T178-K183 VanDerWaalsContact CG2-NZ 3.32Å; T178-K183 WeakPolarHBondContact OG1-CE 3.41Å
179L87.1Confident87.8Confident103 Ų10376.1 Ų76.154%0.53941%0.413SS..Hα-helixtrans-66.6-24.5179.2-72167.1000112.3K175 S176 L177 L428 W429K175-L179 HydrophobicContact CG-CD1 4.22Å; K175-L179 VanDerWaalsContact O-CG 3.28Å; K175-L179 WeakPolarHBondContact O-CG 3.38Å; K175-L179 PolarHBondContact O-N 2.82Å; S176-L179 PolarHBondContact O-N 3.37Å; L177-L179 PolarHBondContact O-N 3.18Å; L179-L428 HydrophobicContact CD1-CD2 3.82Å; L179-W429 HydrophobicContact CD1-CH2 3.92Å; L179-W429 HydrophobicContact CD1-CZ2 3.61Å
180S86.3Confident87.6Confident98 Ų9876.2 Ų76.269%0.68541%0.413SS*.Hα-helixtrans-91.7-13.8-179.2-51.60000113.3S176 L177 T178S176-S180 PolarHBondContact O-N 2.95Å; S176-S180 PolarHBondContact O-OG 3.43Å; L177-S180 PolarHBondContact O-N 3.41Å; T178-S180 PolarHBondContact O-N 3.14Å
181T81.8Confident87.4Confident83 Ų8375.7 Ų75.751%0.50941%0.411SS..SBendtrans-130.1145.9-170.158.80000112.2L177 T178 K183L177-T181 WeakPolarHBondContact O-CB 3.38Å; L177-T181 WeakPolarHBondContact O-CG2 3.5Å; L177-T181 PolarHBondContact O-N 3.23Å; L177-T181 VanDerWaalsContact O-N 3.09Å; L177-T181 PolarHBondContact O-OG1 3.15Å; T178-T181 PolarHBondContact O-N 3.28Å; T181-K183 PolarHBondContact O-N 2.8Å
182V77.2Confident87.4Confident145 Ų14573.7 Ų73.788%0.87940%0.401SS*.  trans-70.6117.1171.6-179.60000108.6S184V182-S184 PolarHBondContact O-N 2.99Å; V182-S184 VanDerWaalsContact O-N 3.08Å
183K77.3Confident87.3Confident87 Ų8773.7 Ų73.738%0.37840%0.403SS..  trans-64.4108.2175.3-85.4176.1156.6167.30110.5E35 T178 T181E35-K183 IonicContact OE1-NZ 2.87Å; E35-K183 PolarHBondContact OE1-NZ 2.95Å; E35-K183 WeakPolarHBondContact OE2-CE 3.23Å; E35-K183 IonicContact OE2-NZ 3.63Å; E35-K183 PolarHBondContact OE2-NZ 2.95Å; T178-K183 HydrophobicContact CG2-CD 3.74Å; T178-K183 HydrophobicContact CG2-CG 4.15Å; T178-K183 VanDerWaalsContact CG2-NZ 3.32Å; T178-K183 WeakPolarHBondContact OG1-CE 3.41Å; T181-K183 PolarHBondContact O-N 2.8Å
184S85.6Confident87.3Confident61 Ų6174.6 Ų74.643%0.42741%0.407SS..  trans-86.7148.216579.80000110.7V182 R186 S187 I188V182-S184 PolarHBondContact O-N 2.99Å; V182-S184 VanDerWaalsContact O-N 3.08Å; S184-R186 PolarHBondContact O-N 3.36Å; S184-S187 WeakPolarHBondContact O-CB 3.36Å; S184-S187 PolarHBondContact O-N 2.68Å; S184-S187 PolarHBondContact OG-N 2.95Å; S184-S187 VanDerWaalsContact OG-N 3.14Å; S184-I188 PolarHBondContact O-N 3.36Å
185Q86.4Confident87.4Confident118 Ų11874.9 Ų74.955%0.55141%0.405SS*.Hα-helixtrans-49.7-41.6171.5168.8177.1-17.500112.4Y39 S187 I188 I189Y39-Q185 HydrophobicContact CE1-CG 4.15Å; Y39-Q185 HydrophobicContact CE2-CB 4.32Å; Y39-Q185 HydrophobicContact CE2-CG 3.74Å; Y39-Q185 VanDerWaalsContact CZ-CG 3.45Å; Y39-Q185 VanDerWaalsContact OH-CG 3.28Å; Y39-Q185 WeakPolarHBondContact OH-CG 3.49Å; Y39-Q185 PolarHBondContact OH-NE2 3.02Å; Q185-S187 VanDerWaalsContact C-N 3.34Å; Q185-S187 PolarHBondContact O-N 2.96Å; Q185-I188 PolarHBondContact O-N 2.99Å; Q185-I189 HydrophobicContact CG-CD1 4.3Å; Q185-I189 PolarHBondContact O-N 3.46Å
186R88.8Confident87.6Confident192 Ų19272.3 Ų72.373%0.72539%0.394SS*.Hα-helixtrans-63.3-40.1178.8-170.9-177-66.8160.4-0.4111.7S184 I188 I189 I190S184-R186 PolarHBondContact O-N 3.36Å; R186-I188 VanDerWaalsContact C-N 3.34Å; R186-I188 PolarHBondContact O-N 3.35Å; R186-I189 PolarHBondContact O-N 3.37Å; R186-I190 HydrophobicContact CG-CD1 3.81Å; R186-I190 HydrophobicContact CG-CG1 4.41Å; R186-I190 VanDerWaalsContact O-CG1 3.29Å; R186-I190 WeakPolarHBondContact O-CG1 3.36Å; R186-I190 PolarHBondContact O-N 3.28Å
187S88Confident87.8Confident65 Ų6573.8 Ų73.846%0.45540%0.398SS..Hα-helixtrans-63.4-38.9178.6-167.30000112.3S184 Q185 S191S184-S187 WeakPolarHBondContact O-CB 3.36Å; S184-S187 PolarHBondContact O-N 2.68Å; S184-S187 PolarHBondContact OG-N 2.95Å; S184-S187 VanDerWaalsContact OG-N 3.14Å; Q185-S187 VanDerWaalsContact C-N 3.34Å; Q185-S187 PolarHBondContact O-N 2.96Å; S187-S191 WeakPolarHBondContact O-CB 3.32Å; S187-S191 PolarHBondContact O-N 3.41Å
188I88Confident88Confident31 Ų3171 Ų7116%0.15939%0.387CS..Hα-helixtrans-63.9-46.6178.5-62.8172.3000110.4Y39 S184 Q185 R186 S191 A192Y39-I188 HydrophobicContact CD1-CG2 4.41Å; Y39-I188 HydrophobicContact CG-CG2 4.44Å; S184-I188 PolarHBondContact O-N 3.36Å; Q185-I188 PolarHBondContact O-N 2.99Å; R186-I188 VanDerWaalsContact C-N 3.34Å; R186-I188 PolarHBondContact O-N 3.35Å; I188-S191 PolarHBondContact O-N 3.43Å; I188-A192 PolarHBondContact O-N 3.07Å; I188-A192 VanDerWaalsContact O-N 3.13Å
189I90.7Very high88.5Confident30 Ų3069.4 Ų69.415%0.15438%0.377CS..Hα-helixtrans-65.2-45.2179.4-62.7170.8000111Y39 L109 Q185 R186 S191 A192 V193Y39-I189 HydrophobicContact CE1-CD1 4.07Å; Y39-I189 HydrophobicContact CE1-CG1 4.12Å; L109-I189 HydrophobicContact CD2-CG2 4.38Å; Q185-I189 HydrophobicContact CG-CD1 4.3Å; Q185-I189 PolarHBondContact O-N 3.46Å; R186-I189 PolarHBondContact O-N 3.37Å; I189-S191 VanDerWaalsContact C-N 3.33Å; I189-S191 PolarHBondContact O-N 3.46Å; I189-A192 PolarHBondContact O-N 3.38Å; I189-V193 HydrophobicContact CG2-CG2 4.36Å; I189-V193 WeakPolarHBondContact O-CG2 3.39Å; I189-V193 PolarHBondContact O-N 3.44Å
190I90.7Very high88.9Confident90 Ų9065.3 Ų65.346%0.46236%0.355SS..Hα-helixtrans-59.7-44.7178.4-70.9170.4000110.9R186 A192 V193 I194R186-I190 HydrophobicContact CG-CD1 3.81Å; R186-I190 HydrophobicContact CG-CG1 4.41Å; R186-I190 VanDerWaalsContact O-CG1 3.29Å; R186-I190 WeakPolarHBondContact O-CG1 3.36Å; R186-I190 PolarHBondContact O-N 3.28Å; I190-A192 PolarHBondContact O-N 2.92Å; I190-V193 PolarHBondContact O-N 2.89Å; I190-I194 HydrophobicContact CG2-CD1 3.78Å; I190-I194 HydrophobicContact CG2-CG1 4.43Å; I190-I194 VanDerWaalsContact O-CG1 3.32Å; I190-I194 WeakPolarHBondContact O-CG1 3.49Å; I190-I194 PolarHBondContact O-N 2.87Å
191S88.8Confident89.4Confident38 Ų3865.8 Ų65.827%0.26635%0.349SS..Hα-helixtrans-57.8-49.5177.1-175.70000111.5S187 I188 I189 V193 I194 F195S187-S191 WeakPolarHBondContact O-CB 3.32Å; S187-S191 PolarHBondContact O-N 3.41Å; I188-S191 PolarHBondContact O-N 3.43Å; I189-S191 VanDerWaalsContact C-N 3.33Å; I189-S191 PolarHBondContact O-N 3.46Å; S191-V193 PolarHBondContact O-N 3.32Å; S191-I194 PolarHBondContact O-N 2.95Å; S191-F195 WeakPolarHBondContact O-CD2 3.17Å; S191-F195 PolarHBondContact O-N 2.99Å; S191-F195 WeakPolarHBondContact OG-CE2 3.46Å
192A90.8Very high90Very high4 Ų463.9 Ų63.93%0.03334%0.336CS..Hα-helixtrans-59.8-43.4177.500000112.8Y36 I188 I189 I190 I194 F195 F196Y36-A192 HydrophobicContact CD1-CB 4.05Å; Y36-A192 HydrophobicContact CD2-CB 3.76Å; Y36-A192 HydrophobicContact CE2-CB 4.44Å; Y36-A192 HydrophobicContact CG-CB 3.53Å; I188-A192 PolarHBondContact O-N 3.07Å; I188-A192 VanDerWaalsContact O-N 3.13Å; I189-A192 PolarHBondContact O-N 3.38Å; I190-A192 PolarHBondContact O-N 2.92Å; A192-I194 VanDerWaalsContact C-N 3.33Å; A192-I194 PolarHBondContact O-N 3.28Å; A192-F195 WeakPolarHBondContact O-CB 3.35Å; A192-F195 PolarHBondContact O-N 3.22Å; A192-F196 HydrophobicContact CB-CE2 4.24Å; A192-F196 WeakPolarHBondContact O-CD2 3.48Å; A192-F196 PolarHBondContact O-N 3.07Å
193V93.6Very high90.9Very high34 Ų3457 Ų5721%0.20629%0.294CS..Hα-helixtrans-61.2-42176.8170.70000111.3I105 A108 L109 I189 I190 S191 F195 F196 L197I105-V193 HydrophobicContact CG2-CG1 4.34Å; A108-V193 HydrophobicContact CB-CG2 4.12Å; L109-V193 HydrophobicContact CD2-CG2 4.09Å; I189-V193 HydrophobicContact CG2-CG2 4.36Å; I189-V193 WeakPolarHBondContact O-CG2 3.39Å; I189-V193 PolarHBondContact O-N 3.44Å; I190-V193 PolarHBondContact O-N 2.89Å; S191-V193 PolarHBondContact O-N 3.32Å; V193-F195 VanDerWaalsContact C-N 3.35Å; V193-F195 PolarHBondContact O-N 2.88Å; V193-F196 PolarHBondContact O-N 3.32Å; V193-L197 VanDerWaalsContact O-CB 3.25Å; V193-L197 WeakPolarHBondContact O-CB 3.39Å; V193-L197 PolarHBondContact O-N 3.38Å
194I91.6Very high91.8Very high104 Ų10456.9 Ų56.953%0.53330%0.297SS..Hα-helixtrans-61.9-43.2176-69.3167.1000110.8I190 S191 A192 L197 S198I190-I194 HydrophobicContact CG2-CD1 3.78Å; I190-I194 HydrophobicContact CG2-CG1 4.43Å; I190-I194 VanDerWaalsContact O-CG1 3.32Å; I190-I194 WeakPolarHBondContact O-CG1 3.49Å; I190-I194 PolarHBondContact O-N 2.87Å; S191-I194 PolarHBondContact O-N 2.95Å; A192-I194 VanDerWaalsContact C-N 3.33Å; A192-I194 PolarHBondContact O-N 3.28Å; I194-L197 PolarHBondContact O-N 2.95Å; I194-S198 WeakPolarHBondContact O-CB 3.34Å; I194-S198 PolarHBondContact O-N 3.36Å
195F90.3Very high92.3Very high42 Ų4255.7 Ų55.718%0.18429%0.291CS..Hα-helixtrans-59.9-51.3175.9-79.3-66.7000112.2V29 V170 S191 A192 V193 L197 S198 A199V29-F195 HydrophobicContact CG1-CB 4.25Å; V170-F195 HydrophobicContact CG1-CE1 3.53Å; V170-F195 HydrophobicContact CG1-CZ 3.52Å; S191-F195 WeakPolarHBondContact O-CD2 3.17Å; S191-F195 PolarHBondContact O-N 2.99Å; S191-F195 WeakPolarHBondContact OG-CE2 3.46Å; A192-F195 WeakPolarHBondContact O-CB 3.35Å; A192-F195 PolarHBondContact O-N 3.22Å; V193-F195 VanDerWaalsContact C-N 3.35Å; V193-F195 PolarHBondContact O-N 2.88Å; F195-L197 VanDerWaalsContact C-N 3.33Å; F195-L197 PolarHBondContact O-N 2.95Å; F195-S198 PolarHBondContact O-N 3.05Å; F195-S198 PolarHBondContact O-OG 2.66Å; F195-A199 PolarHBondContact O-N 3.44Å; F195-A199 VanDerWaalsContact O-N 3.15Å
196F93.8Very high92.7Very high2 Ų250.1 Ų50.11%0.00927%0.265CS..Hα-helixtrans-63.3-38.3178.6-66.3-58.1000112.4V29 F30 Y36 F37 L101 T104 I105 A192 V193 A199 I200V29-F196 HydrophobicContact CB-CD1 4.04Å; V29-F196 HydrophobicContact CB-CE1 4.05Å; V29-F196 HydrophobicContact CG2-CD1 3.74Å; V29-F196 HydrophobicContact CG2-CE1 3.75Å; F30-F196 HydrophobicContact CE1-CE1 4.48Å; F30-F196 HydrophobicContact CZ-CE1 4.49Å; Y36-F196 HydrophobicContact CE1-CE2 4.21Å; Y36-F196 HydrophobicContact CE1-CZ 4.47Å; F37-F196 AromaticContact CZ-CZ 3.97Å; F37-F196 HydrophobicContact CZ-CZ 3.97Å; L101-F196 HydrophobicContact CD2-CD1 4.13Å; T104-F196 WeakPolarHBondContact OG1-CD1 3.32Å; I105-F196 HydrophobicContact CD1-CB 3.96Å; I105-F196 HydrophobicContact CG1-CB 3.48Å; I105-F196 VanDerWaalsContact CG1-CB 3.48Å; I105-F196 HydrophobicContact CG1-CD2 4.49Å; I105-F196 HydrophobicContact CG1-CG 4.31Å; A192-F196 HydrophobicContact CB-CE2 4.24Å; A192-F196 WeakPolarHBondContact O-CD2 3.48Å; A192-F196 PolarHBondContact O-N 3.07Å; V193-F196 PolarHBondContact O-N 3.32Å; F196-A199 WeakPolarHBondContact O-CB 3.4Å; F196-A199 PolarHBondContact O-N 3.47Å; F196-I200 PolarHBondContact O-N 3.47Å; F196-I200 VanDerWaalsContact O-N 3.14Å
197L94.8Very high92.9Very high87 Ų8742.4 Ų42.446%0.45524%0.239SC..Hα-helixtrans-64.5-41.4176.3-176.762.5000111.7I105 V193 I194 F195 A199 I200 L201I105-L197 HydrophobicContact CD1-CB 4.49Å; V193-L197 VanDerWaalsContact O-CB 3.25Å; V193-L197 WeakPolarHBondContact O-CB 3.39Å; V193-L197 PolarHBondContact O-N 3.38Å; I194-L197 PolarHBondContact O-N 2.95Å; F195-L197 VanDerWaalsContact C-N 3.33Å; F195-L197 PolarHBondContact O-N 2.95Å; L197-A199 VanDerWaalsContact C-N 3.27Å; L197-A199 PolarHBondContact O-N 3.39Å; L197-I200 PolarHBondContact O-N 3.41Å; L197-L201 WeakPolarHBondContact O-CG 2.93Å; L197-L201 PolarHBondContact O-N 3.01Å; L197-L201 VanDerWaalsContact O-N 3.07Å
198S92.6Very high93.2Very high44 Ų4445.4 Ų45.431%0.30824%0.244SC..Hα-helixtrans-60.6-37.4176.177.10000112.1I194 F195 L201 I202I194-S198 WeakPolarHBondContact O-CB 3.34Å; I194-S198 PolarHBondContact O-N 3.36Å; F195-S198 PolarHBondContact O-N 3.05Å; F195-S198 PolarHBondContact O-OG 2.66Å; S198-L201 PolarHBondContact O-N 3.4Å; S198-I202 WeakPolarHBondContact O-CG1 3.43Å; S198-I202 PolarHBondContact O-N 3.34Å
199A94.7Very high93.5Very high0 Ų044.3 Ų44.30%024%0.239CC..Hα-helixtrans-63.2-45.4174.200000111.9I25 V29 L101 F195 F196 L197 L201 I202 I203I25-A199 HydrophobicContact CG2-CB 3.5Å; I25-A199 VanDerWaalsContact CG2-CB 3.5Å; V29-A199 HydrophobicContact CG1-CB 4Å; L101-A199 HydrophobicContact CD1-CB 3.83Å; L101-A199 HydrophobicContact CD2-CB 4.09Å; F195-A199 PolarHBondContact O-N 3.44Å; F195-A199 VanDerWaalsContact O-N 3.15Å; F196-A199 WeakPolarHBondContact O-CB 3.4Å; F196-A199 PolarHBondContact O-N 3.47Å; L197-A199 VanDerWaalsContact C-N 3.27Å; L197-A199 PolarHBondContact O-N 3.39Å; A199-L201 VanDerWaalsContact C-N 3.33Å; A199-L201 PolarHBondContact O-N 2.63Å; A199-I202 PolarHBondContact O-N 3.24Å; A199-I203 WeakPolarHBondContact O-CG1 3.42Å; A199-I203 PolarHBondContact O-N 3.4Å
200I96.2Very high93.5Very high17 Ų1743 Ų439%0.08723%0.233CC..Hα-helixtrans-58.2-46.3177.1-67172.4000110.9L101 V102 I105 F196 L197 I202 I203 L204L101-I200 HydrophobicContact CB-CD1 3.94Å; L101-I200 HydrophobicContact CB-CG1 3.53Å; L101-I200 HydrophobicContact CD1-CG1 3.93Å; L101-I200 HydrophobicContact CG-CG1 4.36Å; V102-I200 HydrophobicContact CG2-CD1 3.86Å; I105-I200 HydrophobicContact CD1-CD1 3.51Å; F196-I200 PolarHBondContact O-N 3.47Å; F196-I200 VanDerWaalsContact O-N 3.14Å; L197-I200 PolarHBondContact O-N 3.41Å; I200-I202 VanDerWaalsContact C-N 3.26Å; I200-I202 PolarHBondContact O-N 3.04Å; I200-I203 PolarHBondContact O-N 3.23Å; I200-L204 HydrophobicContact CG2-CD1 3.92Å; I200-L204 HydrophobicContact CG2-CG 4.29Å; I200-L204 WeakPolarHBondContact O-CB 3.29Å; I200-L204 WeakPolarHBondContact O-CG 3.18Å; I200-L204 PolarHBondContact O-N 3.47Å
201L95.8Very high93.5Very high107 Ų10743.5 Ų43.556%0.5623%0.231SC*.Hα-helixtrans-59.3-38.8179.5-67.3176.3000112L197 S198 A199 A205L197-L201 WeakPolarHBondContact O-CG 2.93Å; L197-L201 PolarHBondContact O-N 3.01Å; L197-L201 VanDerWaalsContact O-N 3.07Å; S198-L201 PolarHBondContact O-N 3.4Å; A199-L201 VanDerWaalsContact C-N 3.33Å; A199-L201 PolarHBondContact O-N 2.63Å; L201-A205 WeakPolarHBondContact O-CB 3.24Å; L201-A205 PolarHBondContact O-N 2.84Å
202I95.1Very high93.7Very high43 Ų4347.3 Ų47.322%0.22124%0.24CC..Hα-helixtrans-73.2-38.3179.4-68.1170000111.4L18 I21 I25 S198 A199 I200 A205 C206L18-I202 HydrophobicContact CD1-CG2 4.45Å; I21-I202 HydrophobicContact CG2-CG2 4.25Å; I25-I202 HydrophobicContact CD1-CB 4.48Å; I25-I202 HydrophobicContact CD1-CD1 3.15Å; I25-I202 HydrophobicContact CD1-CG1 4.35Å; I25-I202 HydrophobicContact CD1-CG2 4.23Å; S198-I202 WeakPolarHBondContact O-CG1 3.43Å; S198-I202 PolarHBondContact O-N 3.34Å; A199-I202 PolarHBondContact O-N 3.24Å; I200-I202 VanDerWaalsContact C-N 3.26Å; I200-I202 PolarHBondContact O-N 3.04Å; I202-A205 WeakPolarHBondContact O-CB 3.42Å; I202-A205 PolarHBondContact O-N 3.21Å; I202-C206 PolarHBondContact O-N 3.13Å; I202-C206 PolarHBondContact O-SG 3.41Å
203I94.9Very high93.7Very high0 Ų047.2 Ų47.20%024%0.239CC..Hα-helixtrans-66.9-37.6174.7-65.2-51.1000111.9G22 P26 M94 E97 I98 L101 A199 I200 A205 C206 T207G22-I203 VanDerWaalsContact O-CD1 3.28Å; G22-I203 WeakPolarHBondContact O-CD1 3.47Å; P26-I203 HydrophobicContact CG-CD1 3.67Å; P26-I203 HydrophobicContact CG-CG1 3.99Å; M94-I203 HydrophobicContact SD-CG2 3.74Å; E97-I203 HydrophobicContact CB-CG2 4.35Å; E97-I203 WeakPolarHBondContact OE2-CD1 3.28Å; I98-I203 HydrophobicContact CD1-CG2 4.01Å; I98-I203 HydrophobicContact CG1-CB 4.35Å; I98-I203 HydrophobicContact CG1-CG2 3.62Å; L101-I203 HydrophobicContact CD1-CG1 4.37Å; A199-I203 WeakPolarHBondContact O-CG1 3.42Å; A199-I203 PolarHBondContact O-N 3.4Å; I200-I203 PolarHBondContact O-N 3.23Å; I203-A205 VanDerWaalsContact C-N 3.35Å; I203-C206 PolarHBondContact O-N 2.93Å; I203-T207 PolarHBondContact O-N 3.02Å; I203-T207 PolarHBondContact O-OG1 3.23Å
204L96.2Very high93.3Very high86 Ų8647.6 Ų47.645%0.4524%0.239SC..Hα-helixtrans-61.6-44171-72.7171.9000111.3I98 I200 T207 F208I98-L204 HydrophobicContact CD1-CD2 3.7Å; I98-L204 HydrophobicContact CD1-CG 4.28Å; I200-L204 HydrophobicContact CG2-CD1 3.92Å; I200-L204 HydrophobicContact CG2-CG 4.29Å; I200-L204 WeakPolarHBondContact O-CB 3.29Å; I200-L204 WeakPolarHBondContact O-CG 3.18Å; I200-L204 PolarHBondContact O-N 3.47Å; L204-T207 WeakPolarHBondContact O-CB 3.39Å; L204-T207 PolarHBondContact O-N 3.24Å; L204-F208 PolarHBondContact O-N 3.48Å
205A95.8Very high93.1Very high36 Ų3652 Ų5230%0.29825%0.248SC..Hα-helixtrans-61.5-44.7174.900000111.5L18 L201 I202 I203 T207 F208 T209L18-A205 HydrophobicContact CD2-CB 3.95Å; L201-A205 WeakPolarHBondContact O-CB 3.24Å; L201-A205 PolarHBondContact O-N 2.84Å; I202-A205 WeakPolarHBondContact O-CB 3.42Å; I202-A205 PolarHBondContact O-N 3.21Å; I203-A205 VanDerWaalsContact C-N 3.35Å; A205-T207 VanDerWaalsContact C-N 3.34Å; A205-T207 PolarHBondContact O-N 3.47Å; A205-F208 PolarHBondContact O-N 3.13Å; A205-T209 WeakPolarHBondContact O-CG2 3.43Å; A205-T209 PolarHBondContact O-N 3.48Å; A205-T209 PolarHBondContact O-OG1 2.61Å; A205-T209 VanDerWaalsContact O-OG1 3.12Å
206C95.3Very high93Very high0 Ų050.6 Ų50.60%024%0.243CC..Hα-helixtrans-59.2-42.2173.9-77.30000112.6H19 M94 I202 I203 F208 T209 F210H19-C206 PolarHBondContact CE1-O 3.37Å; M94-C206 HydrophobicContact CE-CB 4.05Å; M94-C206 HydrophobicContact SD-CB 3.93Å; I202-C206 PolarHBondContact O-N 3.13Å; I202-C206 PolarHBondContact O-SG 3.41Å; I203-C206 PolarHBondContact O-N 2.93Å; C206-F208 VanDerWaalsContact C-N 3.33Å; C206-F208 PolarHBondContact O-N 2.89Å; C206-T209 WeakPolarHBondContact CA-OG1 3.4Å; C206-T209 PolarHBondContact O-N 2.81Å; C206-T209 PolarHBondContact O-OG1 3.13Å; C206-F210 WeakPolarHBondContact O-CB 3.07Å; C206-F210 PolarHBondContact O-N 2.84Å
207T93.5Very high92.5Very high30 Ų3053 Ų5318%0.18425%0.253CS..Hα-helixtrans-59.8-47.5177.3-590000110.4L91 M94 I203 L204 A205 F210 F211L91-T207 HydrophobicContact CD1-CG2 4.18Å; M94-T207 WeakPolarHBondContact CB-OG1 3.32Å; M94-T207 PolarHBondContact SD-OG1 3.1Å; I203-T207 PolarHBondContact O-N 3.02Å; I203-T207 PolarHBondContact O-OG1 3.23Å; L204-T207 WeakPolarHBondContact O-CB 3.39Å; L204-T207 PolarHBondContact O-N 3.24Å; A205-T207 VanDerWaalsContact C-N 3.34Å; A205-T207 PolarHBondContact O-N 3.47Å; T207-F210 PolarHBondContact O-N 3.42Å; T207-F211 HydrophobicContact CG2-CE2 4.18Å; T207-F211 VanDerWaalsContact O-CD2 3.23Å; T207-F211 WeakPolarHBondContact O-CD2 3.27Å
208F94.2Very high92.1Very high128 Ų12849.5 Ų49.556%0.56123%0.234SC*.Hα-helixtrans-63.5-48.1177.7176.3-108.1000112.4L204 A205 C206 F210 F211 W212L204-F208 PolarHBondContact O-N 3.48Å; A205-F208 PolarHBondContact O-N 3.13Å; C206-F208 VanDerWaalsContact C-N 3.33Å; C206-F208 PolarHBondContact O-N 2.89Å; F208-F210 VanDerWaalsContact C-N 3.28Å; F208-F210 PolarHBondContact O-N 3.2Å; F208-F211 PolarHBondContact O-N 2.95Å; F208-W212 HydrophobicContact CD1-CE3 4.21Å; F208-W212 AromaticContact CE1-CE3 3.26Å; F208-W212 HydrophobicContact CE1-CE3 3.26Å; F208-W212 AromaticContact CE1-CZ3 3.41Å; F208-W212 HydrophobicContact CE1-CZ3 3.41Å; F208-W212 VanDerWaalsContact CE1-CZ3 3.41Å; F208-W212 HydrophobicContact CE2-CE3 4.29Å; F208-W212 AromaticContact CZ-CE3 3.31Å; F208-W212 HydrophobicContact CZ-CE3 3.31Å; F208-W212 AromaticContact CZ-CZ3 3.35Å; F208-W212 HydrophobicContact CZ-CZ3 3.35Å; F208-W212 PolarHBondContact O-N 3.28Å; F208-W212 VanDerWaalsContact O-N 3.14Å
209T93.9Very high91.8Very high8 Ų848.2 Ų48.25%0.04923%0.225CC..Hα-helixtrans-67.2-28-179.557.50000112.7F15 L18 H19 A205 C206 W212 L213F15-T209 HydrophobicContact CD1-CG2 3.49Å; F15-T209 VanDerWaalsContact CD1-CG2 3.49Å; F15-T209 HydrophobicContact CE1-CG2 3.69Å; F15-T209 HydrophobicContact CG-CG2 4.01Å; F15-T209 HydrophobicContact CZ-CG2 4.35Å; L18-T209 HydrophobicContact CD2-CG2 3.71Å; H19-T209 PolarHBondContact NE2-OG1 3.1Å; A205-T209 WeakPolarHBondContact O-CG2 3.43Å; A205-T209 PolarHBondContact O-N 3.48Å; A205-T209 PolarHBondContact O-OG1 2.61Å; A205-T209 VanDerWaalsContact O-OG1 3.12Å; C206-T209 WeakPolarHBondContact CA-OG1 3.4Å; C206-T209 PolarHBondContact O-N 2.81Å; C206-T209 PolarHBondContact O-OG1 3.13Å; T209-W212 PolarHBondContact O-N 2.87Å; T209-L213 WeakPolarHBondContact O-CB 3.47Å; T209-L213 PolarHBondContact O-N 3.01Å
210F92Very high91.3Very high4 Ų453 Ų532%0.01824%0.243CC..Hα-helixtrans-60.8-48.5174.6176.6-103.8000112.1R87 F90 I144 C206 T207 F208 L213 Q214R87-F210 HydrophobicContact CB-CE1 4.3Å; R87-F210 HydrophobicContact CB-CZ 4.38Å; R87-F210 HydrophobicContact CG-CE1 4.48Å; R87-F210 HydrophobicContact CG-CZ 4.34Å; F90-F210 HydrophobicContact CB-CD2 4.5Å; F90-F210 HydrophobicContact CB-CE1 4Å; F90-F210 HydrophobicContact CB-CE2 3.85Å; F90-F210 HydrophobicContact CB-CZ 3.55Å; F90-F210 HydrophobicContact CD1-CB 4Å; F90-F210 AromaticContact CD1-CD1 3.65Å; F90-F210 HydrophobicContact CD1-CD1 3.65Å; F90-F210 AromaticContact CD1-CD2 3.49Å; F90-F210 HydrophobicContact CD1-CD2 3.49Å; F90-F210 VanDerWaalsContact CD1-CD2 3.49Å; F90-F210 AromaticContact CD1-CE1 3.89Å; F90-F210 HydrophobicContact CD1-CE1 3.89Å; F90-F210 AromaticContact CD1-CE2 3.72Å; F90-F210 HydrophobicContact CD1-CE2 3.72Å; F90-F210 AromaticContact CD1-CG 3.43Å; F90-F210 HydrophobicContact CD1-CG 3.43Å; F90-F210 VanDerWaalsContact CD1-CG 3.43Å; F90-F210 AromaticContact CD1-CZ 3.9Å; F90-F210 HydrophobicContact CD1-CZ 3.9Å; F90-F210 AromaticContact CD2-CD2 3.75Å; F90-F210 HydrophobicContact CD2-CD2 3.75Å; F90-F210 AromaticContact CD2-CE2 3.51Å; F90-F210 HydrophobicContact CD2-CE2 3.51Å; F90-F210 HydrophobicContact CD2-CZ 4.15Å; F90-F210 HydrophobicContact CE1-CB 3.5Å; F90-F210 HydrophobicContact CE1-CD1 4.09Å; F90-F210 AromaticContact CE1-CD2 3.48Å; F90-F210 HydrophobicContact CE1-CD2 3.48Å; F90-F210 VanDerWaalsContact CE1-CD2 3.48Å; F90-F210 HydrophobicContact CE1-CE2 4.15Å; F90-F210 AromaticContact CE1-CG 3.42Å; F90-F210 HydrophobicContact CE1-CG 3.42Å; F90-F210 VanDerWaalsContact CE1-CG 3.42Å; F90-F210 AromaticContact CE2-CD2 3.7Å; F90-F210 HydrophobicContact CE2-CD2 3.7Å; F90-F210 AromaticContact CE2-CE2 3.92Å; F90-F210 HydrophobicContact CE2-CE2 3.92Å; F90-F210 HydrophobicContact CE2-CG 4.48Å; F90-F210 HydrophobicContact CG-CD1 4.23Å; F90-F210 AromaticContact CG-CD2 3.64Å; F90-F210 HydrophobicContact CG-CD2 3.64Å; F90-F210 HydrophobicContact CG-CE1 4.03Å; F90-F210 AromaticContact CG-CE2 3.39Å; F90-F210 HydrophobicContact CG-CE2 3.39Å; F90-F210 HydrophobicContact CG-CG 4.04Å; F90-F210 AromaticContact CG-CZ 3.6Å; F90-F210 HydrophobicContact CG-CZ 3.6Å; F90-F210 HydrophobicContact CZ-CB 4.05Å; F90-F210 AromaticContact CZ-CD2 3.59Å; F90-F210 HydrophobicContact CZ-CD2 3.59Å; F90-F210 HydrophobicContact CZ-CE2 4.24Å; F90-F210 AromaticContact CZ-CG 3.99Å; F90-F210 HydrophobicContact CZ-CG 3.99Å; I144-F210 HydrophobicContact CD1-CD2 4.29Å; I144-F210 HydrophobicContact CD1-CE2 3.62Å; C206-F210 WeakPolarHBondContact O-CB 3.07Å; C206-F210 PolarHBondContact O-N 2.84Å; T207-F210 PolarHBondContact O-N 3.42Å; F208-F210 VanDerWaalsContact C-N 3.28Å; F208-F210 PolarHBondContact O-N 3.2Å; F210-L213 PolarHBondContact O-N 3.4Å; F210-Q214 WeakPolarHBondContact O-CG 3.27Å; F210-Q214 PolarHBondContact O-N 3.31Å
211F90.8Very high90.8Very high99 Ų9953.9 Ų53.943%0.43425%0.245SC..Hα-helixtrans-65.4-40.9177.1-73.5-71000111.6L91 T207 F208 Q214 R215L91-F211 HydrophobicContact CD1-CE2 4.01Å; L91-F211 HydrophobicContact CD1-CZ 4.01Å; L91-F211 HydrophobicContact CD2-CZ 4.19Å; T207-F211 HydrophobicContact CG2-CE2 4.18Å; T207-F211 VanDerWaalsContact O-CD2 3.23Å; T207-F211 WeakPolarHBondContact O-CD2 3.27Å; F208-F211 PolarHBondContact O-N 2.95Å; F211-Q214 PolarHBondContact O-N 3.36Å; F211-R215 WeakPolarHBondContact O-CG 3.47Å; F211-R215 PolarHBondContact O-N 2.9Å
212W91.9Very high90.1Very high118 Ų11850.5 Ų50.545%0.44723%0.225SC..Hα-helixtrans-64.8-46.5178-159.4-29.6000111.5F15 F208 T209 Q214 R215 L216F15-W212 HydrophobicContact CE2-CB 3.76Å; F15-W212 AromaticContact CE2-CD1 3.94Å; F15-W212 HydrophobicContact CE2-CD2 4.17Å; F15-W212 AromaticContact CE2-CG 3.67Å; F15-W212 HydrophobicContact CE2-CG 3.67Å; F15-W212 HydrophobicContact CZ-CB 4.24Å; F15-W212 AromaticContact CZ-CD2 3.94Å; F15-W212 HydrophobicContact CZ-CD2 3.94Å; F15-W212 HydrophobicContact CZ-CE3 4.19Å; F15-W212 AromaticContact CZ-CG 3.94Å; F15-W212 HydrophobicContact CZ-CG 3.94Å; F208-W212 HydrophobicContact CD1-CE3 4.21Å; F208-W212 AromaticContact CE1-CE3 3.26Å; F208-W212 HydrophobicContact CE1-CE3 3.26Å; F208-W212 AromaticContact CE1-CZ3 3.41Å; F208-W212 HydrophobicContact CE1-CZ3 3.41Å; F208-W212 VanDerWaalsContact CE1-CZ3 3.41Å; F208-W212 HydrophobicContact CE2-CE3 4.29Å; F208-W212 AromaticContact CZ-CE3 3.31Å; F208-W212 HydrophobicContact CZ-CE3 3.31Å; F208-W212 AromaticContact CZ-CZ3 3.35Å; F208-W212 HydrophobicContact CZ-CZ3 3.35Å; F208-W212 PolarHBondContact O-N 3.28Å; F208-W212 VanDerWaalsContact O-N 3.14Å; T209-W212 PolarHBondContact O-N 2.87Å; W212-Q214 PolarHBondContact O-N 3.5Å; W212-Q214 VanDerWaalsContact O-N 3.15Å; W212-R215 WeakPolarHBondContact O-CA 3.25Å; W212-R215 PolarHBondContact O-N 3.44Å; W212-L216 PolarHBondContact O-N 3.45Å
213L90.4Very high89.4Confident2 Ų251.1 Ų51.11%0.0123%0.233CC..Hα-helixtrans-51.4-42.7179.6-178.364.6000111.2A12 F15 L16 I144 T209 F210 R215 L216 V219A12-L213 HydrophobicContact CB-CD1 3.97Å; F15-L213 HydrophobicContact CB-CD1 4.32Å; F15-L213 HydrophobicContact CD2-CB 4.08Å; F15-L213 HydrophobicContact CD2-CD1 4.27Å; L16-L213 HydrophobicContact CD2-CD2 3.96Å; L16-L213 HydrophobicContact CG-CD2 4.24Å; I144-L213 HydrophobicContact CG2-CD2 4Å; T209-L213 WeakPolarHBondContact O-CB 3.47Å; T209-L213 PolarHBondContact O-N 3.01Å; F210-L213 PolarHBondContact O-N 3.4Å; L213-R215 VanDerWaalsContact C-N 3.28Å; L213-R215 PolarHBondContact O-N 3.19Å; L213-L216 HydrophobicContact CD1-CD1 4.12Å; L213-L216 PolarHBondContact O-N 2.86Å; L213-V219 HydrophobicContact CD1-CG2 3.89Å; L213-V219 HydrophobicContact CG-CG2 4.35Å; L213-V219 WeakPolarHBondContact O-CB 3.41Å; L213-V219 VanDerWaalsContact O-CG2 3.3Å; L213-V219 WeakPolarHBondContact O-CG2 3.39Å
214Q85.7Confident88.6Confident43 Ų4353.5 Ų53.520%0.20124%0.243CC..Hα-helixtrans-70.9-19.5179.3-66.7-174.81.900114.7F210 F211 W212F210-Q214 WeakPolarHBondContact O-CG 3.27Å; F210-Q214 PolarHBondContact O-N 3.31Å; F211-Q214 PolarHBondContact O-N 3.36Å; W212-Q214 PolarHBondContact O-N 3.5Å; W212-Q214 VanDerWaalsContact O-N 3.15Å
215R87.6Confident87.9Confident196 Ų19652.6 Ų52.674%0.7424%0.239SC*.Hα-helixtrans-91.9-15.8178.4-65.1-67.8-172.2172.62.3112.9F211 W212 L213 K217 R220F211-R215 WeakPolarHBondContact O-CG 3.47Å; F211-R215 PolarHBondContact O-N 2.9Å; W212-R215 WeakPolarHBondContact O-CA 3.25Å; W212-R215 PolarHBondContact O-N 3.44Å; L213-R215 VanDerWaalsContact C-N 3.28Å; L213-R215 PolarHBondContact O-N 3.19Å; R215-K217 PolarHBondContact O-N 3.3Å; R215-R220 PolarHBondContact O-NE 3.03Å; R215-R220 PolarHBondContact O-NH2 2.94Å; R215-R220 VanDerWaalsContact O-NH2 3.15Å
216L87.5Confident86.8Confident12 Ų1254.1 Ų54.16%0.06324%0.237CC..  trans-57.3129.4177.5-65.9-178.6000110.6L11 A12 F15 W212 L213 F218 V219 R220L11-L216 HydrophobicContact CB-CD1 4.45Å; A12-L216 HydrophobicContact CB-CD1 3.84Å; F15-L216 HydrophobicContact CD2-CD1 4.22Å; F15-L216 HydrophobicContact CE2-CD1 4.21Å; W212-L216 PolarHBondContact O-N 3.45Å; L213-L216 HydrophobicContact CD1-CD1 4.12Å; L213-L216 PolarHBondContact O-N 2.86Å; L216-F218 PolarHBondContact O-N 3.47Å; L216-V219 HydrophobicContact CB-CB 4.47Å; L216-V219 HydrophobicContact CB-CG2 4.18Å; L216-V219 PolarHBondContact O-N 3Å; L216-V219 VanDerWaalsContact O-N 3.08Å; L216-R220 PolarHBondContact O-N 3.47Å; L216-R220 VanDerWaalsContact O-N 3.11Å
217K84.4Confident85.7Confident54 Ų5459.2 Ų59.224%0.23526%0.261CS..Hα-helixtrans-52.7-41.9176.8-66.7-163.9179.9-167.50111R215 V219 R220 Y221 D291R215-K217 PolarHBondContact O-N 3.3Å; K217-V219 PolarHBondContact O-N 3.39Å; K217-R220 PolarHBondContact O-N 2.88Å; K217-Y221 WeakPolarHBondContact O-CB 3.34Å; K217-Y221 PolarHBondContact O-N 3.36Å; K217-D291 IonicContact NZ-OD2 3.09Å; K217-D291 PolarHBondContact NZ-OD2 3.23Å
218F85.7Confident84.9Confident13 Ų1360.4 Ų60.46%0.05727%0.269CS..Hα-helixtrans-52.7-49.3175.1178.1-105.4000113.7Y9 A12 L148 P149 Y152 L216 Y221 Y222Y9-F218 AromaticContact CD1-CD2 3.38Å; Y9-F218 HydrophobicContact CD1-CD2 3.38Å; Y9-F218 AromaticContact CD1-CE2 3.39Å; Y9-F218 HydrophobicContact CD1-CE2 3.39Å; Y9-F218 HydrophobicContact CD1-CG 4.11Å; Y9-F218 HydrophobicContact CD1-CZ 4.21Å; Y9-F218 AromaticContact CE1-CD2 3.19Å; Y9-F218 HydrophobicContact CE1-CD2 3.19Å; Y9-F218 AromaticContact CE1-CE2 3.31Å; Y9-F218 HydrophobicContact CE1-CE2 3.31Å; Y9-F218 HydrophobicContact CE1-CG 4.24Å; Y9-F218 HydrophobicContact CE1-CZ 4.47Å; A12-F218 HydrophobicContact CB-CD1 4.08Å; A12-F218 HydrophobicContact CB-CE1 4.46Å; L148-F218 HydrophobicContact CD1-CE1 4.33Å; L148-F218 HydrophobicContact CD2-CD1 4.37Å; L148-F218 HydrophobicContact CD2-CE1 3.91Å; P149-F218 HydrophobicContact CG-CZ 4.18Å; Y152-F218 HydrophobicContact CD2-CE1 4.31Å; Y152-F218 HydrophobicContact CD2-CZ 4.4Å; Y152-F218 HydrophobicContact CE1-CE1 4.09Å; Y152-F218 AromaticContact CE2-CE1 3.52Å; Y152-F218 HydrophobicContact CE2-CE1 3.52Å; Y152-F218 AromaticContact CE2-CZ 3.4Å; Y152-F218 HydrophobicContact CE2-CZ 3.4Å; Y152-F218 AromaticContact CZ-CE1 3.36Å; Y152-F218 AromaticContact CZ-CZ 3.54Å; Y152-F218 VanDerWaalsContact OH-CE1 3.26Å; Y152-F218 WeakPolarHBondContact OH-CE1 3.42Å; Y152-F218 VanDerWaalsContact OH-CZ 3.23Å; Y152-F218 WeakPolarHBondContact OH-CZ 3.44Å; L216-F218 PolarHBondContact O-N 3.47Å; F218-Y221 WeakPolarHBondContact O-CB 3.37Å; F218-Y221 PolarHBondContact O-N 2.96Å; F218-Y222 HydrophobicContact CD2-CD2 4.15Å; F218-Y222 AromaticContact CD2-CE2 3.92Å; F218-Y222 HydrophobicContact CD2-CE2 3.92Å; F218-Y222 HydrophobicContact CE1-CD2 4.22Å; F218-Y222 HydrophobicContact CE1-CE2 4.3Å; F218-Y222 AromaticContact CE2-CD2 3.76Å; F218-Y222 HydrophobicContact CE2-CD2 3.76Å; F218-Y222 AromaticContact CE2-CE2 3.2Å; F218-Y222 HydrophobicContact CE2-CE2 3.2Å; F218-Y222 AromaticContact CZ-CD2 3.75Å; F218-Y222 HydrophobicContact CZ-CD2 3.75Å; F218-Y222 AromaticContact CZ-CE2 3.39Å; F218-Y222 HydrophobicContact CZ-CE2 3.39Å; F218-Y222 WeakPolarHBondContact O-CD2 3.47Å; F218-Y222 PolarHBondContact O-N 3.16Å
219V85.4Confident83.9Confident17 Ų1757 Ų5710%0.10326%0.257CS..Hα-helixtrans-69.3-38-179.3176.60000110.7L148 L213 L216 K217 S223L148-V219 HydrophobicContact CD1-CG2 4.29Å; L148-V219 HydrophobicContact CD2-CG2 4.21Å; L213-V219 HydrophobicContact CD1-CG2 3.89Å; L213-V219 HydrophobicContact CG-CG2 4.35Å; L213-V219 WeakPolarHBondContact O-CB 3.41Å; L213-V219 VanDerWaalsContact O-CG2 3.3Å; L213-V219 WeakPolarHBondContact O-CG2 3.39Å; L216-V219 HydrophobicContact CB-CB 4.47Å; L216-V219 HydrophobicContact CB-CG2 4.18Å; L216-V219 PolarHBondContact O-N 3Å; L216-V219 VanDerWaalsContact O-N 3.08Å; K217-V219 PolarHBondContact O-N 3.39Å; V219-S223 WeakPolarHBondContact O-CB 3.36Å; V219-S223 PolarHBondContact O-N 3.03Å
220R85.2Confident82.8Confident101 Ų10158.5 Ų58.538%0.38127%0.265SS..Hα-helixtrans-63.6-41.1174.5-72.2-170.2-81.9157.2-7.5112.2R215 L216 K217 S223 K224R215-R220 PolarHBondContact O-NE 3.03Å; R215-R220 PolarHBondContact O-NH2 2.94Å; R215-R220 VanDerWaalsContact O-NH2 3.15Å; L216-R220 PolarHBondContact O-N 3.47Å; L216-R220 VanDerWaalsContact O-N 3.11Å; K217-R220 PolarHBondContact O-N 2.88Å; R220-S223 WeakPolarHBondContact O-CB 3.34Å; R220-S223 PolarHBondContact O-N 3.23Å; R220-K224 PolarHBondContact O-N 2.93Å
221Y85.2Confident81.7Confident35 Ų3563.5 Ų63.514%0.13729%0.288CS..Hα-helixtrans-56.9-53.4175.7172.1-93.4000111.5K217 F218 S223 K224 L225 V295K217-Y221 WeakPolarHBondContact O-CB 3.34Å; K217-Y221 PolarHBondContact O-N 3.36Å; F218-Y221 WeakPolarHBondContact O-CB 3.37Å; F218-Y221 PolarHBondContact O-N 2.96Å; Y221-S223 VanDerWaalsContact C-N 3.26Å; Y221-S223 PolarHBondContact O-N 2.92Å; Y221-K224 PolarHBondContact O-N 3.28Å; Y221-K224 VanDerWaalsContact O-N 3.13Å; Y221-L225 HydrophobicContact CE1-CD2 4.28Å; Y221-L225 WeakPolarHBondContact O-CB 3.47Å; Y221-L225 PolarHBondContact O-N 2.91Å; Y221-V295 HydrophobicContact CD1-CB 4.34Å; Y221-V295 HydrophobicContact CD1-CG1 3.94Å; Y221-V295 HydrophobicContact CD1-CG2 4.42Å; Y221-V295 HydrophobicContact CD2-CB 4.32Å; Y221-V295 HydrophobicContact CD2-CG2 4.27Å; Y221-V295 HydrophobicContact CE1-CB 4.28Å; Y221-V295 HydrophobicContact CE1-CG1 3.8Å; Y221-V295 HydrophobicContact CE2-CB 4.26Å; Y221-V295 HydrophobicContact CG-CB 4.37Å; Y221-V295 HydrophobicContact CG-CG1 4.45Å; Y221-V295 HydrophobicContact CG-CG2 4.13Å
222Y82.3Confident80.9Confident36 Ų3661.6 Ų61.614%0.14128%0.282CS..Hα-helixtrans-63.2-33.1177.4-84.5-86.8000112.6L148 P149 F218 R226L148-Y222 HydrophobicContact CD2-CD2 4.32Å; L148-Y222 HydrophobicContact CD2-CG 4.2Å; P149-Y222 HydrophobicContact CG-CE1 3.82Å; P149-Y222 HydrophobicContact CG-CE2 4.12Å; P149-Y222 VanDerWaalsContact CG-CZ 3.46Å; P149-Y222 WeakPolarHBondContact CG-OH 3.38Å; F218-Y222 HydrophobicContact CD2-CD2 4.15Å; F218-Y222 AromaticContact CD2-CE2 3.92Å; F218-Y222 HydrophobicContact CD2-CE2 3.92Å; F218-Y222 HydrophobicContact CE1-CD2 4.22Å; F218-Y222 HydrophobicContact CE1-CE2 4.3Å; F218-Y222 AromaticContact CE2-CD2 3.76Å; F218-Y222 HydrophobicContact CE2-CD2 3.76Å; F218-Y222 AromaticContact CE2-CE2 3.2Å; F218-Y222 HydrophobicContact CE2-CE2 3.2Å; F218-Y222 AromaticContact CZ-CD2 3.75Å; F218-Y222 HydrophobicContact CZ-CD2 3.75Å; F218-Y222 AromaticContact CZ-CE2 3.39Å; F218-Y222 HydrophobicContact CZ-CE2 3.39Å; F218-Y222 WeakPolarHBondContact O-CD2 3.47Å; F218-Y222 PolarHBondContact O-N 3.16Å; Y222-R226 WeakPolarHBondContact O-CB 3.46Å; Y222-R226 PolarHBondContact O-N 2.93Å
223S79Confident79.9Confident55 Ų5558.6 Ų58.639%0.38527%0.274SS..Hα-helixtrans-65.2-42.8173.3-172.60000112.5V219 R220 Y221 Q227V219-S223 WeakPolarHBondContact O-CB 3.36Å; V219-S223 PolarHBondContact O-N 3.03Å; R220-S223 WeakPolarHBondContact O-CB 3.34Å; R220-S223 PolarHBondContact O-N 3.23Å; Y221-S223 VanDerWaalsContact C-N 3.26Å; Y221-S223 PolarHBondContact O-N 2.92Å; S223-Q227 WeakPolarHBondContact O-CG 3.44Å; S223-Q227 PolarHBondContact O-N 3.36Å
224K79.5Confident79Confident50 Ų5063.6 Ų63.622%0.21730%0.298CS..Hα-helixtrans-69-45.7177.3-75.6-177.8173-175.50111.6R220 Y221 R226 Q227 C228 E287 F288 D292R220-K224 PolarHBondContact O-N 2.93Å; Y221-K224 PolarHBondContact O-N 3.28Å; Y221-K224 VanDerWaalsContact O-N 3.13Å; K224-R226 PolarHBondContact O-N 3.41Å; K224-Q227 WeakPolarHBondContact O-CA 3.46Å; K224-Q227 WeakPolarHBondContact O-CB 3.24Å; K224-Q227 PolarHBondContact O-N 3.16Å; K224-C228 PolarHBondContact O-N 3.43Å; K224-E287 PolarHBondContact NZ-O 3.17Å; K224-F288 HydrophobicContact CD-CD1 4.4Å; K224-F288 HydrophobicContact CD-CE1 3.89Å; K224-F288 HydrophobicContact CD-CZ 4.15Å; K224-D292 IonicContact NZ-OD2 2.69Å; K224-D292 PolarHBondContact NZ-OD2 3.04Å
225L79.7Confident78.3Confident67 Ų6763.1 Ų63.135%0.35130%0.299SS..Hα-helixtrans-53.9-40.6176.6-178.264.3000111.4Y221 C228 N229Y221-L225 HydrophobicContact CE1-CD2 4.28Å; Y221-L225 WeakPolarHBondContact O-CB 3.47Å; Y221-L225 PolarHBondContact O-N 2.91Å; L225-C228 PolarHBondContact O-N 3.23Å; L225-N229 PolarHBondContact O-N 3.5Å
226R73.4Confident77.3Confident68 Ų6858 Ų5826%0.25728%0.284SS..Hα-helixtrans-66-42.6174.7179.8-179.1177.3-150.20.9113.1Y222 K224 C228 N229 N230 P526 D527 P530Y222-R226 WeakPolarHBondContact O-CB 3.46Å; Y222-R226 PolarHBondContact O-N 2.93Å; K224-R226 PolarHBondContact O-N 3.41Å; R226-C228 VanDerWaalsContact C-N 3.32Å; R226-N229 PolarHBondContact O-N 2.91Å; R226-N230 PolarHBondContact O-N 3.16Å; R226-N230 PolarHBondContact O-OD1 3.03Å; R226-N230 VanDerWaalsContact O-OD1 3.05Å; R226-P526 HydrophobicContact CB-CB 4.48Å; R226-P526 VanDerWaalsContact CD-O 3.32Å; R226-P526 WeakPolarHBondContact CD-O 3.46Å; R226-P526 HydrophobicContact CG-CB 3.98Å; R226-P526 PolarHBondContact NE-O 3.28Å; R226-D527 VanDerWaalsContact NE-CA 3.35Å; R226-D527 VanDerWaalsContact NH2-C 3.27Å; R226-D527 PolarHBondContact NH2-O 3.35Å; R226-P530 VanDerWaalsContact NH2-CD 3.32Å
227Q72.7Confident76.3Confident108 Ų10865.5 Ų65.551%0.50531%0.311SS..Hα-helixtrans-61.5-43175.9-71.4171.4-6.500111S223 K224 N230 H231S223-Q227 WeakPolarHBondContact O-CG 3.44Å; S223-Q227 PolarHBondContact O-N 3.36Å; K224-Q227 WeakPolarHBondContact O-CA 3.46Å; K224-Q227 WeakPolarHBondContact O-CB 3.24Å; K224-Q227 PolarHBondContact O-N 3.16Å; Q227-N230 WeakPolarHBondContact O-CB 3.25Å; Q227-N230 PolarHBondContact O-N 3.35Å; Q227-H231 PolarHBondContact O-CD2 2.85Å; Q227-H231 PolarHBondContact O-N 2.87Å
228C76.7Confident75.5Confident54 Ų5466.2 Ų66.237%0.36532%0.323SS..Hα-helixtrans-59.5-49.4174.9-174.40000111.8K224 L225 R226 N230 H231 I232K224-C228 PolarHBondContact O-N 3.43Å; L225-C228 PolarHBondContact O-N 3.23Å; R226-C228 VanDerWaalsContact C-N 3.32Å; C228-N230 PolarHBondContact O-N 3.14Å; C228-H231 PolarHBondContact O-N 3.38Å; C228-H231 VanDerWaalsContact O-N 3.12Å; C228-I232 WeakPolarHBondContact O-CG1 3.41Å; C228-I232 PolarHBondContact O-N 2.68Å
229N73.9Confident74.4Confident56 Ų5667.6 Ų67.630%0.29933%0.329SS..Hα-helixtrans-58.2-35.5175.7-77.3-17.4000112.9L225 R226 N233L225-N229 PolarHBondContact O-N 3.5Å; R226-N229 PolarHBondContact O-N 2.91Å; N229-N233 WeakPolarHBondContact O-CB 3.41Å; N229-N233 PolarHBondContact O-N 3.42Å; N229-N233 PolarHBondContact O-ND2 2.85Å
230N69Low73.4Confident40 Ų4071 Ų7121%0.21435%0.347CS..Hα-helixtrans-68.7-43.1176.9-64.9-3000111.7R226 Q227 C228 I232 N233 E234 D527R226-N230 PolarHBondContact O-N 3.16Å; R226-N230 PolarHBondContact O-OD1 3.03Å; R226-N230 VanDerWaalsContact O-OD1 3.05Å; Q227-N230 WeakPolarHBondContact O-CB 3.25Å; Q227-N230 PolarHBondContact O-N 3.35Å; C228-N230 PolarHBondContact O-N 3.14Å; N230-I232 VanDerWaalsContact C-N 3.33Å; N230-I232 PolarHBondContact O-N 3.09Å; N230-N233 PolarHBondContact O-N 3.07Å; N230-E234 WeakPolarHBondContact O-CB 3.37Å; N230-E234 WeakPolarHBondContact O-CG 3.32Å; N230-E234 PolarHBondContact O-N 3.36Å; N230-D527 WeakPolarHBondContact OD1-CB 3.4Å
231H70.6Confident72Confident110 Ų11069.5 Ų69.551%0.50935%0.349SS..Hα-helixtrans-61.5-41.7176.2-80.3-64.7000112Q227 C228 E234 S235Q227-H231 PolarHBondContact O-CD2 2.85Å; Q227-H231 PolarHBondContact O-N 2.87Å; C228-H231 PolarHBondContact O-N 3.38Å; C228-H231 VanDerWaalsContact O-N 3.12Å; H231-E234 PolarHBondContact O-N 3.37Å; H231-S235 WeakPolarHBondContact O-CB 3.3Å; H231-S235 PolarHBondContact O-N 3.3Å; H231-S235 PolarHBondContact O-OG 2.84Å
232I73.5Confident71Confident59 Ų5971 Ų7130%0.30336%0.359SS..Hα-helixtrans-61.3-51.3175.4-64.7166.5000109.9C228 N230 E234 S235 E236C228-I232 WeakPolarHBondContact O-CG1 3.41Å; C228-I232 PolarHBondContact O-N 2.68Å; N230-I232 VanDerWaalsContact C-N 3.33Å; N230-I232 PolarHBondContact O-N 3.09Å; I232-E234 VanDerWaalsContact C-N 3.3Å; I232-E234 PolarHBondContact O-N 3.3Å; I232-S235 PolarHBondContact O-N 2.83Å; I232-S235 PolarHBondContact O-OG 3.44Å; I232-E236 HydrophobicContact CG2-CG 4.44Å; I232-E236 WeakPolarHBondContact O-CG 3.42Å; I232-E236 PolarHBondContact O-N 2.87Å
233N71.2Confident69.8Low54 Ų5472.8 Ų72.829%0.28937%0.368SS..Hα-helixtrans-60.5-35.8178.7-71.6-33.7000113.3N229 N230 R237N229-N233 WeakPolarHBondContact O-CB 3.41Å; N229-N233 PolarHBondContact O-N 3.42Å; N229-N233 PolarHBondContact O-ND2 2.85Å; N230-N233 PolarHBondContact O-N 3.07Å; N233-R237 WeakPolarHBondContact O-CG 3.38Å; N233-R237 PolarHBondContact O-N 2.75Å; N233-R237 VanDerWaalsContact O-N 3.1Å
234E70.2Confident68.6Low108 Ų10874.3 Ų74.351%0.50537%0.371SS..Hα-helixtrans-69-39.1174.7-77.3179.3-178.400111.8N230 H231 I232 R237 S238N230-E234 WeakPolarHBondContact O-CB 3.37Å; N230-E234 WeakPolarHBondContact O-CG 3.32Å; N230-E234 PolarHBondContact O-N 3.36Å; H231-E234 PolarHBondContact O-N 3.37Å; I232-E234 VanDerWaalsContact C-N 3.3Å; I232-E234 PolarHBondContact O-N 3.3Å; E234-R237 PolarHBondContact O-N 2.74Å; E234-S238 WeakPolarHBondContact O-CB 3.47Å; E234-S238 PolarHBondContact O-N 2.97Å; E234-S238 PolarHBondContact O-OG 3.4Å
235S71.3Confident66.8Low32 Ų3279.4 Ų79.422%0.22439%0.39CS..Hα-helixtrans-66.2-43.9176.574.40000111.8H231 I232 R237 S238 H239H231-S235 WeakPolarHBondContact O-CB 3.3Å; H231-S235 PolarHBondContact O-N 3.3Å; H231-S235 PolarHBondContact O-OG 2.84Å; I232-S235 PolarHBondContact O-N 2.83Å; I232-S235 PolarHBondContact O-OG 3.44Å; S235-R237 PolarHBondContact O-N 3.05Å; S235-S238 WeakPolarHBondContact O-CB 3.16Å; S235-S238 PolarHBondContact O-N 3.45Å; S235-H239 WeakPolarHBondContact O-CB 3.42Å; S235-H239 PolarHBondContact O-N 3.4Å
236E67.9Low65.8Low89 Ų8979 Ų7942%0.41639%0.391SS..Hα-helixtrans-61.7-43.7175.2-72179.7174.800111.7I232 S238 H239 N240I232-E236 HydrophobicContact CG2-CG 4.44Å; I232-E236 WeakPolarHBondContact O-CG 3.42Å; I232-E236 PolarHBondContact O-N 2.87Å; E236-S238 VanDerWaalsContact C-N 3.33Å; E236-S238 PolarHBondContact O-N 3.26Å; E236-H239 PolarHBondContact O-N 2.88Å; E236-N240 WeakPolarHBondContact O-CB 3.45Å; E236-N240 VanDerWaalsContact O-CG 3.27Å; E236-N240 PolarHBondContact O-N 3.42Å; E236-N240 PolarHBondContact O-ND2 3.15Å
237R65.8Low64.8Low170 Ų17079.1 Ų79.164%0.64240%0.396SS*.Hα-helixtrans-62.5-41.5175.1-77.8-176.7-147.9179.17.5112.2N233 E234 S235 H239 T241N233-R237 WeakPolarHBondContact O-CG 3.38Å; N233-R237 PolarHBondContact O-N 2.75Å; N233-R237 VanDerWaalsContact O-N 3.1Å; E234-R237 PolarHBondContact O-N 2.74Å; S235-R237 PolarHBondContact O-N 3.05Å; R237-H239 VanDerWaalsContact C-N 3.33Å; R237-T241 WeakPolarHBondContact O-CB 3.45Å; R237-T241 PolarHBondContact O-N 2.76Å; R237-T241 PolarHBondContact O-OG1 3.19Å
238S67.1Low63.5Low68 Ų6877.8 Ų77.848%0.47639%0.393SS..Hα-helixtrans-63.5-43.4178.2-57.90000110.5E234 S235 E236 T241 I242E234-S238 WeakPolarHBondContact O-CB 3.47Å; E234-S238 PolarHBondContact O-N 2.97Å; E234-S238 PolarHBondContact O-OG 3.4Å; S235-S238 WeakPolarHBondContact O-CB 3.16Å; S235-S238 PolarHBondContact O-N 3.45Å; E236-S238 VanDerWaalsContact C-N 3.33Å; E236-S238 PolarHBondContact O-N 3.26Å; S238-T241 PolarHBondContact O-N 2.9Å; S238-I242 VanDerWaalsContact O-CG1 3.28Å; S238-I242 WeakPolarHBondContact O-CG1 3.39Å; S238-I242 PolarHBondContact O-N 3.42Å
239H63.4Low61.9Low42 Ų4280.2 Ų80.219%0.19440%0.402CS..Hα-helixtrans-63.9-47.5176.8-169.5-89.5000112.6S235 E236 R237 T241 I242 Q243S235-H239 WeakPolarHBondContact O-CB 3.42Å; S235-H239 PolarHBondContact O-N 3.4Å; E236-H239 PolarHBondContact O-N 2.88Å; R237-H239 VanDerWaalsContact C-N 3.33Å; H239-T241 VanDerWaalsContact C-N 3.27Å; H239-T241 PolarHBondContact O-N 3.29Å; H239-I242 PolarHBondContact O-N 3.49Å; H239-I242 VanDerWaalsContact O-N 3.16Å; H239-Q243 WeakPolarHBondContact O-CG 3.24Å; H239-Q243 PolarHBondContact O-N 3.01Å
240N64.5Low60.7Low89 Ų8983 Ų8348%0.47642%0.417SS..Hα-helixtrans-61.5-37.1176.7-71.5-18.2000112.1E236 Q243 I244E236-N240 WeakPolarHBondContact O-CB 3.45Å; E236-N240 VanDerWaalsContact O-CG 3.27Å; E236-N240 PolarHBondContact O-N 3.42Å; E236-N240 PolarHBondContact O-ND2 3.15Å; N240-Q243 PolarHBondContact O-N 2.93Å; N240-I244 WeakPolarHBondContact O-CD1 3.31Å; N240-I244 VanDerWaalsContact O-CG1 3.25Å; N240-I244 WeakPolarHBondContact O-CG1 3.4Å; N240-I244 PolarHBondContact O-N 2.99Å
241T55.8Low59.7Low69 Ų6984.2 Ų84.242%0.42343%0.429SS..Hα-helixtrans-64.1-46.2175-560000110.5R237 S238 H239 Q243 I244 Y245R237-T241 WeakPolarHBondContact O-CB 3.45Å; R237-T241 PolarHBondContact O-N 2.76Å; R237-T241 PolarHBondContact O-OG1 3.19Å; S238-T241 PolarHBondContact O-N 2.9Å; H239-T241 VanDerWaalsContact C-N 3.27Å; H239-T241 PolarHBondContact O-N 3.29Å; T241-Q243 PolarHBondContact O-N 3.4Å; T241-I244 PolarHBondContact O-N 3.07Å; T241-Y245 HydrophobicContact CG2-CD2 3.77Å; T241-Y245 HydrophobicContact CG2-CE2 3.57Å; T241-Y245 WeakPolarHBondContact O-CD2 3.46Å; T241-Y245 PolarHBondContact O-N 3.35Å
242I63.8Low58.5Low67 Ų6785.8 Ų85.834%0.34444%0.441SS..Hα-helixtrans-59.3-47.1176.8-67.6163.3000110.9S238 H239 I244 Y245 T246S238-I242 VanDerWaalsContact O-CG1 3.28Å; S238-I242 WeakPolarHBondContact O-CG1 3.39Å; S238-I242 PolarHBondContact O-N 3.42Å; H239-I242 PolarHBondContact O-N 3.49Å; H239-I242 VanDerWaalsContact O-N 3.16Å; I242-I244 VanDerWaalsContact C-N 3.34Å; I242-I244 PolarHBondContact O-N 3.22Å; I242-Y245 PolarHBondContact O-N 3.03Å; I242-Y245 VanDerWaalsContact O-N 3.14Å; I242-T246 HydrophobicContact CG2-CG2 4.29Å; I242-T246 WeakPolarHBondContact O-CG2 3.41Å; I242-T246 PolarHBondContact O-N 2.83Å; I242-T246 PolarHBondContact O-OG1 2.9Å
243Q56.3Low57Low73 Ų7386.8 Ų86.834%0.34145%0.453SS..Hα-helixtrans-58.1-41.6178-76.4-88.4-18.800112.9H239 N240 T241 T246 N247H239-Q243 WeakPolarHBondContact O-CG 3.24Å; H239-Q243 PolarHBondContact O-N 3.01Å; N240-Q243 PolarHBondContact O-N 2.93Å; T241-Q243 PolarHBondContact O-N 3.4Å; Q243-T246 WeakPolarHBondContact CA-OG1 3.43Å; Q243-T246 PolarHBondContact O-N 3.34Å; Q243-T246 PolarHBondContact O-OG1 3.41Å; Q243-N247 WeakPolarHBondContact O-CB 3.35Å; Q243-N247 PolarHBondContact O-N 3.33Å
244I54.2Low55.4Low88 Ų8891 Ų9145%0.45148%0.476SS..Hα-helixtrans-64.9-42.9175.8-67.9163.6000110.7N240 T241 I242 N248N240-I244 WeakPolarHBondContact O-CD1 3.31Å; N240-I244 VanDerWaalsContact O-CG1 3.25Å; N240-I244 WeakPolarHBondContact O-CG1 3.4Å; N240-I244 PolarHBondContact O-N 2.99Å; T241-I244 PolarHBondContact O-N 3.07Å; I242-I244 VanDerWaalsContact C-N 3.34Å; I242-I244 PolarHBondContact O-N 3.22Å; I244-N248 WeakPolarHBondContact O-CB 3.44Å; I244-N248 PolarHBondContact O-N 3.4Å
245Y42.6Very low53.6Low156 Ų15692.1 Ų92.161%0.61249%0.49SS*.Hα-helixtrans-65-42.7176.9-84.7-72.4000112.6T241 I242 N248 N249T241-Y245 HydrophobicContact CG2-CD2 3.77Å; T241-Y245 HydrophobicContact CG2-CE2 3.57Å; T241-Y245 WeakPolarHBondContact O-CD2 3.46Å; T241-Y245 PolarHBondContact O-N 3.35Å; I242-Y245 PolarHBondContact O-N 3.03Å; I242-Y245 VanDerWaalsContact O-N 3.14Å; Y245-N248 PolarHBondContact O-N 3.39Å; Y245-N249 PolarHBondContact O-N 3.45Å
246T57.2Low51.7Low59 Ų5998.8 Ų98.836%0.36252%0.518SS..Hα-helixtrans-65.8-40.8178.249.80000111.7I242 Q243 N249 N250I242-T246 HydrophobicContact CG2-CG2 4.29Å; I242-T246 WeakPolarHBondContact O-CG2 3.41Å; I242-T246 PolarHBondContact O-N 2.83Å; I242-T246 PolarHBondContact O-OG1 2.9Å; Q243-T246 WeakPolarHBondContact CA-OG1 3.43Å; Q243-T246 PolarHBondContact O-N 3.34Å; Q243-T246 PolarHBondContact O-OG1 3.41Å; T246-N249 PolarHBondContact O-N 2.85Å; T246-N250 WeakPolarHBondContact O-CB 3.33Å; T246-N250 VanDerWaalsContact O-CG 3.28Å; T246-N250 PolarHBondContact O-N 3.44Å
247N53.9Low49.7Very low70 Ų70106.8 Ų106.837%0.37454%0.544SS..Hα-helixtrans-67.6-39.6177.7-75.5-8000112.4Q243 N250 S251Q243-N247 WeakPolarHBondContact O-CB 3.35Å; Q243-N247 PolarHBondContact O-N 3.33Å; N247-N250 PolarHBondContact O-N 2.9Å; N247-S251 PolarHBondContact O-N 2.88Å; N247-S251 VanDerWaalsContact O-N 3.08Å; N247-S251 PolarHBondContact O-OG 3.4Å
248N44.9Very low47.8Very low80 Ų80105.9 Ų105.943%0.42855%0.55SS.*Hα-helixtrans-65.2-44175.5-75.4-7.6000111.9I244 Y245 N250 S251 D252I244-N248 WeakPolarHBondContact O-CB 3.44Å; I244-N248 PolarHBondContact O-N 3.4Å; Y245-N248 PolarHBondContact O-N 3.39Å; N248-N250 VanDerWaalsContact C-N 3.28Å; N248-N250 PolarHBondContact O-N 3.26Å; N248-S251 WeakPolarHBondContact CA-OG 3.27Å; N248-S251 PolarHBondContact O-N 2.87Å; N248-S251 PolarHBondContact O-OG 3.11Å; N248-S251 VanDerWaalsContact O-OG 3.13Å; N248-D252 PolarHBondContact O-N 2.89Å
249N43.5Very low45.8Very low106 Ų106107.4 Ų107.457%0.56756%0.561SS**Hα-helixtrans-64.9-32.4177.7-74.6-7.6000112.7Y245 T246Y245-N249 PolarHBondContact O-N 3.45Å; T246-N249 PolarHBondContact O-N 2.85Å
250N47.9Very low44.1Very low113 Ų113109.9 Ų109.960%0.60458%0.581SS**Hα-helixtrans-77.4-22.4176.6-72-9.2000113.1T246 N247 N248 S253T246-N250 WeakPolarHBondContact O-CB 3.33Å; T246-N250 VanDerWaalsContact O-CG 3.28Å; T246-N250 PolarHBondContact O-N 3.44Å; N247-N250 PolarHBondContact O-N 2.9Å; N248-N250 VanDerWaalsContact C-N 3.28Å; N248-N250 PolarHBondContact O-N 3.26Å; N250-S253 PolarHBondContact O-OG 3.43Å
251S47.4Very low42.2Very low66 Ų66110.8 Ų110.846%0.46259%0.59SS.*Hα-helixtrans-87.3-14178.134.90000113.8N247 N248 S253N247-S251 PolarHBondContact O-N 2.88Å; N247-S251 VanDerWaalsContact O-N 3.08Å; N247-S251 PolarHBondContact O-OG 3.4Å; N248-S251 WeakPolarHBondContact CA-OG 3.27Å; N248-S251 PolarHBondContact O-N 2.87Å; N248-S251 PolarHBondContact O-OG 3.11Å; N248-S251 VanDerWaalsContact O-OG 3.13Å; S251-S253 PolarHBondContact O-N 3.35Å
252D45Very low41Very low144 Ų144114.1 Ų114.177%0.7760%0.604SS**SBendtrans-71.2-13168-76.6-24.7000112.8N248N248-D252 PolarHBondContact O-N 2.89Å
253S43.8Very low39.2Very low80 Ų80117.4 Ų117.456%0.55962%0.622SS**SBendtrans-100.986.1170.255.80000111.1N250 S251N250-S253 PolarHBondContact O-OG 3.43Å; S251-S253 PolarHBondContact O-N 3.35Å
254N36Very low37.9Very low143 Ų143120.2 Ų120.277%0.76564%0.638SS**SBendtrans63.8136.5171.2-63.4-28.8000116.6
255T32.2Very low36.7Very low130 Ų130119 Ų11980%0.79863%0.632SS**SBendtrans94.1140.4164.2-18.40000116.5
256E32Very low36Very low173 Ų173115.7 Ų115.781%0.80863%0.63SS**  trans-49150.8-164.6-64.9173.4141.600115.8I258E256-I258 PolarHBondContact O-N 3.1Å
257R26.2Very low35Very low257 Ų257121.6 Ų121.697%0.9765%0.65SS**  trans-47.391.3177.4-79.6-177.4-100.8-157.9-7.8112.6
258I26.5Very low33.8Very low150 Ų150125.4 Ų125.477%0.76967%0.67SS**  trans-86.6111158.8-60.1173.8000106.2E256E256-I258 PolarHBondContact O-N 3.1Å
259S24.8Very low33.4Very low100 Ų100123 Ų12370%0.69966%0.66SS**  trans-51.6137.2171.6-92.80000109.8T261S259-T261 PolarHBondContact O-N 2.9Å
260P28.1Very low33.1Very low95 Ų95124.8 Ų124.862%0.61767%0.665SS**  trans-60.9103.8-173.623.4-32000109.5L262P260-L262 PolarHBondContact O-N 3.49Å
261T24.3Very low32.5Very low108 Ų108125.6 Ų125.666%0.66367%0.665SS**  trans-69.5115170.7-62.70000106.3S259 L263S259-T261 PolarHBondContact O-N 2.9Å; T261-L263 VanDerWaalsContact C-N 3.3Å; T261-L263 PolarHBondContact O-N 3.33Å
262L30.6Very low32Very low139 Ų139124 Ų12473%0.72865%0.651SS**  trans-61.990.1175.8-164.992.5000108.2P260 I264P260-L262 PolarHBondContact O-N 3.49Å; L262-I264 HydrophobicContact CD2-CD1 3.8Å; L262-I264 HydrophobicContact CD2-CG1 3.63Å; L262-I264 HydrophobicContact CG-CG1 4.15Å; L262-I264 PolarHBondContact O-N 3.2Å
263L26Very low31.5Very low136 Ų136122.1 Ų122.171%0.71264%0.638SS**  trans-68.787.6169.3-86.9163000107.8T261 L265T261-L263 VanDerWaalsContact C-N 3.3Å; T261-L263 PolarHBondContact O-N 3.33Å; L263-L265 VanDerWaalsContact C-N 3.33Å; L263-L265 PolarHBondContact O-N 2.99Å
264I28.7Very low31.2Very low132 Ų132124.4 Ų124.468%0.67764%0.638SS**  trans-69.698162.6-57.7173.4000105.3L262L262-I264 HydrophobicContact CD2-CD1 3.8Å; L262-I264 HydrophobicContact CD2-CG1 3.63Å; L262-I264 HydrophobicContact CG-CG1 4.15Å; L262-I264 PolarHBondContact O-N 3.2Å
265L29.1Very low31.2Very low62 Ų62119.9 Ų119.933%0.32561%0.613SS.*  trans-57.2130.3166.2-74.5167.6000107.8L263 K267 N272L263-L265 VanDerWaalsContact C-N 3.33Å; L263-L265 PolarHBondContact O-N 2.99Å; L265-K267 PolarHBondContact O-N 3.14Å; L265-N272 WeakPolarHBondContact CB-ND2 3.37Å; L265-N272 PolarHBondContact O-ND2 2.91Å
266P26.8Very low31.3Very low87 Ų87116.4 Ų116.457%0.56559%0.589SS**  trans-52.7140.1178.7-2432000110.8D268 S269 N272P266-D268 PolarHBondContact O-N 3.45Å; P266-S269 PolarHBondContact O-N 3.2Å; P266-S269 VanDerWaalsContact O-N 3.16Å; P266-N272 PolarHBondContact O-ND2 3.23Å
267K36.2Very low31.4Very low183 Ų183113.5 Ų113.580%0.79658%0.579SS**THydrogen-bonded Turntrans-52.4-23.1-179-86.8-176.1171.7-178.50113.9L265L265-K267 PolarHBondContact O-N 3.14Å
268D30.6Very low31.8Very low149 Ų149111.4 Ų111.480%0.79757%0.571SS**THydrogen-bonded Turntrans-110.317.4-172.1-50.2-40.8000113.8P266P266-D268 PolarHBondContact O-N 3.45Å
269S36.2Very low32.1Very low29 Ų29111.2 Ų111.220%0.20356%0.562CS.*  trans-74.8135.7172.680.40000111P266 E271 N272 Q273P266-S269 PolarHBondContact O-N 3.2Å; P266-S269 VanDerWaalsContact O-N 3.16Å; S269-E271 PolarHBondContact O-N 3.25Å; S269-N272 WeakPolarHBondContact O-CB 3.44Å; S269-N272 PolarHBondContact O-N 3.46Å; S269-N272 WeakPolarHBondContact OG-CB 3.34Å; S269-N272 PolarHBondContact OG-N 2.91Å; S269-N272 VanDerWaalsContact OG-N 3.14Å; S269-Q273 PolarHBondContact O-N 3.45Å; S269-Q273 VanDerWaalsContact O-N 3.11Å
270E36.9Very low32.2Very low145 Ų145109.6 Ų109.668%0.67855%0.551SS**Hα-helixtrans-53.6-28.8174.8-76.5-168.2172.400112.5Q273 K274E270-Q273 PolarHBondContact O-N 2.9Å; E270-K274 WeakPolarHBondContact O-CB 3.34Å; E270-K274 WeakPolarHBondContact O-CG 3.16Å; E270-K274 PolarHBondContact O-N 3.29Å; E270-K274 IonicContact OE2-NZ 3.63Å
271E35.2Very low32.3Very low130 Ų130110 Ų11061%0.60755%0.554SS**Hα-helixtrans-70.6-42.6178-138.1171.3-173.700111.7S269 Q273 K274 I275S269-E271 PolarHBondContact O-N 3.25Å; E271-Q273 VanDerWaalsContact C-N 3.32Å; E271-Q273 PolarHBondContact O-N 3.44Å; E271-K274 PolarHBondContact O-N 2.89Å; E271-I275 HydrophobicContact CG-CD1 4.46Å; E271-I275 WeakPolarHBondContact O-CB 3.28Å; E271-I275 WeakPolarHBondContact O-CD1 3.21Å; E271-I275 WeakPolarHBondContact O-CG1 3.45Å; E271-I275 PolarHBondContact O-N 3.24Å
272N36.4Very low32.5Very low31 Ų31114 Ų11417%0.16656%0.564CS.*Hα-helixtrans-60.9-41.6171.1-98.8-15.5000111.1L265 P266 S269 I275 L276L265-N272 WeakPolarHBondContact CB-ND2 3.37Å; L265-N272 PolarHBondContact O-ND2 2.91Å; P266-N272 PolarHBondContact O-ND2 3.23Å; S269-N272 WeakPolarHBondContact O-CB 3.44Å; S269-N272 PolarHBondContact O-N 3.46Å; S269-N272 WeakPolarHBondContact OG-CB 3.34Å; S269-N272 PolarHBondContact OG-N 2.91Å; S269-N272 VanDerWaalsContact OG-N 3.14Å; N272-I275 PolarHBondContact O-N 3.31Å; N272-L276 WeakPolarHBondContact O-CB 3.47Å; N272-L276 WeakPolarHBondContact O-CD1 3.3Å; N272-L276 VanDerWaalsContact O-CG 3.28Å; N272-L276 WeakPolarHBondContact O-CG 3.06Å; N272-L276 PolarHBondContact O-N 3.06Å
273Q35.6Very low32.5Very low106 Ų106111.6 Ų111.650%0.49555%0.552SS.*Hα-helixtrans-64.4-49.4178.9-147.983.916.700111.8S269 E270 E271 I275 L276 D277S269-Q273 PolarHBondContact O-N 3.45Å; S269-Q273 VanDerWaalsContact O-N 3.11Å; E270-Q273 PolarHBondContact O-N 2.9Å; E271-Q273 VanDerWaalsContact C-N 3.32Å; E271-Q273 PolarHBondContact O-N 3.44Å; Q273-I275 VanDerWaalsContact C-N 3.28Å; Q273-I275 PolarHBondContact O-N 3.16Å; Q273-L276 PolarHBondContact O-N 3.04Å; Q273-D277 PolarHBondContact O-N 3.21Å
274K36Very low32.5Very low128 Ų128107.6 Ų107.656%0.55754%0.535SS*.Hα-helixtrans-63.5-31.5178.6-78.6171.8-179.5158.50112.9E270 E271 R278E270-K274 WeakPolarHBondContact O-CB 3.34Å; E270-K274 WeakPolarHBondContact O-CG 3.16Å; E270-K274 PolarHBondContact O-N 3.29Å; E270-K274 IonicContact OE2-NZ 3.63Å; E271-K274 PolarHBondContact O-N 2.89Å; K274-R278 PolarHBondContact O-N 3.12Å
275I36.2Very low32.6Very low48 Ų48110.2 Ų110.225%0.24654%0.541CS..Hα-helixtrans-76.3-41.9177.1-68.2167.2000110.6E271 N272 Q273 D277 R278 Y279E271-I275 HydrophobicContact CG-CD1 4.46Å; E271-I275 WeakPolarHBondContact O-CB 3.28Å; E271-I275 WeakPolarHBondContact O-CD1 3.21Å; E271-I275 WeakPolarHBondContact O-CG1 3.45Å; E271-I275 PolarHBondContact O-N 3.24Å; N272-I275 PolarHBondContact O-N 3.31Å; Q273-I275 VanDerWaalsContact C-N 3.28Å; Q273-I275 PolarHBondContact O-N 3.16Å; I275-D277 VanDerWaalsContact C-N 3.27Å; I275-D277 PolarHBondContact O-N 2.95Å; I275-R278 PolarHBondContact O-N 2.98Å; I275-R278 VanDerWaalsContact O-N 3.12Å; I275-Y279 HydrophobicContact CG2-CD2 3.97Å; I275-Y279 HydrophobicContact CG2-CE2 4.25Å; I275-Y279 WeakPolarHBondContact O-CD2 3.28Å; I275-Y279 PolarHBondContact O-N 3.43Å; I275-Y279 VanDerWaalsContact O-N 3.08Å
276L35.4Very low32.6Very low56 Ų56114.2 Ų114.229%0.29356%0.563SS.*Hα-helixtrans-58.7-38.8172.7-78.5165.5000111.8N272 Q273 R278 S280N272-L276 WeakPolarHBondContact O-CB 3.47Å; N272-L276 WeakPolarHBondContact O-CD1 3.3Å; N272-L276 VanDerWaalsContact O-CG 3.28Å; N272-L276 WeakPolarHBondContact O-CG 3.06Å; N272-L276 PolarHBondContact O-N 3.06Å; Q273-L276 PolarHBondContact O-N 3.04Å; L276-R278 VanDerWaalsContact C-N 3.35Å; L276-S280 VanDerWaalsContact O-CB 3.29Å; L276-S280 WeakPolarHBondContact O-CB 3.47Å; L276-S280 PolarHBondContact O-N 3.44Å; L276-S280 PolarHBondContact O-OG 3.28Å
277D34.1Very low33Very low113 Ų113116.8 Ų116.860%0.60457%0.567SS**Hα-helixtrans-67.4-34175.6-72-23000112.6Q273 I275Q273-D277 PolarHBondContact O-N 3.21Å; I275-D277 VanDerWaalsContact C-N 3.27Å; I275-D277 PolarHBondContact O-N 2.95Å
278R33.7Very low32.8Very low213 Ų213110.9 Ų110.980%0.80454%0.542SS*.Hα-helixtrans-77.1-28.8-178.7-155.2-176.8-73.8-158.4-0.6112.8K274 I275 L276K274-R278 PolarHBondContact O-N 3.12Å; I275-R278 PolarHBondContact O-N 2.98Å; I275-R278 VanDerWaalsContact O-N 3.12Å; L276-R278 VanDerWaalsContact C-N 3.35Å
279Y33.2Very low33.2Very low146 Ų146108.4 Ų108.457%0.57353%0.529SS*.Hα-helixtrans-101-11.1179.4-78.8-79000114.8I275 P281I275-Y279 HydrophobicContact CG2-CD2 3.97Å; I275-Y279 HydrophobicContact CG2-CE2 4.25Å; I275-Y279 WeakPolarHBondContact O-CD2 3.28Å; I275-Y279 PolarHBondContact O-N 3.43Å; I275-Y279 VanDerWaalsContact O-N 3.08Å; Y279-P281 WeakPolarHBondContact O-CD 3.29Å
280S26.4Very low33.2Very low66 Ų66115.8 Ų115.846%0.46256%0.56SS.*SBendtrans-70.8106164.3-68.70000107.9L276 Q282L276-S280 VanDerWaalsContact O-CB 3.29Å; L276-S280 WeakPolarHBondContact O-CB 3.47Å; L276-S280 PolarHBondContact O-N 3.44Å; L276-S280 PolarHBondContact O-OG 3.28Å; S280-Q282 PolarHBondContact O-N 3.1Å
281P30.2Very low33.3Very low104 Ų104113.6 Ų113.668%0.67555%0.553SS**  trans-59.7131.5165.5-4.121.8000104.7Y279 I283Y279-P281 WeakPolarHBondContact O-CD 3.29Å; P281-I283 PolarHBondContact O-N 3.42Å
282Q28.3Very low33.5Very low191 Ų191107.7 Ų107.789%0.89353%0.525SS*.  trans-53.695.3175.8-62.1-149-10.700108.8S280 S284S280-Q282 PolarHBondContact O-N 3.1Å; Q282-S284 PolarHBondContact O-N 2.91Å
283I30.3Very low33.5Very low89 Ų89115 Ų11546%0.45655%0.551SS.*  trans-61.4101.6158.2-63.4173.9000101.4P281 K285 E287 F288P281-I283 PolarHBondContact O-N 3.42Å; I283-K285 PolarHBondContact O-N 2.93Å; I283-E287 HydrophobicContact CG2-CB 4.49Å; I283-F288 HydrophobicContact CG2-CD2 4.46Å; I283-F288 HydrophobicContact CG2-CE2 4.11Å
284S26.8Very low33.3Very low51 Ų51113.7 Ų113.736%0.35755%0.547SS..  trans-49.4130.7-177.6178.80000107.3Q282 N286 E287Q282-S284 PolarHBondContact O-N 2.91Å; S284-N286 PolarHBondContact O-N 3.23Å; S284-N286 VanDerWaalsContact OG-CB 3.26Å; S284-N286 WeakPolarHBondContact OG-CB 3.23Å; S284-N286 VanDerWaalsContact OG-CG 3.24Å; S284-N286 PolarHBondContact OG-N 3.04Å; S284-N286 PolarHBondContact OG-ND2 3.29Å; S284-E287 PolarHBondContact O-N 3.39Å
285K30Very low33.4Very low188 Ų188108.6 Ų108.682%0.81753%0.527SS*.G310 helixtrans-48.4-21.3169.1-78.8179.8173.7177.90111.5I283 E287 F288I283-K285 PolarHBondContact O-N 2.93Å; K285-E287 VanDerWaalsContact C-N 3.29Å; K285-E287 PolarHBondContact O-N 3.24Å; K285-F288 PolarHBondContact O-N 3.02Å
286N29.4Very low33.1Very low145 Ų145113.6 Ų113.678%0.77555%0.549SS*.G310 helixtrans-72.5-9.6176.9-52.4-7.4000115S284S284-N286 PolarHBondContact O-N 3.23Å; S284-N286 VanDerWaalsContact OG-CB 3.26Å; S284-N286 WeakPolarHBondContact OG-CB 3.23Å; S284-N286 VanDerWaalsContact OG-CG 3.24Å; S284-N286 PolarHBondContact OG-N 3.04Å; S284-N286 PolarHBondContact OG-ND2 3.29Å
287E35.8Very low32.8Very low141 Ų141118.3 Ų118.366%0.65957%0.57SS**G310 helixtrans-93.1-7.2174.5-142166.6-163.300112.3K224 I283 S284 K285K224-E287 PolarHBondContact NZ-O 3.17Å; I283-E287 HydrophobicContact CG2-CB 4.49Å; S284-E287 PolarHBondContact O-N 3.39Å; K285-E287 VanDerWaalsContact C-N 3.29Å; K285-E287 PolarHBondContact O-N 3.24Å
288F31.1Very low32.4Very low60 Ų60116.3 Ų116.326%0.26356%0.563SS.*SBendtrans-100.5117.8162.6-76.5-96.1000107.6K224 I283 K285 E290 D292K224-F288 HydrophobicContact CD-CD1 4.4Å; K224-F288 HydrophobicContact CD-CE1 3.89Å; K224-F288 HydrophobicContact CD-CZ 4.15Å; I283-F288 HydrophobicContact CG2-CD2 4.46Å; I283-F288 HydrophobicContact CG2-CE2 4.11Å; K285-F288 PolarHBondContact O-N 3.02Å; F288-E290 PolarHBondContact O-N 3.04Å; F288-D292 HydrophobicContact CD1-CB 4.06Å
289D39.3Very low32Very low97 Ų97111.4 Ų111.452%0.51957%0.567SS.*  trans-57.4132.6156.4-66.3-34.2000105.6D291 D292D289-D291 HydrophobicContact CB-CB 4.48Å; D289-D291 PolarHBondContact O-N 3.35Å; D289-D292 PolarHBondContact O-N 3.18Å
290E37.2Very low31.9Very low184 Ų184108.6 Ų108.686%0.8656%0.56SS**G310 helixtrans-50.4-26.8178.8-74.6-175.8149.800111.9F288 D292F288-E290 PolarHBondContact O-N 3.04Å; E290-D292 VanDerWaalsContact C-N 3.3Å; E290-D292 PolarHBondContact O-N 3.48Å
291D39.5Very low31.8Very low98 Ų98114.8 Ų114.852%0.52458%0.578SS.*G310 helixtrans-66.6-11.1174.8-63.9-5.5000116.9K217 D289 W293K217-D291 IonicContact NZ-OD2 3.09Å; K217-D291 PolarHBondContact NZ-OD2 3.23Å; D289-D291 HydrophobicContact CB-CB 4.48Å; D289-D291 PolarHBondContact O-N 3.35Å; D291-W293 VanDerWaalsContact C-N 3.31Å
292D37.6Very low31.6Very low6 Ų6117.3 Ų117.33%0.03259%0.585CS.*G310 helixtrans-78.9-11.8-175.9-89-11.3000113K224 F288 D289 E290K224-D292 IonicContact NZ-OD2 2.69Å; K224-D292 PolarHBondContact NZ-OD2 3.04Å; F288-D292 HydrophobicContact CD1-CB 4.06Å; D289-D292 PolarHBondContact O-N 3.18Å; E290-D292 VanDerWaalsContact C-N 3.3Å; E290-D292 PolarHBondContact O-N 3.48Å
293W36.9Very low31.5Very low184 Ų184113.9 Ų113.970%0.69757%0.573SS**G310 helixtrans-85-12-176.5-73.291.9000115.2D291 V295D291-W293 VanDerWaalsContact C-N 3.31Å; W293-V295 PolarHBondContact O-N 2.96Å
294D32Very low31.2Very low79 Ų79116.1 Ų116.142%0.42259%0.585SS.*  trans-76.730.5-175.4-68.6-22.8000114.5L5L5-D294 HydrophobicContact CD1-CB 4.42Å; L5-D294 WeakPolarHBondContact CD1-O 3.49Å
295V38Very low31Very low21 Ų21118.7 Ų118.713%0.12760%0.603CS.*  trans-101.297.2177.1174.10000109.5Y9 Y221 W293 Q297Y9-V295 HydrophobicContact CE1-CG1 4.39Å; Y9-V295 WeakPolarHBondContact OH-CA 3.48Å; Y9-V295 WeakPolarHBondContact OH-CG1 3.38Å; Y221-V295 HydrophobicContact CD1-CB 4.34Å; Y221-V295 HydrophobicContact CD1-CG1 3.94Å; Y221-V295 HydrophobicContact CD1-CG2 4.42Å; Y221-V295 HydrophobicContact CD2-CB 4.32Å; Y221-V295 HydrophobicContact CD2-CG2 4.27Å; Y221-V295 HydrophobicContact CE1-CB 4.28Å; Y221-V295 HydrophobicContact CE1-CG1 3.8Å; Y221-V295 HydrophobicContact CE2-CB 4.26Å; Y221-V295 HydrophobicContact CG-CB 4.37Å; Y221-V295 HydrophobicContact CG-CG1 4.45Å; Y221-V295 HydrophobicContact CG-CG2 4.13Å; W293-V295 PolarHBondContact O-N 2.96Å; V295-Q297 PolarHBondContact O-N 3.42Å
296E30Very low30.7Very low154 Ų154115.5 Ų115.572%0.7260%0.604SS**PPolyproline II helixtrans-60119.9172.3-149.3172.7-15500109.6P298E296-P298 WeakPolarHBondContact O-CD 3.39Å
297Q28.8Very low30.6Very low155 Ų155113.2 Ų113.272%0.72460%0.598SS**PPolyproline II helixtrans-69.8121.3178.1-66.2-178.8-3.700108.9V295 A299V295-Q297 PolarHBondContact O-N 3.42Å; Q297-A299 PolarHBondContact O-N 3.06Å
298P25.7Very low29.9Very low71 Ų71112.8 Ų112.846%0.46160%0.6SS.*PPolyproline II helixtrans-61.2133.1159.9-1125.9000106.9E296 E300E296-P298 WeakPolarHBondContact O-CD 3.39Å; P298-E300 HydrophobicContact CB-CG 4.44Å; P298-E300 PolarHBondContact O-N 3.41Å
299A24.7Very low29.7Very low109 Ų109120.2 Ų120.290%0.90163%0.632SS**  trans-61.874.5173.200000110.5Q297 K301Q297-A299 PolarHBondContact O-N 3.06Å; A299-K301 PolarHBondContact O-N 3.36Å
300E32.4Very low28.8Very low87 Ų87124 Ų12441%0.40765%0.646SS.*  trans-84.7106.4174-77.4-174.7176.300107.2P298 L302 R522P298-E300 HydrophobicContact CB-CG 4.44Å; P298-E300 PolarHBondContact O-N 3.41Å; E300-L302 PolarHBondContact O-N 3.23Å; E300-R522 IonicContact OE2-NH1 3.58Å
301K23.5Very low28.1Very low197 Ų197123.1 Ų123.186%0.85765%0.647SS**  trans-54.2107.4164.6-73.9179.7178178.60107.6A299 L303A299-K301 PolarHBondContact O-N 3.36Å; K301-L303 PolarHBondContact O-N 3.33Å
302L25.8Very low27.3Very low156 Ų156122.5 Ų122.582%0.81765%0.65SS**  trans-52.6112.1167.1-78.1161000107.4E300 N304E300-L302 PolarHBondContact O-N 3.23Å; L302-N304 PolarHBondContact O-N 3.33Å
303L26.7Very low26.5Very low120 Ų120131.1 Ų131.163%0.62869%0.693SS**SBendtrans-68.519.2178-84.7163.7000113.5K301K301-L303 PolarHBondContact O-N 3.33Å
304N24.3Very low25.8Very low136 Ų136130.2 Ų130.273%0.72770%0.701SS**  trans-105.472.9174.8-74.5-7.6000110.2L302L302-N304 PolarHBondContact O-N 3.33Å
305S23.2Very low25.2Very low104 Ų104131.3 Ų131.373%0.72771%0.714SS**  trans-130.887148.364.30000106.8P307S305-P307 WeakPolarHBondContact O-CD 3.45Å
306S22.6Very low24.5Very low121 Ų121136.5 Ų136.585%0.84675%0.747SS**  trans-81.2110.1151.2-166.50000105.1
307P27.3Very low24Very low97 Ų97135.3 Ų135.363%0.6375%0.75SS**  trans-73.8156.3171.720.6-8.6000108.9S305S305-P307 WeakPolarHBondContact O-CD 3.45Å
308N22.1Very low23.6Very low133 Ų133132.2 Ų132.271%0.71175%0.751SS**  trans85.882.4166.8-51.3-14.2000116.8
309K25Very low23.4Very low215 Ų215136 Ų13694%0.93577%0.773SS**  -126.564.5123.4-84.8-169.1175.7-176.30108.9L311K309-L311 PolarHBondContact O-N 3.49Å; K309-L311 VanDerWaalsContact O-N 3.13Å
310E20.9Very low23Very low176 Ų176136.4 Ų136.482%0.82276%0.764SS**  trans-67.894.1148.6-73.2179.5161.100105.8S312E310-S312 VanDerWaalsContact C-N 3.31Å; E310-S312 PolarHBondContact O-N 3.02Å; E310-S312 VanDerWaalsContact O-N 3.17Å
311L23.4Very low22.4Very low166 Ų166139.1 Ų139.187%0.86978%0.782SS**  trans-78.896.6163.2-167.468.6000105.9K309K309-L311 PolarHBondContact O-N 3.49Å; K309-L311 VanDerWaalsContact O-N 3.13Å
312S21.5Very low22.3Very low85 Ų85135.9 Ų135.959%0.59478%0.778SS**  trans-8.3118.1165.853.40000115.6E310 L314E310-S312 VanDerWaalsContact C-N 3.31Å; E310-S312 PolarHBondContact O-N 3.02Å; E310-S312 VanDerWaalsContact O-N 3.17Å; S312-L314 PolarHBondContact O-N 3.38Å; S312-L314 VanDerWaalsContact O-N 3.12Å
313M21.9Very low22Very low188 Ų188136.2 Ų136.293%0.92678%0.775SS**  trans-40.8111.3155-68.3179-77.800110.4
314L22Very low21.7Very low164 Ų164138.6 Ų138.686%0.85979%0.787SS**  trans-106.4105.4152.2-120.995.5000107.7S312S312-L314 PolarHBondContact O-N 3.38Å; S312-L314 VanDerWaalsContact O-N 3.12Å
315S20.2Very low21.4Very low102 Ų102135.7 Ų135.771%0.71378%0.778SS**  trans-55.7131.3163.849.80000112
316T21.9Very low21.2Very low131 Ų131137.4 Ų137.480%0.80478%0.779SS**  trans-154.9102139.236.10000109.9
317T19.3Very low21.2Very low128 Ų128140.1 Ų140.179%0.78578%0.778SS**  trans31.8111.5134.723.60000120.3
318A20.3Very low20.8Very low91 Ų91143.4 Ų143.475%0.75279%0.789SS**  44.4113.2120.600000120
319T21.6Very low20.7Very low150 Ų150143 Ų14392%0.9279%0.791SS**  trans-146.7134.5132.113.70000110.9
320T17.7Very low20.4Very low117 Ų117138.9 Ų138.972%0.71878%0.784SS**  trans-78167.9-175.937.90000114.2
321N20.2Very low20.3Very low145 Ų145133.6 Ų133.678%0.77578%0.777SS**  trans90.2130.7163.4-58.5-17.4000114.4
322T20.5Very low20.2Very low128 Ų128135.5 Ų135.579%0.78578%0.778SS**  cis-166.3153.621.98.10000109.6
323H19.4Very low20.1Very low163 Ų163137.8 Ų137.876%0.75579%0.788SS**  trans-27.7128.3168.2-83.8-101.8000117.2
324I20.6Very low20.1Very low170 Ų170136.3 Ų136.387%0.87278%0.784SS**  trans-133102140-60.6-178.2000107.1
325S18.1Very low20Very low76 Ų76135 Ų13553%0.53178%0.778SS.*  trans-86.4152164.5-560000109.5
326D19.7Very low20.1Very low140 Ų140136.6 Ų136.675%0.74978%0.779SS**  trans65.2111.7158.3-57.3-30.3000118.8
327H21.1Very low20.1Very low178 Ų178137.3 Ų137.382%0.82478%0.778SS**  -171.498116.8-95.6-64.3000110.5V329H327-V329 PolarHBondContact O-N 2.98Å
328L19.4Very low20.2Very low165 Ų165140.6 Ų140.686%0.86478%0.781SS**  trans-74.593.3167.2-151.7100.5000108.1T330L328-T330 HydrophobicContact CD2-CG2 4.5Å; L328-T330 PolarHBondContact O-N 3.48Å
329V19.9Very low20.2Very low126 Ų126145.3 Ų145.376%0.76479%0.787SS**  trans-85.299.3176.3179.30000109.5H327 G331H327-V329 PolarHBondContact O-N 2.98Å; V329-G331 PolarHBondContact O-N 3.25Å
330T19.2Very low20.2Very low127 Ų127146.4 Ų146.478%0.77978%0.782SS**  trans-76.188.9162.251.30000109.2L328L328-T330 HydrophobicContact CD2-CG2 4.5Å; L328-T330 PolarHBondContact O-N 3.48Å
331G19.6Very low20.3Very low66 Ų66150.1 Ų150.168%0.6879%0.788SS**  trans-87.8105.8173.400000111.2V329V329-G331 PolarHBondContact O-N 3.25Å
332K19.6Very low20.5Very low206 Ų206149.5 Ų149.590%0.89679%0.789SS**  trans-59.7139.6167.2-85178.3173.3176.90110.5N334K332-N334 PolarHBondContact O-N 3.4Å
333V21.1Very low20.6Very low132 Ų132150.1 Ų150.180%0.879%0.788SS**  trans-56.8120171.9178.60000109.5
334N20.4Very low20.8Very low158 Ų158145.9 Ų145.985%0.84579%0.789SS**  trans-132.8139.1158.5-96-7.1000108.3K332K332-N334 PolarHBondContact O-N 3.4Å
335D20.9Very low20.9Very low137 Ų137144.4 Ų144.473%0.73378%0.781SS**  trans-60.4159.7-169.8-76.2-49.6000115.8
336D21Very low21.1Very low135 Ų135150.1 Ų150.172%0.72280%0.796SS**  trans79.3114.1151.7-61.7-27000120
337N22.1Very low21.2Very low146 Ų146152.6 Ų152.678%0.78180%0.8SS**  trans70.479.8147-61.3-36.1000117.2
338K21.2Very low21.4Very low197 Ų197151.1 Ų151.186%0.85779%0.789SS**  -169.9111.4117.7-99.2155.5-171.9178.40108.7Q340K338-Q340 PolarHBondContact O-N 2.89Å
339E21.8Very low21.6Very low190 Ų190153.3 Ų153.389%0.88879%0.785SS**  trans-55.781.5154.4-71.8-178.9144.100108.5K341E339-K341 PolarHBondContact O-N 3.47Å
340Q20.5Very low22.2Very low173 Ų173151.1 Ų151.181%0.80877%0.774SS**  trans-65.4101155.1-99.7-177.3-13.700105.1K338 V342K338-Q340 PolarHBondContact O-N 2.89Å; Q340-V342 PolarHBondContact O-N 3.49Å
341K21Very low23.1Very low195 Ų195149.4 Ų149.485%0.84876%0.763SS**  trans-50.683165.7-73.2173.4175.5170.80108.9E339 N343E339-K341 PolarHBondContact O-N 3.47Å; K341-N343 VanDerWaalsContact C-N 3.26Å; K341-N343 PolarHBondContact O-N 3.28Å
342V22.8Very low24.1Very low131 Ų131153.8 Ų153.879%0.79477%0.766SS**  trans-66.698.4159.9176.90000105Q340 G344Q340-V342 PolarHBondContact O-N 3.49Å; V342-G344 PolarHBondContact O-N 2.88Å
343N23.6Very low25.5Very low141 Ų141145.1 Ų145.175%0.75473%0.73SS**  trans12.6102.5165-70.7-27.3000114.9K341 I345K341-N343 VanDerWaalsContact C-N 3.26Å; K341-N343 PolarHBondContact O-N 3.28Å; N343-I345 PolarHBondContact O-N 3.2Å
344G22.8Very low27.1Very low75 Ų75140 Ų14077%0.77370%0.7SS**  trans-5693.4177.300000112.2V342 K346V342-G344 PolarHBondContact O-N 2.88Å; G344-K346 PolarHBondContact O-N 3.06Å
345I23.2Very low28.8Very low139 Ų139132.5 Ų132.571%0.71366%0.66SS**  trans-66.189151.5-58.1175.6000104.7N343 K347N343-I345 PolarHBondContact O-N 3.2Å; I345-K347 VanDerWaalsContact C-N 3.34Å; I345-K347 PolarHBondContact O-N 3.45Å
346K21.7Very low30.4Very low195 Ų195134.4 Ų134.485%0.84866%0.657SS**  trans-56.3107.4164-77.9-177.4178.2176.10105.2G344 Y348G344-K346 PolarHBondContact O-N 3.06Å; K346-Y348 VanDerWaalsContact C-N 3.33Å; K346-Y348 PolarHBondContact O-N 2.82Å
347K22.3Very low31.9Very low193 Ų193132.7 Ų132.784%0.83964%0.641SS**  trans-45.2104.5165-103.8-179.5175.1173.30106.4I345 R349I345-K347 VanDerWaalsContact C-N 3.34Å; I345-K347 PolarHBondContact O-N 3.45Å; K347-R349 PolarHBondContact O-N 3.21Å
348Y25.3Very low33.6Very low147 Ų147126 Ų12658%0.57661%0.605SS**  trans-70.784.1172.1-170.3-96.2000106K346 P350 D379K346-Y348 VanDerWaalsContact C-N 3.33Å; K346-Y348 PolarHBondContact O-N 2.82Å; Y348-P350 HydrophobicContact CE1-CB 4.38Å; Y348-P350 VanDerWaalsContact O-CD 3.29Å; Y348-P350 WeakPolarHBondContact O-CD 3.45Å; Y348-D379 PolarHBondContact OH-OD2 2.92Å
349R23.6Very low35.3Very low211 Ų211120 Ų12080%0.79658%0.58SS**  trans-67.9118.2157.9-89.5-169.5-172.1-174.83.8104.9K347 V351K347-R349 PolarHBondContact O-N 3.21Å; R349-V351 PolarHBondContact O-N 3.47Å
350P32Very low36.9Very low80 Ų80118.4 Ų118.452%0.51957%0.565SS.*  trans-54.9114.5163.523.3-30.2000106.1Y348 Q352Y348-P350 HydrophobicContact CE1-CB 4.38Å; Y348-P350 VanDerWaalsContact O-CD 3.29Å; Y348-P350 WeakPolarHBondContact O-CD 3.45Å; P350-Q352 PolarHBondContact O-N 2.93Å
351V38.4Very low38.5Very low90 Ų90111.5 Ų111.555%0.54553%0.534SS..  trans-61111.8172.4175.90000104.8R349 T353R349-V351 PolarHBondContact O-N 3.47Å; V351-T353 VanDerWaalsContact C-N 3.32Å; V351-T353 HydrophobicContact CG1-CG2 4.06Å; V351-T353 PolarHBondContact O-N 2.96Å
352Q40.4Very low40.3Very low159 Ų159103.9 Ų103.974%0.74351%0.505SS*.  trans-60.498.1174-78.7-179.2-18.100108P350P350-Q352 PolarHBondContact O-N 2.93Å
353T48.7Very low41.8Very low23 Ų23104.9 Ų104.914%0.14150%0.499CS..  trans-94.5134.5176.843.40000108.8V351 R376V351-T353 VanDerWaalsContact C-N 3.32Å; V351-T353 HydrophobicContact CG1-CG2 4.06Å; V351-T353 PolarHBondContact O-N 2.96Å; T353-R376 HydrophobicContact CG2-CB 4.44Å; T353-R376 HydrophobicContact CG2-CG 3.99Å
354S55Low43.1Very low25 Ų2599.8 Ų99.818%0.17548%0.48CS..  trans-69.7137.6176.869.10000110S79 W356 Y357 I358S79-S354 WeakPolarHBondContact OG-CB 3.34Å; S354-W356 PolarHBondContact O-N 3.33Å; S354-W356 VanDerWaalsContact O-N 3.14Å; S354-Y357 PolarHBondContact O-N 2.95Å; S354-Y357 WeakPolarHBondContact OG-CB 3.47Å; S354-Y357 PolarHBondContact OG-N 3.25Å; S354-I358 PolarHBondContact O-N 3.47Å; S354-I358 VanDerWaalsContact O-N 3.08Å
355G57.1Low44.4Very low1 Ų1102 Ų1021%0.0147%0.473CS..Hα-helixtrans-54.7-31.1172.800000112.1I358 F359G355-I358 PolarHBondContact O-N 3.36Å; G355-F359 WeakPolarHBondContact O-CB 3.41Å; G355-F359 PolarHBondContact O-N 3.42Å
356W53.6Low45.8Very low177 Ų17796 Ų9667%0.6744%0.443SS*.Hα-helixtrans-63.8-47.3172.6179.8-112000113.5S354 I358 F359 R360S354-W356 PolarHBondContact O-N 3.33Å; S354-W356 VanDerWaalsContact O-N 3.14Å; W356-I358 VanDerWaalsContact C-N 3.28Å; W356-I358 PolarHBondContact O-N 2.95Å; W356-F359 PolarHBondContact O-N 2.73Å; W356-R360 WeakPolarHBondContact O-CB 3.49Å; W356-R360 PolarHBondContact O-N 2.96Å
357Y53.9Low47.4Very low99 Ų9989.6 Ų89.639%0.38842%0.423SS..Hα-helixtrans-62.3-38.9176.4176.8-88.1000111.1S354 N361S354-Y357 PolarHBondContact O-N 2.95Å; S354-Y357 WeakPolarHBondContact OG-CB 3.47Å; S354-Y357 PolarHBondContact OG-N 3.25Å; Y357-N361 VanDerWaalsContact CE1-ND2 3.32Å; Y357-N361 WeakPolarHBondContact CE1-ND2 3.5Å; Y357-N361 WeakPolarHBondContact CE2-ND2 3.03Å; Y357-N361 VanDerWaalsContact CZ-ND2 3.26Å; Y357-N361 WeakPolarHBondContact O-CB 3.39Å; Y357-N361 VanDerWaalsContact O-CG 3.32Å; Y357-N361 PolarHBondContact O-N 3.01Å; Y357-N361 PolarHBondContact O-ND2 3.21Å
358I56.3Low49Very low4 Ų488.3 Ų88.32%0.02142%0.418CS..Hα-helixtrans-65.4-55.1176.6-65.9164.1000109S354 G355 W356 R360 N361 C362 Y380S354-I358 PolarHBondContact O-N 3.47Å; S354-I358 VanDerWaalsContact O-N 3.08Å; G355-I358 PolarHBondContact O-N 3.36Å; W356-I358 VanDerWaalsContact C-N 3.28Å; W356-I358 PolarHBondContact O-N 2.95Å; I358-R360 PolarHBondContact O-N 2.81Å; I358-N361 CarbonylContact O-C 3.56Å; I358-N361 WeakPolarHBondContact O-CA 3.42Å; I358-N361 PolarHBondContact O-N 3.04Å; I358-C362 HydrophobicContact CG2-CB 3.89Å; I358-C362 WeakPolarHBondContact O-CA 3.48Å; I358-C362 WeakPolarHBondContact O-CB 3.37Å; I358-C362 PolarHBondContact O-N 3.24Å; I358-Y380 HydrophobicContact CD1-CD1 4.24Å; I358-Y380 HydrophobicContact CD1-CD2 3.53Å; I358-Y380 HydrophobicContact CD1-CE2 4.37Å; I358-Y380 HydrophobicContact CD1-CG 3.46Å; I358-Y380 VanDerWaalsContact CD1-CG 3.46Å
359F57.6Low50.5Low73 Ų7388.9 Ų88.932%0.3242%0.423SS..Hα-helixtrans-57.1-49-178.1-174.8-101.9000113.7Y77 G355 W356 N361 C362 F363Y77-F359 HydrophobicContact CD1-CB 4.39Å; Y77-F359 HydrophobicContact CE1-CB 3.85Å; Y77-F359 AromaticContact CE1-CD2 3.5Å; Y77-F359 HydrophobicContact CE1-CD2 3.5Å; Y77-F359 VanDerWaalsContact CE1-CD2 3.5Å; Y77-F359 HydrophobicContact CE1-CE2 4.25Å; Y77-F359 AromaticContact CE1-CG 3.8Å; Y77-F359 HydrophobicContact CE1-CG 3.8Å; Y77-F359 AromaticContact CZ-CD2 3.78Å; Y77-F359 VanDerWaalsContact OH-CD2 3.25Å; Y77-F359 WeakPolarHBondContact OH-CD2 3.41Å; Y77-F359 VanDerWaalsContact OH-CE2 3.24Å; Y77-F359 WeakPolarHBondContact OH-CE2 3.43Å; G355-F359 WeakPolarHBondContact O-CB 3.41Å; G355-F359 PolarHBondContact O-N 3.42Å; W356-F359 PolarHBondContact O-N 2.73Å; F359-N361 PolarHBondContact O-N 3.31Å; F359-C362 PolarHBondContact O-N 3.04Å; F359-F363 AromaticContact CE1-CE2 3.87Å; F359-F363 HydrophobicContact CE1-CE2 3.87Å; F359-F363 HydrophobicContact CE1-CZ 4.12Å; F359-F363 HydrophobicContact CE2-CZ 4.41Å; F359-F363 AromaticContact CZ-CE2 3.85Å; F359-F363 HydrophobicContact CZ-CE2 3.85Å; F359-F363 AromaticContact CZ-CZ 3.7Å; F359-F363 HydrophobicContact CZ-CZ 3.7Å
360R55.7Low51.8Low155 Ų15583.6 Ų83.659%0.58542%0.416SS*.Hα-helixtrans-53.2-33.4177.1-167-165.175.6111.59.9111.8W356 I358W356-R360 WeakPolarHBondContact O-CB 3.49Å; W356-R360 PolarHBondContact O-N 2.96Å; I358-R360 PolarHBondContact O-N 2.81Å
361N54.1Low52.9Low28 Ų2885.3 Ų85.315%0.1543%0.427CS..Hα-helixtrans-95.6-18.6177.4-59-46.7000112.3Y357 I358 F359 F363 L365 C366Y357-N361 VanDerWaalsContact CE1-ND2 3.32Å; Y357-N361 WeakPolarHBondContact CE1-ND2 3.5Å; Y357-N361 WeakPolarHBondContact CE2-ND2 3.03Å; Y357-N361 VanDerWaalsContact CZ-ND2 3.26Å; Y357-N361 WeakPolarHBondContact O-CB 3.39Å; Y357-N361 VanDerWaalsContact O-CG 3.32Å; Y357-N361 PolarHBondContact O-N 3.01Å; Y357-N361 PolarHBondContact O-ND2 3.21Å; I358-N361 CarbonylContact O-C 3.56Å; I358-N361 WeakPolarHBondContact O-CA 3.42Å; I358-N361 PolarHBondContact O-N 3.04Å; F359-N361 PolarHBondContact O-N 3.31Å; N361-F363 PolarHBondContact O-N 3.02Å; N361-L365 CarbonylContact O-C 3.4Å; N361-L365 WeakPolarHBondContact O-CB 3.12Å; N361-L365 PolarHBondContact O-N 3.49Å; N361-C366 HydrophobicContact CB-CB 3.56Å; N361-C366 WeakPolarHBondContact O-CA 3.42Å; N361-C366 VanDerWaalsContact O-CB 3.28Å; N361-C366 WeakPolarHBondContact O-CB 3.29Å; N361-C366 PolarHBondContact O-N 3.29Å
362C57.4Low54.4Low36 Ų3683.9 Ų83.924%0.24342%0.421CS..THydrogen-bonded Turntrans-95.531.7-165.8-164.80000114.1I358 F359 G364I358-C362 HydrophobicContact CG2-CB 3.89Å; I358-C362 WeakPolarHBondContact O-CA 3.48Å; I358-C362 WeakPolarHBondContact O-CB 3.37Å; I358-C362 PolarHBondContact O-N 3.24Å; F359-C362 PolarHBondContact O-N 3.04Å; C362-G364 PolarHBondContact O-N 2.84Å
363F55.9Low55.8Low151 Ų15176.4 Ų76.466%0.66239%0.387SS*.THydrogen-bonded Turntrans-77.740.3158.8-80.5-80.7000111.6F359 N361 L365F359-F363 AromaticContact CE1-CE2 3.87Å; F359-F363 HydrophobicContact CE1-CE2 3.87Å; F359-F363 HydrophobicContact CE1-CZ 4.12Å; F359-F363 HydrophobicContact CE2-CZ 4.41Å; F359-F363 AromaticContact CZ-CE2 3.85Å; F359-F363 HydrophobicContact CZ-CE2 3.85Å; F359-F363 AromaticContact CZ-CZ 3.7Å; F359-F363 HydrophobicContact CZ-CZ 3.7Å; N361-F363 PolarHBondContact O-N 3.02Å; F363-L365 PolarHBondContact O-N 3.13Å; F363-L365 VanDerWaalsContact O-N 3.16Å
364G51.2Low57Low35 Ų3581.6 Ų81.636%0.36141%0.407SS..THydrogen-bonded Turntrans76.8-20.3-165.900000114.5C362 C366 C367 F368C362-G364 PolarHBondContact O-N 2.84Å; G364-C366 PolarHBondContact O-N 3.4Å; G364-C367 WeakPolarHBondContact O-CB 3.18Å; G364-C367 PolarHBondContact O-N 3.44Å; G364-F368 WeakPolarHBondContact O-CD2 3.5Å; G364-F368 WeakPolarHBondContact O-CE2 3.28Å
365L50.1Low58Low120 Ų12084.7 Ų84.763%0.62842%0.419SS*.G310 helixtrans-68.4-31.2-174.8-71.4161.6000115.3N361 F363 C367 F368N361-L365 CarbonylContact O-C 3.4Å; N361-L365 WeakPolarHBondContact O-CB 3.12Å; N361-L365 PolarHBondContact O-N 3.49Å; F363-L365 PolarHBondContact O-N 3.13Å; F363-L365 VanDerWaalsContact O-N 3.16Å; L365-C367 VanDerWaalsContact C-N 3.27Å; L365-C367 PolarHBondContact O-N 3.43Å; L365-F368 WeakPolarHBondContact O-CB 3.14Å; L365-F368 PolarHBondContact O-N 3.3Å
366C52.6Low58.7Low13 Ų1388.2 Ų88.29%0.08843%0.432CS..G310 helixtrans-70.3-29.2-179.8-161.20000111.1N361 G364 F368 K369 G373N361-C366 HydrophobicContact CB-CB 3.56Å; N361-C366 WeakPolarHBondContact O-CA 3.42Å; N361-C366 VanDerWaalsContact O-CB 3.28Å; N361-C366 WeakPolarHBondContact O-CB 3.29Å; N361-C366 PolarHBondContact O-N 3.29Å; G364-C366 PolarHBondContact O-N 3.4Å; C366-F368 PolarHBondContact O-N 3.13Å; C366-K369 PolarHBondContact O-N 3.01Å; C366-G373 WeakPolarHBondContact O-CA 3.38Å
367C54.5Low59.9Low62 Ų6280.7 Ų80.742%0.41941%0.406SS..G310 helixtrans-62.8-21.5172.1-63.10000112G364 L365G364-C367 WeakPolarHBondContact O-CB 3.18Å; G364-C367 PolarHBondContact O-N 3.44Å; L365-C367 VanDerWaalsContact C-N 3.27Å; L365-C367 PolarHBondContact O-N 3.43Å
368F54.9Low61.2Low166 Ų16680.3 Ų80.373%0.72841%0.411SS*.G310 helixtrans-87.72.4-179.7-69.2-84.5000115.3G364 L365 C366 P370G364-F368 WeakPolarHBondContact O-CD2 3.5Å; G364-F368 WeakPolarHBondContact O-CE2 3.28Å; L365-F368 WeakPolarHBondContact O-CB 3.14Å; L365-F368 PolarHBondContact O-N 3.3Å; C366-F368 PolarHBondContact O-N 3.13Å; F368-P370 WeakPolarHBondContact O-CD 3.44Å
369K58.2Low62.3Low159 Ų15982.6 Ų82.669%0.69142%0.423SS*.SBendtrans-103.271.8163.3-149.9173.2-173.2177.20110.2C366 S372 G373C366-K369 PolarHBondContact O-N 3.01Å; K369-S372 PolarHBondContact O-N 3.29Å; K369-G373 PolarHBondContact O-N 3.18Å
370P50.3Low63.4Low99 Ų9980.3 Ų80.364%0.64341%0.412SS*.THydrogen-bonded Turntrans-66.8144.6179.428.6-33.7000110.2F368F368-P370 WeakPolarHBondContact O-CD 3.44Å
371P55.6Low64.8Low116 Ų11677.2 Ų77.275%0.75340%0.401SS*.THydrogen-bonded Turncis-94.4-11.3-2.532.5-31000114.8G373P371-G373 PolarHBondContact O-N 3.03Å
372S69.4Low66.4Low60 Ų6079 Ų7942%0.4242%0.415SS..Hα-helixtrans-72.1-31.9-166.9670000115.7K369 R376K369-S372 PolarHBondContact O-N 3.29Å; S372-R376 WeakPolarHBondContact O-CD 3.38Å; S372-R376 VanDerWaalsContact O-CG 3.3Å; S372-R376 WeakPolarHBondContact O-CG 3.25Å; S372-R376 PolarHBondContact O-N 3.2Å
373G69.7Low67.7Low3 Ų381.5 Ų81.53%0.03142%0.422CS..Hα-helixtrans-73.4-43.6-175.600000113.5C366 K369 P371 Q375 R376 C377C366-G373 WeakPolarHBondContact O-CA 3.38Å; K369-G373 PolarHBondContact O-N 3.18Å; P371-G373 PolarHBondContact O-N 3.03Å; G373-Q375 PolarHBondContact O-N 2.84Å; G373-R376 PolarHBondContact O-N 3.45Å; G373-C377 PolarHBondContact O-N 3.47Å; G373-C377 VanDerWaalsContact O-N 3.07Å
374K73.3Confident69.4Low131 Ų13175 Ų7557%0.5739%0.393SS*.Hα-helixtrans-59.3-45.9176.5-174.8178.5178.5-178.80111.4R376 C377 L378K374-R376 PolarHBondContact O-N 3.01Å; K374-C377 PolarHBondContact O-N 2.99Å; K374-L378 HydrophobicContact CG-CD1 4.1Å; K374-L378 WeakPolarHBondContact O-CG 3.26Å; K374-L378 PolarHBondContact O-N 3.47Å
375Q77.1Confident71.2Confident90 Ų9077.2 Ų77.242%0.42140%0.403SS..Hα-helixtrans-62.1-44.8179.1-170.360.938.200112G373 C377 L378 D379G373-Q375 PolarHBondContact O-N 2.84Å; Q375-C377 VanDerWaalsContact C-N 3.31Å; Q375-C377 PolarHBondContact O-N 3.03Å; Q375-L378 PolarHBondContact O-N 3.41Å; Q375-D379 PolarHBondContact NE2-OD1 2.97Å; Q375-D379 WeakPolarHBondContact O-CB 3.29Å; Q375-D379 VanDerWaalsContact O-CG 3.23Å; Q375-D379 PolarHBondContact O-N 3.26Å
376R72.4Confident73.2Confident75 Ų7575.3 Ų75.328%0.28339%0.393SS..Hα-helixtrans-61.6-38.8177.9-73.1169.9175.2-1675.9112.9T353 S372 G373 K374 Y380T353-R376 HydrophobicContact CG2-CB 4.44Å; T353-R376 HydrophobicContact CG2-CG 3.99Å; S372-R376 WeakPolarHBondContact O-CD 3.38Å; S372-R376 VanDerWaalsContact O-CG 3.3Å; S372-R376 WeakPolarHBondContact O-CG 3.25Å; S372-R376 PolarHBondContact O-N 3.2Å; G373-R376 PolarHBondContact O-N 3.45Å; K374-R376 PolarHBondContact O-N 3.01Å; R376-Y380 PolarHBondContact O-N 3.26Å; R376-Y380 VanDerWaalsContact O-N 3.1Å
377C78.3Confident75.1Confident19 Ų1974.7 Ų74.713%0.12839%0.389CS..Hα-helixtrans-65.5-46.6176.7-172.70000110.9G373 K374 Q375 Y380 W381G373-C377 PolarHBondContact O-N 3.47Å; G373-C377 VanDerWaalsContact O-N 3.07Å; K374-C377 PolarHBondContact O-N 2.99Å; Q375-C377 VanDerWaalsContact C-N 3.31Å; Q375-C377 PolarHBondContact O-N 3.03Å; C377-Y380 PolarHBondContact O-N 2.9Å; C377-W381 VanDerWaalsContact O-CD1 3.31Å; C377-W381 PolarHBondContact O-N 3.43Å
378L81.2Confident77Confident92 Ų9274.1 Ų74.148%0.48238%0.381SS..Hα-helixtrans-60.1-45.2175.1-71.9171.1000111.7K374 Q375 Y380 S382K374-L378 HydrophobicContact CG-CD1 4.1Å; K374-L378 WeakPolarHBondContact O-CG 3.26Å; K374-L378 PolarHBondContact O-N 3.47Å; Q375-L378 PolarHBondContact O-N 3.41Å; L378-Y380 VanDerWaalsContact C-N 3.34Å; L378-Y380 PolarHBondContact O-N 3.19Å; L378-S382 WeakPolarHBondContact O-CA 3.49Å; L378-S382 WeakPolarHBondContact O-CB 3.29Å; L378-S382 PolarHBondContact O-N 2.71Å; L378-S382 PolarHBondContact O-OG 3.34Å
379D78.9Confident78.9Confident51 Ų5174.7 Ų74.727%0.27338%0.383SS..Hα-helixtrans-61.5-41.7178.9-70.6-4.4000112.2Y348 Q375 S382Y348-D379 PolarHBondContact OH-OD2 2.92Å; Q375-D379 PolarHBondContact NE2-OD1 2.97Å; Q375-D379 WeakPolarHBondContact O-CB 3.29Å; Q375-D379 VanDerWaalsContact O-CG 3.23Å; Q375-D379 PolarHBondContact O-N 3.26Å; D379-S382 PolarHBondContact O-OG 3.4Å
380Y80.9Confident80.7Confident25 Ų2570 Ų7010%0.09836%0.364CS..Hα-helixtrans-67.2-57.1177.4-177.8-93.3000111.6F76 I358 R376 C377 L378 S382 K383 Y384F76-Y380 PolarHBondContact O-OH 3.32Å; I358-Y380 HydrophobicContact CD1-CD1 4.24Å; I358-Y380 HydrophobicContact CD1-CD2 3.53Å; I358-Y380 HydrophobicContact CD1-CE2 4.37Å; I358-Y380 HydrophobicContact CD1-CG 3.46Å; I358-Y380 VanDerWaalsContact CD1-CG 3.46Å; R376-Y380 PolarHBondContact O-N 3.26Å; R376-Y380 VanDerWaalsContact O-N 3.1Å; C377-Y380 PolarHBondContact O-N 2.9Å; L378-Y380 VanDerWaalsContact C-N 3.34Å; L378-Y380 PolarHBondContact O-N 3.19Å; Y380-S382 PolarHBondContact O-N 3.05Å; Y380-K383 PolarHBondContact O-N 2.91Å; Y380-Y384 HydrophobicContact CD1-CD2 4.3Å; Y380-Y384 HydrophobicContact CD1-CE2 4.2Å; Y380-Y384 HydrophobicContact CD2-CE2 4.48Å; Y380-Y384 HydrophobicContact CE1-CD2 4.04Å; Y380-Y384 AromaticContact CE1-CE2 3.63Å; Y380-Y384 HydrophobicContact CE1-CE2 3.63Å; Y380-Y384 AromaticContact CE2-CE2 3.98Å; Y380-Y384 HydrophobicContact CE2-CE2 3.98Å; Y380-Y384 AromaticContact CZ-CE2 3.51Å; Y380-Y384 WeakPolarHBondContact O-CD2 3.43Å; Y380-Y384 PolarHBondContact OH-OH 2.96Å
381W85.3Confident82.9Confident91 Ų9165.3 Ų65.335%0.34533%0.333SS..Hα-helixtrans-73-25.6-173.9-71.4112.5000113.6F76 C377 K383 Y384 S385F76-W381 HydrophobicContact CD1-CZ3 4.39Å; C377-W381 VanDerWaalsContact O-CD1 3.31Å; C377-W381 PolarHBondContact O-N 3.43Å; W381-K383 VanDerWaalsContact C-N 3.27Å; W381-K383 PolarHBondContact O-N 3.35Å; W381-Y384 HydrophobicContact CE3-CD2 4.49Å; W381-Y384 HydrophobicContact CE3-CG 4.37Å; W381-Y384 PolarHBondContact O-N 3.13Å; W381-Y384 VanDerWaalsContact O-N 3.15Å; W381-S385 WeakPolarHBondContact O-CB 3.37Å; W381-S385 PolarHBondContact O-N 3.11Å
382S86.4Confident84.9Confident65 Ų6560.8 Ų60.846%0.45531%0.308SS..Hα-helixtrans-60-37.8175.660.20000111.8L378 D379 Y380 Y384 S385 L386L378-S382 WeakPolarHBondContact O-CA 3.49Å; L378-S382 WeakPolarHBondContact O-CB 3.29Å; L378-S382 PolarHBondContact O-N 2.71Å; L378-S382 PolarHBondContact O-OG 3.34Å; D379-S382 PolarHBondContact O-OG 3.4Å; Y380-S382 PolarHBondContact O-N 3.05Å; S382-Y384 PolarHBondContact O-N 3.48Å; S382-S385 PolarHBondContact O-N 2.91Å; S382-L386 WeakPolarHBondContact O-CB 3.34Å; S382-L386 PolarHBondContact O-N 3.49Å
383K86.6Confident86.2Confident89 Ų8961.2 Ų61.239%0.38731%0.311SS..Hα-helixtrans-60.6-45.5174-177.5-177.8178.3-178.90111.9Y380 W381 T387 R528 L531Y380-K383 PolarHBondContact O-N 2.91Å; W381-K383 VanDerWaalsContact C-N 3.27Å; W381-K383 PolarHBondContact O-N 3.35Å; K383-T387 WeakPolarHBondContact O-CB 3.21Å; K383-T387 PolarHBondContact O-N 3.35Å; K383-T387 PolarHBondContact O-OG1 3.16Å; K383-R528 HydrophobicContact CG-CG 4.24Å; K383-L531 HydrophobicContact CG-CD2 4.23Å
384Y90.3Very high87.6Confident13 Ų1361.3 Ų61.35%0.05131%0.31CS..Hα-helixtrans-66.6-47.2179-75.9-94.7000111.3T75 F76 Q78 Y380 W381 S382 T387 M388 L531 F535T75-Y384 VanDerWaalsContact O-CE1 3.29Å; T75-Y384 WeakPolarHBondContact O-CE1 3.41Å; T75-Y384 PolarHBondContact O-OH 3.35Å; F76-Y384 HydrophobicContact CD1-CD1 4.06Å; F76-Y384 HydrophobicContact CD1-CE1 4.4Å; F76-Y384 PolarHBondContact O-OH 2.91Å; Q78-Y384 PolarHBondContact N-OH 3.14Å; Y380-Y384 HydrophobicContact CD1-CD2 4.3Å; Y380-Y384 HydrophobicContact CD1-CE2 4.2Å; Y380-Y384 HydrophobicContact CD2-CE2 4.48Å; Y380-Y384 HydrophobicContact CE1-CD2 4.04Å; Y380-Y384 AromaticContact CE1-CE2 3.63Å; Y380-Y384 HydrophobicContact CE1-CE2 3.63Å; Y380-Y384 AromaticContact CE2-CE2 3.98Å; Y380-Y384 HydrophobicContact CE2-CE2 3.98Å; Y380-Y384 AromaticContact CZ-CE2 3.51Å; Y380-Y384 WeakPolarHBondContact O-CD2 3.43Å; Y380-Y384 PolarHBondContact OH-OH 2.96Å; W381-Y384 HydrophobicContact CE3-CD2 4.49Å; W381-Y384 HydrophobicContact CE3-CG 4.37Å; W381-Y384 PolarHBondContact O-N 3.13Å; W381-Y384 VanDerWaalsContact O-N 3.15Å; S382-Y384 PolarHBondContact O-N 3.48Å; Y384-T387 PolarHBondContact O-N 3.49Å; Y384-M388 WeakPolarHBondContact O-CB 3.35Å; Y384-M388 WeakPolarHBondContact O-CG 3.46Å; Y384-M388 PolarHBondContact O-N 3.3Å; Y384-L531 HydrophobicContact CD1-CD1 3.96Å; Y384-L531 HydrophobicContact CD1-CD2 4.03Å; Y384-L531 HydrophobicContact CE1-CD1 3.5Å; Y384-L531 HydrophobicContact CE1-CD2 4.1Å; Y384-L531 HydrophobicContact CE1-CG 4.45Å; Y384-L531 HydrophobicContact CG-CD2 4.29Å; Y384-F535 HydrophobicContact CD1-CE1 4.39Å; Y384-F535 AromaticContact CD1-CZ 3.72Å; Y384-F535 HydrophobicContact CD1-CZ 3.72Å; Y384-F535 HydrophobicContact CE1-CZ 4.5Å
385S89.7Confident88.8Confident82 Ų8255 Ų5557%0.57328%0.283SS*.Hα-helixtrans-61.4-45.9178.5-178.90000112.1W381 S382 T387 M388 K389W381-S385 WeakPolarHBondContact O-CB 3.37Å; W381-S385 PolarHBondContact O-N 3.11Å; S382-S385 PolarHBondContact O-N 2.91Å; S385-T387 PolarHBondContact O-N 3.16Å; S385-M388 PolarHBondContact O-N 3.03Å; S385-K389 WeakPolarHBondContact O-CB 3.49Å; S385-K389 PolarHBondContact O-N 3.35Å
386L91.3Very high89.8Confident80 Ų8053 Ų5342%0.41928%0.281SS..Hα-helixtrans-64-43.2177.7-175.965.5000111.8S382 K389 E390S382-L386 WeakPolarHBondContact O-CB 3.34Å; S382-L386 PolarHBondContact O-N 3.49Å; L386-K389 PolarHBondContact O-N 2.99Å; L386-E390 WeakPolarHBondContact O-CG 3.45Å; L386-E390 PolarHBondContact O-N 3.37Å; L386-E390 VanDerWaalsContact O-N 3.16Å
387T92.6Very high91.1Very high0 Ų050 Ų500%027%0.271CS..Hα-helixtrans-63-47.5176.9-52.70000110.7K383 Y384 S385 K389 E390 C391 R528 L531 A532 F535K383-T387 WeakPolarHBondContact O-CB 3.21Å; K383-T387 PolarHBondContact O-N 3.35Å; K383-T387 PolarHBondContact O-OG1 3.16Å; Y384-T387 PolarHBondContact O-N 3.49Å; S385-T387 PolarHBondContact O-N 3.16Å; T387-K389 VanDerWaalsContact C-N 3.31Å; T387-K389 PolarHBondContact O-N 2.95Å; T387-E390 PolarHBondContact O-N 3.42Å; T387-C391 PolarHBondContact O-N 3.06Å; T387-C391 PolarHBondContact O-SG 2.95Å; T387-R528 HydrophobicContact CG2-CB 4.31Å; T387-R528 WeakPolarHBondContact OG1-CD 3.44Å; T387-R528 PolarHBondContact OG1-NH1 3.41Å; T387-L531 HydrophobicContact CG2-CB 4.36Å; T387-L531 HydrophobicContact CG2-CD2 4.18Å; T387-L531 HydrophobicContact CG2-CG 4.05Å; T387-A532 HydrophobicContact CG2-CB 3.87Å; T387-F535 HydrophobicContact CG2-CD2 3.83Å; T387-F535 HydrophobicContact CG2-CE2 3.76Å
388M95.3Very high92Very high51 Ų5149.1 Ų49.125%0.25127%0.265SS..Hα-helixtrans-60.4-37.5175.3-78.5-55.8-57.100112.9Y384 S385 E390 G392 F535 F539Y384-M388 WeakPolarHBondContact O-CB 3.35Å; Y384-M388 WeakPolarHBondContact O-CG 3.46Å; Y384-M388 PolarHBondContact O-N 3.3Å; S385-M388 PolarHBondContact O-N 3.03Å; M388-E390 VanDerWaalsContact C-N 3.29Å; M388-E390 PolarHBondContact O-N 3.49Å; M388-G392 WeakPolarHBondContact O-CA 3.32Å; M388-G392 PolarHBondContact O-N 3.46Å; M388-F535 HydrophobicContact CG-CD1 4.47Å; M388-F535 HydrophobicContact CG-CD2 4.21Å; M388-F535 HydrophobicContact CG-CE1 3.93Å; M388-F535 HydrophobicContact CG-CE2 3.61Å; M388-F535 HydrophobicContact CG-CZ 3.43Å; M388-F535 VanDerWaalsContact CG-CZ 3.43Å; M388-F535 HydrophobicContact SD-CB 4.2Å; M388-F535 HydrophobicContact SD-CD1 3.46Å; M388-F535 WeakPolarHBondContact SD-CD1 3.2Å; M388-F535 HydrophobicContact SD-CD2 3.54Å; M388-F535 VanDerWaalsContact SD-CD2 3.54Å; M388-F535 HydrophobicContact SD-CE1 3.51Å; M388-F535 VanDerWaalsContact SD-CE1 3.51Å; M388-F535 HydrophobicContact SD-CE2 3.56Å; M388-F535 VanDerWaalsContact SD-CE2 3.56Å; M388-F535 HydrophobicContact SD-CG 3.49Å; M388-F535 WeakPolarHBondContact SD-CG 3.09Å; M388-F535 HydrophobicContact SD-CZ 3.53Å; M388-F535 VanDerWaalsContact SD-CZ 3.53Å; M388-F539 HydrophobicContact CE-CE2 3.6Å; M388-F539 HydrophobicContact CE-CZ 3.68Å; M388-F539 HydrophobicContact SD-CE2 4.19Å
389K94.9Very high92.9Very high178 Ų17848.8 Ų48.877%0.77426%0.257SS*.Hα-helixtrans-63.1-36.6177.1-175.7179177.9-179.20112S385 L386 T387S385-K389 WeakPolarHBondContact O-CB 3.49Å; S385-K389 PolarHBondContact O-N 3.35Å; L386-K389 PolarHBondContact O-N 2.99Å; T387-K389 VanDerWaalsContact C-N 3.31Å; T387-K389 PolarHBondContact O-N 2.95Å
390E95.1Very high93.8Very high61 Ų6147.2 Ų47.229%0.28525%0.25SS..Hα-helixtrans-83-47-178.5-73.2170.7-178.600112.9L386 T387 M388 C523 C524 R528L386-E390 WeakPolarHBondContact O-CG 3.45Å; L386-E390 PolarHBondContact O-N 3.37Å; L386-E390 VanDerWaalsContact O-N 3.16Å; T387-E390 PolarHBondContact O-N 3.42Å; M388-E390 VanDerWaalsContact C-N 3.29Å; M388-E390 PolarHBondContact O-N 3.49Å; E390-C523 WeakPolarHBondContact O-CB 3.32Å; E390-C524 VanDerWaalsContact OE2-CA 3.32Å; E390-C524 WeakPolarHBondContact OE2-CA 3.32Å; E390-C524 PolarHBondContact OE2-SG 3.37Å; E390-R528 VanDerWaalsContact CD-NH1 3.32Å; E390-R528 IonicContact OE1-CZ 2.69Å; E390-R528 IonicContact OE1-NH1 2.78Å; E390-R528 PolarHBondContact OE1-NH1 2.91Å; E390-R528 IonicContact OE1-NH2 2.78Å; E390-R528 PolarHBondContact OE1-NH2 2.89Å; E390-R528 IonicContact OE2-CZ 3.49Å; E390-R528 IonicContact OE2-NH1 2.66Å; E390-R528 PolarHBondContact OE2-NH1 3.21Å; E390-R528 IonicContact OE2-NH2 2.88Å; E390-R528 PolarHBondContact OE2-NH2 3.2Å
391C96.6Very high94.7Very high0 Ų046 Ų460%025%0.246CC..Hα-helixtrans-93.6-3.2-177.173.60000113.9T387 S393 Q394 C395 A520 C523 A532T387-C391 PolarHBondContact O-N 3.06Å; T387-C391 PolarHBondContact O-SG 2.95Å; C391-S393 VanDerWaalsContact C-N 3.3Å; C391-S393 PolarHBondContact O-N 3.33Å; C391-Q394 PolarHBondContact O-N 3.15Å; C391-C395 PolarHBondContact O-N 2.84Å; C391-C395 PolarHBondContact O-SG 3.37Å; C391-C395 VanDerWaalsContact SG-SG 3.64Å; C391-A520 HydrophobicContact CB-CB 4.22Å; C391-A520 VanDerWaalsContact CB-O 3.29Å; C391-A520 WeakPolarHBondContact CB-O 3.3Å; C391-C523 HydrophobicContact CB-CB 4.36Å; C391-A532 HydrophobicContact CB-CB 4.14Å
392G97.2Very high95.3Very high21 Ų2142.6 Ų42.622%0.21623%0.233CC..Hα-helixtrans-59.7-36-172.700000114.1M388 Q394 C395 A396M388-G392 WeakPolarHBondContact O-CA 3.32Å; M388-G392 PolarHBondContact O-N 3.46Å; G392-Q394 VanDerWaalsContact C-N 3.33Å; G392-Q394 PolarHBondContact O-N 2.88Å; G392-C395 PolarHBondContact O-N 3.49Å; G392-A396 WeakPolarHBondContact O-CB 3.31Å; G392-A396 PolarHBondContact O-N 3.02Å
393S97.7Very high95.9Very high69 Ų6941.9 Ų41.948%0.48322%0.222SC..Hα-helixtrans-60.5-42.5174.258.20000111.9C391 A396 N397C391-S393 VanDerWaalsContact C-N 3.3Å; C391-S393 PolarHBondContact O-N 3.33Å; S393-A396 PolarHBondContact O-N 3.13Å; S393-N397 VanDerWaalsContact O-CG 3.26Å; S393-N397 PolarHBondContact O-N 2.89Å; S393-N397 PolarHBondContact O-ND2 2.71Å
394Q98.4Very high96.4Very high4 Ų437.7 Ų37.72%0.01920%0.203CC..Hα-helixtrans-73.1-36.4177.3-52.6-49.3-46.100111.5C391 G392 A396 N397 I398 P458 A520C391-Q394 PolarHBondContact O-N 3.15Å; G392-Q394 VanDerWaalsContact C-N 3.33Å; G392-Q394 PolarHBondContact O-N 2.88Å; Q394-A396 VanDerWaalsContact C-N 3.33Å; Q394-A396 PolarHBondContact O-N 2.98Å; Q394-N397 WeakPolarHBondContact O-CB 3.23Å; Q394-N397 PolarHBondContact O-N 3.42Å; Q394-N397 PolarHBondContact OE1-ND2 3.46Å; Q394-I398 WeakPolarHBondContact O-CD1 3.4Å; Q394-I398 WeakPolarHBondContact O-CG1 3.44Å; Q394-I398 PolarHBondContact O-N 3.39Å; Q394-P458 PolarHBondContact NE2-O 2.89Å; Q394-A520 HydrophobicContact CB-CB 3.76Å
395C98.6Very high96.8Very high0 Ų037.1 Ų37.10%020%0.201CC..Hα-helixtrans-60.7-42.2173.4-64.30000111.7C391 G392 I398 W399 F539C391-C395 PolarHBondContact O-N 2.84Å; C391-C395 PolarHBondContact O-SG 3.37Å; C391-C395 VanDerWaalsContact SG-SG 3.64Å; G392-C395 PolarHBondContact O-N 3.49Å; C395-I398 PolarHBondContact O-N 3.3Å; C395-W399 WeakPolarHBondContact O-CB 3.35Å; C395-W399 PolarHBondContact O-N 3.36Å; C395-F539 HydrophobicContact CB-CB 4.19Å; C395-F539 HydrophobicContact CB-CD1 3.94Å; C395-F539 HydrophobicContact CB-CD2 3.67Å; C395-F539 HydrophobicContact CB-CE1 4.24Å; C395-F539 HydrophobicContact CB-CE2 3.98Å; C395-F539 HydrophobicContact CB-CG 3.66Å; C395-F539 HydrophobicContact CB-CZ 4.26Å; C395-F539 WeakPolarHBondContact O-CB 3.42Å; C395-F539 WeakPolarHBondContact O-CD1 3.3Å
396A98.6Very high97.2Very high47 Ų4734.5 Ų34.539%0.38818%0.181SC..Hα-helixtrans-64-41.1173.900000111.9G392 S393 Q394 W399 C400G392-A396 WeakPolarHBondContact O-CB 3.31Å; G392-A396 PolarHBondContact O-N 3.02Å; S393-A396 PolarHBondContact O-N 3.13Å; Q394-A396 VanDerWaalsContact C-N 3.33Å; Q394-A396 PolarHBondContact O-N 2.98Å; A396-W399 PolarHBondContact O-N 3.27Å; A396-C400 VanDerWaalsContact O-CB 3.26Å; A396-C400 WeakPolarHBondContact O-CB 3.46Å; A396-C400 PolarHBondContact O-N 2.8Å
397N98.7Very high97.5Very high12 Ų1230.8 Ų30.86%0.06416%0.161CC..Hα-helixtrans-60.2-47.9174.6-70-28.8000111.6S393 Q394 C400 V401 L461 W462 V465S393-N397 VanDerWaalsContact O-CG 3.26Å; S393-N397 PolarHBondContact O-N 2.89Å; S393-N397 PolarHBondContact O-ND2 2.71Å; Q394-N397 WeakPolarHBondContact O-CB 3.23Å; Q394-N397 PolarHBondContact O-N 3.42Å; Q394-N397 PolarHBondContact OE1-ND2 3.46Å; N397-C400 PolarHBondContact O-N 3.14Å; N397-V401 WeakPolarHBondContact O-CG2 3.34Å; N397-V401 PolarHBondContact O-N 3.47Å; N397-L461 HydrophobicContact CB-CD2 4.16Å; N397-L461 HydrophobicContact CB-CG 4.41Å; N397-W462 WeakPolarHBondContact OD1-CA 3.38Å; N397-W462 VanDerWaalsContact OD1-CB 3.29Å; N397-W462 WeakPolarHBondContact OD1-CB 3.45Å; N397-V465 HydrophobicContact CB-CG1 4.43Å; N397-V465 HydrophobicContact CB-CG2 4.28Å
398I98.6Very high97.7Very high0 Ų030.8 Ų30.80%016%0.161CC..Hα-helixtrans-57.8-53.4177.6-65.4160.1000109.8Q394 C395 C400 V401 Y402 L517 A520 L540Q394-I398 WeakPolarHBondContact O-CD1 3.4Å; Q394-I398 WeakPolarHBondContact O-CG1 3.44Å; Q394-I398 PolarHBondContact O-N 3.39Å; C395-I398 PolarHBondContact O-N 3.3Å; I398-C400 VanDerWaalsContact C-N 3.3Å; I398-C400 PolarHBondContact O-N 2.76Å; I398-V401 PolarHBondContact O-N 3Å; I398-Y402 HydrophobicContact CG2-CD2 3.9Å; I398-Y402 HydrophobicContact CG2-CE2 4Å; I398-Y402 VanDerWaalsContact O-CD2 3.29Å; I398-Y402 WeakPolarHBondContact O-CD2 3.45Å; I398-Y402 PolarHBondContact O-N 2.99Å; I398-Y402 VanDerWaalsContact O-N 3.13Å; I398-L517 HydrophobicContact CD1-CD2 3.82Å; I398-L517 HydrophobicContact CD1-CG 3.81Å; I398-L517 HydrophobicContact CG1-CG 4.09Å; I398-L517 HydrophobicContact CG2-CG 4.44Å; I398-A520 HydrophobicContact CD1-CB 4.39Å; I398-L540 HydrophobicContact CG2-CB 3.81Å
399W98.7Very high97.8Very high86 Ų8629.4 Ų29.433%0.32615%0.154SC..Hα-helixtrans-54.6-46.9178.1166.781.2000111.9C395 A396 V401 Y402 F403 F539 G543 T546C395-W399 WeakPolarHBondContact O-CB 3.35Å; C395-W399 PolarHBondContact O-N 3.36Å; A396-W399 PolarHBondContact O-N 3.27Å; W399-V401 PolarHBondContact O-N 3.35Å; W399-Y402 PolarHBondContact O-N 3.27Å; W399-F403 HydrophobicContact CH2-CG 4.49Å; W399-F403 HydrophobicContact CZ2-CB 4.31Å; W399-F403 HydrophobicContact CZ2-CD2 4.12Å; W399-F403 HydrophobicContact CZ2-CG 4.11Å; W399-F403 WeakPolarHBondContact O-CB 3.23Å; W399-F403 PolarHBondContact O-N 2.94Å; W399-F539 WeakPolarHBondContact CA-O 3.29Å; W399-F539 HydrophobicContact CB-CB 4.26Å; W399-F539 HydrophobicContact CB-CD1 3.88Å; W399-G543 VanDerWaalsContact CD1-CA 3.41Å; W399-T546 PolarHBondContact NE1-OG1 3.37Å
400C98.7Very high97.7Very high18 Ų1823.2 Ų23.212%0.12213%0.132CC..Hα-helixtrans-65.4-39.8-177.5-173.70000112.4A396 N397 I398 F403 C404 V465 T469A396-C400 VanDerWaalsContact O-CB 3.26Å; A396-C400 WeakPolarHBondContact O-CB 3.46Å; A396-C400 PolarHBondContact O-N 2.8Å; N397-C400 PolarHBondContact O-N 3.14Å; I398-C400 VanDerWaalsContact C-N 3.3Å; I398-C400 PolarHBondContact O-N 2.76Å; C400-F403 PolarHBondContact O-N 3.04Å; C400-C404 VanDerWaalsContact O-CB 3.24Å; C400-C404 WeakPolarHBondContact O-CB 3.49Å; C400-C404 PolarHBondContact O-N 3.48Å; C400-V465 HydrophobicContact CB-CG1 3.63Å; C400-T469 PolarHBondContact SG-OG1 2.89Å; C400-T469 VanDerWaalsContact SG-OG1 3.37Å
401V98.7Very high97.6Very high0 Ų021.5 Ų21.50%013%0.128CC..Hα-helixtrans-60.4-49.4175.11740000111N397 I398 W399 T405 V465 N509 L512 A513N397-V401 WeakPolarHBondContact O-CG2 3.34Å; N397-V401 PolarHBondContact O-N 3.47Å; I398-V401 PolarHBondContact O-N 3Å; W399-V401 PolarHBondContact O-N 3.35Å; V401-T405 WeakPolarHBondContact O-CB 3.26Å; V401-T405 PolarHBondContact O-N 3.13Å; V401-T405 PolarHBondContact O-OG1 2.72Å; V401-V465 HydrophobicContact CG2-CB 4.32Å; V401-V465 HydrophobicContact CG2-CG1 3.84Å; V401-V465 HydrophobicContact CG2-CG2 3.66Å; V401-N509 WeakPolarHBondContact CG1-OD1 3.23Å; V401-L512 HydrophobicContact CG2-CB 3.84Å; V401-A513 HydrophobicContact CG1-CB 3.92Å
402Y98.4Very high97.5Very high19 Ų1921.5 Ų21.58%0.07513%0.128CC..Hα-helixtrans-70.6-37.2179.7-76.4-78.8000112.1I398 W399 T405 L406 A513 L540 V544I398-Y402 HydrophobicContact CG2-CD2 3.9Å; I398-Y402 HydrophobicContact CG2-CE2 4Å; I398-Y402 VanDerWaalsContact O-CD2 3.29Å; I398-Y402 WeakPolarHBondContact O-CD2 3.45Å; I398-Y402 PolarHBondContact O-N 2.99Å; I398-Y402 VanDerWaalsContact O-N 3.13Å; W399-Y402 PolarHBondContact O-N 3.27Å; Y402-T405 PolarHBondContact O-N 3.33Å; Y402-L406 HydrophobicContact CD1-CD2 4.05Å; Y402-L406 WeakPolarHBondContact O-CB 3.3Å; Y402-L406 WeakPolarHBondContact O-CD2 3.3Å; Y402-L406 PolarHBondContact O-N 3.17Å; Y402-A513 HydrophobicContact CE2-CB 3.74Å; Y402-L540 HydrophobicContact CD1-CG 4.16Å; Y402-L540 HydrophobicContact CD2-CB 3.98Å; Y402-L540 HydrophobicContact CD2-CD1 4.29Å; Y402-L540 HydrophobicContact CD2-CG 3.65Å; Y402-L540 HydrophobicContact CE1-CD1 4.08Å; Y402-L540 HydrophobicContact CE1-CD2 4.44Å; Y402-L540 HydrophobicContact CE1-CG 3.9Å; Y402-L540 HydrophobicContact CE2-CB 3.93Å; Y402-L540 HydrophobicContact CE2-CD1 3.5Å; Y402-L540 VanDerWaalsContact CE2-CD1 3.5Å; Y402-L540 HydrophobicContact CE2-CG 3.38Å; Y402-L540 HydrophobicContact CG-CG 4.05Å; Y402-L540 VanDerWaalsContact OH-CD1 3.28Å; Y402-L540 WeakPolarHBondContact OH-CD1 3.46Å; Y402-V544 HydrophobicContact CD1-CG2 3.91Å; Y402-V544 HydrophobicContact CG-CG2 4.35Å
403F98.6Very high97.5Very high50 Ų5020.5 Ų20.522%0.21912%0.118CC..Hα-helixtrans-58.6-54.5173.7171.4-96.3000111.4W399 C400 T405 L406 S407 G543 A550W399-F403 HydrophobicContact CH2-CG 4.49Å; W399-F403 HydrophobicContact CZ2-CB 4.31Å; W399-F403 HydrophobicContact CZ2-CD2 4.12Å; W399-F403 HydrophobicContact CZ2-CG 4.11Å; W399-F403 WeakPolarHBondContact O-CB 3.23Å; W399-F403 PolarHBondContact O-N 2.94Å; C400-F403 PolarHBondContact O-N 3.04Å; F403-T405 VanDerWaalsContact C-N 3.27Å; F403-T405 PolarHBondContact O-N 3.3Å; F403-L406 PolarHBondContact O-N 3.41Å; F403-S407 VanDerWaalsContact O-CB 3.28Å; F403-S407 WeakPolarHBondContact O-CB 3.18Å; F403-S407 PolarHBondContact O-N 2.85Å; F403-S407 PolarHBondContact O-OG 2.97Å; F403-G543 WeakPolarHBondContact CA-O 3.33Å; F403-G543 PolarHBondContact N-O 3.17Å; F403-A550 HydrophobicContact CE2-CB 3.65Å; F403-A550 HydrophobicContact CZ-CB 3.86Å
404C98.6Very high97.4Very high0 Ų018.7 Ų18.70%011%0.105CC..Hα-helixtrans-55.8-46.3177167.20000110.9C400 T469C400-C404 VanDerWaalsContact O-CB 3.24Å; C400-C404 WeakPolarHBondContact O-CB 3.49Å; C400-C404 PolarHBondContact O-N 3.48Å; C404-T469 HydrophobicContact CB-CG2 4.24Å; C404-T469 WeakPolarHBondContact CB-OG1 3.04Å
405T98.4Very high97.2Very high2 Ų222.8 Ų22.81%0.01212%0.12CC..Hα-helixtrans-63.1-53.2-177.8-62.30000111.9V401 Y402 F403 S407 V408 F409 F439 R468 F505 N509V401-T405 WeakPolarHBondContact O-CB 3.26Å; V401-T405 PolarHBondContact O-N 3.13Å; V401-T405 PolarHBondContact O-OG1 2.72Å; Y402-T405 PolarHBondContact O-N 3.33Å; F403-T405 VanDerWaalsContact C-N 3.27Å; F403-T405 PolarHBondContact O-N 3.3Å; T405-S407 VanDerWaalsContact C-N 3.31Å; T405-S407 PolarHBondContact O-N 2.9Å; T405-V408 PolarHBondContact O-N 3.44Å; T405-F409 WeakPolarHBondContact O-CB 3.34Å; T405-F409 PolarHBondContact O-N 2.92Å; T405-F439 HydrophobicContact CG2-CE1 4.35Å; T405-F439 HydrophobicContact CG2-CE2 3.67Å; T405-F439 HydrophobicContact CG2-CZ 3.29Å; T405-R468 PolarHBondContact OG1-NH2 3.36Å; T405-F505 HydrophobicContact CG2-CE1 4.45Å; T405-F505 HydrophobicContact CG2-CZ 4.33Å; T405-N509 HydrophobicContact CG2-CB 4.5Å; T405-N509 PolarHBondContact OG1-OD1 3.02Å
406L96.8Very high97.1Very high27 Ų2722.9 Ų22.914%0.14112%0.121CC..Hα-helixtrans-79-14.2-174.5-78.6-56.8000113.6Y402 F403 V408 F409 V544 G547 V548Y402-L406 HydrophobicContact CD1-CD2 4.05Å; Y402-L406 WeakPolarHBondContact O-CB 3.3Å; Y402-L406 WeakPolarHBondContact O-CD2 3.3Å; Y402-L406 PolarHBondContact O-N 3.17Å; F403-L406 PolarHBondContact O-N 3.41Å; L406-V408 PolarHBondContact O-N 3.39Å; L406-F409 WeakPolarHBondContact CA-O 3.29Å; L406-F409 WeakPolarHBondContact CD1-O 3.17Å; L406-V544 HydrophobicContact CD2-CG2 4.03Å; L406-V544 HydrophobicContact CG-CB 4.39Å; L406-V544 HydrophobicContact CG-CG1 4.21Å; L406-V544 HydrophobicContact CG-CG2 4.27Å; L406-G547 CarbonylContact C-O 3.33Å; L406-G547 CarbonylContact O-C 3.35Å; L406-V548 HydrophobicContact CB-CG2 4.2Å; L406-V548 HydrophobicContact CD1-CG2 4.39Å; L406-V548 HydrophobicContact CG-CG2 4.43Å
407S97.7Very high97Very high1 Ų125.8 Ų25.81%0.00712%0.122CC..Hα-helixtrans-64.2-29167.6-62.70000111.8F403 T405 G547 A550 S551F403-S407 VanDerWaalsContact O-CB 3.28Å; F403-S407 WeakPolarHBondContact O-CB 3.18Å; F403-S407 PolarHBondContact O-N 2.85Å; F403-S407 PolarHBondContact O-OG 2.97Å; T405-S407 VanDerWaalsContact C-N 3.31Å; T405-S407 PolarHBondContact O-N 2.9Å; S407-G547 VanDerWaalsContact CA-O 3.3Å; S407-G547 WeakPolarHBondContact CA-O 3.05Å; S407-G547 PolarHBondContact N-O 3.39Å; S407-A550 WeakPolarHBondContact OG-CB 3.1Å; S407-S551 VanDerWaalsContact O-CA 3.25Å; S407-S551 WeakPolarHBondContact O-CA 3.43Å; S407-S551 WeakPolarHBondContact O-CB 3.38Å
408V97.7Very high96.9Very high1 Ų126.1 Ų26.11%0.00613%0.125CC..Hα-helixtrans-112.2-52-175.9178.90000111.7T405 L406 P410 A411 V412 Q413 I473 F476 F505T405-V408 PolarHBondContact O-N 3.44Å; L406-V408 PolarHBondContact O-N 3.39Å; V408-P410 CarbonylContact O-C 3.45Å; V408-A411 PolarHBondContact O-N 3.43Å; V408-V412 HydrophobicContact CG1-CB 4.2Å; V408-V412 HydrophobicContact CG1-CG1 4.47Å; V408-V412 WeakPolarHBondContact O-CA 3.2Å; V408-V412 WeakPolarHBondContact O-CB 3.24Å; V408-V412 PolarHBondContact O-N 2.7Å; V408-Q413 HydrophobicContact CG1-CB 4.22Å; V408-Q413 PolarHBondContact O-N 3.22Å; V408-I473 HydrophobicContact CG2-CG1 4Å; V408-F476 HydrophobicContact CB-CD2 4.46Å; V408-F476 HydrophobicContact CG1-CB 3.48Å; V408-F476 VanDerWaalsContact CG1-CB 3.48Å; V408-F476 HydrophobicContact CG1-CD1 4.19Å; V408-F476 HydrophobicContact CG1-CD2 3.51Å; V408-F476 HydrophobicContact CG1-CE2 4.25Å; V408-F476 HydrophobicContact CG1-CG 3.47Å; V408-F476 VanDerWaalsContact CG1-CG 3.47Å; V408-F505 HydrophobicContact CB-CZ 4.11Å
409F96Very high96.7Very high22 Ų2229.3 Ų29.310%0.09614%0.141CC..THydrogen-bonded Turntrans-91.5133.1-178171.7-94.7000112T405 L406 C435 F436 F439 F505T405-F409 WeakPolarHBondContact O-CB 3.34Å; T405-F409 PolarHBondContact O-N 2.92Å; L406-F409 WeakPolarHBondContact CA-O 3.29Å; L406-F409 WeakPolarHBondContact CD1-O 3.17Å; F409-C435 VanDerWaalsContact CD2-SG 3.55Å; F409-C435 WeakPolarHBondContact CE2-O 3.46Å; F409-F436 HydrophobicContact CE2-CD1 4.13Å; F409-F436 HydrophobicContact CZ-CD1 4.12Å; F409-F439 HydrophobicContact CB-CD2 4.38Å; F409-F439 HydrophobicContact CB-CE2 4.32Å; F409-F439 AromaticContact CD1-CD1 3.84Å; F409-F439 HydrophobicContact CD1-CD1 3.84Å; F409-F439 HydrophobicContact CD1-CD2 4.33Å; F409-F439 AromaticContact CD1-CE1 3.79Å; F409-F439 HydrophobicContact CD1-CE1 3.79Å; F409-F439 HydrophobicContact CD1-CE2 4.29Å; F409-F439 HydrophobicContact CD1-CG 4.14Å; F409-F439 HydrophobicContact CD1-CZ 4.04Å; F409-F439 HydrophobicContact CD2-CB 4.07Å; F409-F439 HydrophobicContact CD2-CD1 4.29Å; F409-F439 HydrophobicContact CD2-CD2 4.05Å; F409-F439 AromaticContact CD2-CG 3.85Å; F409-F439 HydrophobicContact CD2-CG 3.85Å; F409-F439 AromaticContact CE1-CD1 3.54Å; F409-F439 HydrophobicContact CE1-CD1 3.54Å; F409-F439 AromaticContact CE1-CE1 3.75Å; F409-F439 HydrophobicContact CE1-CE1 3.75Å; F409-F439 HydrophobicContact CE1-CG 4.1Å; F409-F439 HydrophobicContact CE1-CZ 4.46Å; F409-F439 HydrophobicContact CE2-CB 3.78Å; F409-F439 HydrophobicContact CE2-CD1 4.04Å; F409-F439 HydrophobicContact CE2-CD2 4.49Å; F409-F439 AromaticContact CE2-CG 3.83Å; F409-F439 HydrophobicContact CE2-CG 3.83Å; F409-F439 HydrophobicContact CG-CD1 4.21Å; F409-F439 AromaticContact CG-CD2 3.98Å; F409-F439 HydrophobicContact CG-CD2 3.98Å; F409-F439 HydrophobicContact CG-CE1 4.39Å; F409-F439 HydrophobicContact CG-CE2 4.17Å; F409-F439 HydrophobicContact CG-CG 4.02Å; F409-F439 HydrophobicContact CG-CZ 4.39Å; F409-F439 HydrophobicContact CZ-CB 4.14Å; F409-F439 AromaticContact CZ-CD1 3.64Å; F409-F439 HydrophobicContact CZ-CD1 3.64Å; F409-F439 HydrophobicContact CZ-CE1 4.33Å; F409-F439 AromaticContact CZ-CG 3.95Å; F409-F439 HydrophobicContact CZ-CG 3.95Å; F409-F505 HydrophobicContact CB-CE1 3.96Å
410P94.3Very high96.5Very high47 Ų4728.8 Ų28.831%0.30515%0.145SC..THydrogen-bonded Turncis-85.2-13.6-11.933.8-34.2000112.6V408 V412 Q413 S414 F436V408-P410 CarbonylContact O-C 3.45Å; P410-V412 PolarHBondContact O-N 2.82Å; P410-Q413 PolarHBondContact O-N 3.09Å; P410-S414 WeakPolarHBondContact O-CB 3.4Å; P410-S414 PolarHBondContact O-N 3.4Å; P410-S414 PolarHBondContact O-OG 2.88Å; P410-F436 HydrophobicContact CB-CE1 3.6Å; P410-F436 HydrophobicContact CB-CZ 3.81Å; P410-F436 HydrophobicContact CG-CE1 4.14Å
411A92.6Very high96.3Very high25 Ų2532.6 Ų32.621%0.20717%0.169CC..THydrogen-bonded Turntrans-58.1-40.7-161.500000115.3V408 R415 S551 N555V408-A411 PolarHBondContact O-N 3.43Å; A411-R415 PolarHBondContact O-NH1 2.94Å; A411-S551 WeakPolarHBondContact CB-OG 3.46Å; A411-N555 PolarHBondContact O-OD1 2.9Å
412V95.5Very high96.1Very high0 Ų040.8 Ų40.80%021%0.208CC..THydrogen-bonded Turntrans-85.9-49.2174.7175.60000109.4V408 P410 S414 R415 L477 F481 L554 I558V408-V412 HydrophobicContact CG1-CB 4.2Å; V408-V412 HydrophobicContact CG1-CG1 4.47Å; V408-V412 WeakPolarHBondContact O-CA 3.2Å; V408-V412 WeakPolarHBondContact O-CB 3.24Å; V408-V412 PolarHBondContact O-N 2.7Å; P410-V412 PolarHBondContact O-N 2.82Å; V412-S414 VanDerWaalsContact C-N 3.3Å; V412-S414 PolarHBondContact O-N 2.9Å; V412-R415 WeakPolarHBondContact O-CB 3.34Å; V412-R415 PolarHBondContact O-N 3.02Å; V412-L477 HydrophobicContact CG1-CD2 4.39Å; V412-F481 HydrophobicContact CG1-CE1 3.92Å; V412-F481 HydrophobicContact CG1-CZ 3.83Å; V412-L554 HydrophobicContact CG2-CB 4.06Å; V412-I558 HydrophobicContact CG1-CD1 3.91Å
413Q96.6Very high96Very high0 Ų040.7 Ų40.70%021%0.207CC..G310 helixtrans-61.9-33.5-173.4-168.7178.7-6.200113.5V408 P410 R415 V416 T434 C435 F476 Y498 C502V408-Q413 HydrophobicContact CG1-CB 4.22Å; V408-Q413 PolarHBondContact O-N 3.22Å; P410-Q413 PolarHBondContact O-N 3.09Å; Q413-R415 PolarHBondContact O-N 2.75Å; Q413-V416 WeakPolarHBondContact O-CB 3.42Å; Q413-V416 PolarHBondContact O-N 3.4Å; Q413-T434 PolarHBondContact NE2-O 3.14Å; Q413-C435 HydrophobicContact CG-CB 4.16Å; Q413-F476 HydrophobicContact CG-CD1 4.25Å; Q413-F476 HydrophobicContact CG-CE1 3.96Å; Q413-Y498 WeakPolarHBondContact CG-OH 3.45Å; Q413-Y498 PolarHBondContact O-OH 3.44Å; Q413-C502 PolarHBondContact NE2-SG 3.25Å
414S95.4Very high95.8Very high32 Ų3244.9 Ų44.922%0.22423%0.226CC..G310 helixtrans-71.8-12.2179.473.10000113.8P410 V412 R417 V431P410-S414 WeakPolarHBondContact O-CB 3.4Å; P410-S414 PolarHBondContact O-N 3.4Å; P410-S414 PolarHBondContact O-OG 2.88Å; V412-S414 VanDerWaalsContact C-N 3.3Å; V412-S414 PolarHBondContact O-N 2.9Å; S414-R417 PolarHBondContact O-NH1 3.34Å; S414-V431 WeakPolarHBondContact O-CG2 3.27Å
415R94.6Very high95.7Very high89 Ų8945.4 Ų45.434%0.33623%0.228SC..G310 helixtrans-90.5-13175.5-67.2-179.916192.9-2.7112.8A411 V412 Q413 R417 F481 N555A411-R415 PolarHBondContact O-NH1 2.94Å; V412-R415 WeakPolarHBondContact O-CB 3.34Å; V412-R415 PolarHBondContact O-N 3.02Å; Q413-R415 PolarHBondContact O-N 2.75Å; R415-R417 PolarHBondContact O-NH1 2.97Å; R415-F481 HydrophobicContact CB-CD1 3.8Å; R415-F481 HydrophobicContact CB-CE1 4.21Å; R415-N555 WeakPolarHBondContact CD-OD1 2.9Å; R415-N555 PolarHBondContact NH1-ND2 3.37Å; R415-N555 PolarHBondContact NH1-OD1 3.36Å
416V96.3Very high95.6Very high2 Ų248.4 Ų48.41%0.01225%0.248CC..  trans-63.2141176.2-179.20000109.9Q413 F430 C479 N480 F481 Y498Q413-V416 WeakPolarHBondContact O-CB 3.42Å; Q413-V416 PolarHBondContact O-N 3.4Å; V416-F430 HydrophobicContact CG1-CE1 4.34Å; V416-C479 HydrophobicContact CG1-CB 4.02Å; V416-C479 HydrophobicContact CG2-CB 3.82Å; V416-N480 CarbonylContact C-O 3.55Å; V416-N480 VanDerWaalsContact CA-O 3.29Å; V416-N480 WeakPolarHBondContact CA-O 3.41Å; V416-N480 WeakPolarHBondContact CG1-O 3.35Å; V416-F481 HydrophobicContact CG2-CD1 4.33Å; V416-F481 HydrophobicContact CG2-CE1 3.87Å; V416-F481 HydrophobicContact CG2-CZ 4.45Å; V416-Y498 HydrophobicContact CB-CE2 3.94Å; V416-Y498 HydrophobicContact CG1-CD1 4.49Å; V416-Y498 HydrophobicContact CG1-CD2 3.99Å; V416-Y498 HydrophobicContact CG1-CE1 4.14Å; V416-Y498 HydrophobicContact CG1-CE2 3.58Å; V416-Y498 HydrophobicContact CG1-CG 4.41Å; V416-Y498 HydrophobicContact CG2-CE2 3.91Å
417R95.8Very high95.6Very high109 Ų10950.6 Ų50.641%0.41126%0.263SS..  trans-123.6144.9179.5-62-62.8175-104.34109.9S414 R415 V431 N480S414-R417 PolarHBondContact O-NH1 3.34Å; R415-R417 PolarHBondContact O-NH1 2.97Å; R417-V431 VanDerWaalsContact NH1-CG2 3.27Å; R417-N480 PolarHBondContact N-O 2.89Å; R417-N480 PolarHBondContact O-ND2 2.76Å
418P96.7Very high95.4Very high18 Ų1854.9 Ų54.912%0.11729%0.286CS..  trans-61.6143.6175.627.4-32.8000109.7P427 F430 D495P418-P427 HydrophobicContact CG-CB 4.04Å; P418-P427 HydrophobicContact CG-CG 3.97Å; P418-F430 HydrophobicContact CB-CD2 3.81Å; P418-F430 HydrophobicContact CB-CE2 3.77Å; P418-F430 HydrophobicContact CB-CG 4.22Å; P418-F430 HydrophobicContact CB-CZ 4.13Å; P418-F430 HydrophobicContact CG-CB 4.39Å; P418-F430 HydrophobicContact CG-CD1 4.49Å; P418-F430 HydrophobicContact CG-CD2 4.12Å; P418-F430 HydrophobicContact CG-CG 4.09Å; P418-D495 WeakPolarHBondContact CA-OD1 3.15Å
419I94.9Very high95.3Very high67 Ų6757.3 Ų57.334%0.34430%0.295SS..SBendtrans-82.4-45.8175.6-66.5173.9000109.6P421 N480 I492 T493 D495I419-P421 WeakPolarHBondContact O-CD 3.29Å; I419-N480 HydrophobicContact CD1-CB 3.91Å; I419-N480 HydrophobicContact CG1-CB 3.58Å; I419-N480 WeakPolarHBondContact CG1-ND2 3.4Å; I419-I492 VanDerWaalsContact CD1-O 3.25Å; I419-I492 WeakPolarHBondContact CD1-O 3.22Å; I419-T493 WeakPolarHBondContact CD1-O 3.03Å; I419-D495 PolarHBondContact N-OD1 3.08Å; I419-D495 PolarHBondContact N-OD2 2.78Å; I419-D495 VanDerWaalsContact N-OD2 3.16Å
420N95.3Very high95.4Very high75 Ų7556.3 Ų56.340%0.40129%0.291SS..SBendtrans-85.4113.9174.5-1760.1000109.7E422 Y423 D495N420-E422 PolarHBondContact O-N 2.71Å; N420-E422 WeakPolarHBondContact OD1-CB 3.26Å; N420-E422 PolarHBondContact OD1-N 3.48Å; N420-Y423 VanDerWaalsContact O-CB 3.25Å; N420-Y423 WeakPolarHBondContact O-CB 3.33Å; N420-Y423 PolarHBondContact O-N 3.09Å; N420-D495 PolarHBondContact N-OD2 2.93Å
421P92.6Very high95.5Very high98 Ų9855.4 Ų55.464%0.63628%0.284SS*.THydrogen-bonded Turntrans-63.4-22.7175.927.1-34.8000113.1I419 Y423I419-P421 WeakPolarHBondContact O-CD 3.29Å; P421-Y423 VanDerWaalsContact C-N 3.34Å
422E95Very high95.6Very high173 Ų17355.7 Ų55.781%0.80828%0.282SS*.THydrogen-bonded Turntrans-9313.5176.1-58.2-177.7178.600112.9N420N420-E422 PolarHBondContact O-N 2.71Å; N420-E422 WeakPolarHBondContact OD1-CB 3.26Å; N420-E422 PolarHBondContact OD1-N 3.48Å
423Y96.3Very high95.7Very high17 Ų1757 Ų577%0.06729%0.29CS..SBendtrans-57.8147.7174.9-167.7-116.2000111.3N420 P421 I425 F430 D495 H496 V499N420-Y423 VanDerWaalsContact O-CB 3.25Å; N420-Y423 WeakPolarHBondContact O-CB 3.33Å; N420-Y423 PolarHBondContact O-N 3.09Å; P421-Y423 VanDerWaalsContact C-N 3.34Å; Y423-I425 HydrophobicContact CD1-CB 4.03Å; Y423-I425 HydrophobicContact CD1-CG1 4.27Å; Y423-I425 HydrophobicContact CE1-CB 4.28Å; Y423-I425 HydrophobicContact CE1-CD1 4.19Å; Y423-I425 HydrophobicContact CE1-CG1 4.06Å; Y423-I425 CarbonylContact O-C 3.53Å; Y423-I425 PolarHBondContact O-N 2.91Å; Y423-F430 HydrophobicContact CD1-CD2 4.31Å; Y423-F430 AromaticContact CD1-CE2 3.99Å; Y423-F430 HydrophobicContact CD1-CE2 3.99Å; Y423-F430 HydrophobicContact CE1-CE2 4.08Å; Y423-D495 HydrophobicContact CD1-CB 4.25Å; Y423-D495 HydrophobicContact CD2-CB 3.7Å; Y423-D495 HydrophobicContact CE1-CB 4.09Å; Y423-D495 HydrophobicContact CE2-CB 3.53Å; Y423-D495 HydrophobicContact CG-CB 4.05Å; Y423-D495 PolarHBondContact OH-O 2.81Å; Y423-H496 AromaticContact CE2-CE1 3.47Å; Y423-H496 VanDerWaalsContact CE2-CE1 3.47Å; Y423-H496 WeakPolarHBondContact CE2-CE1 2.95Å; Y423-H496 AromaticContact CE2-ND1 3.67Å; Y423-H496 AromaticContact CE2-NE2 3.75Å; Y423-H496 AromaticContact CZ-ND1 3.86Å; Y423-H496 PolarHBondContact OH-ND1 3.12Å; Y423-V499 HydrophobicContact CE1-CG2 4.23Å; Y423-V499 WeakPolarHBondContact OH-CG2 3.27Å
424F95.6Very high95.8Very high138 Ų13857 Ų5761%0.60529%0.29SS*.SBendtrans-60.3-22.7-173.778.6-91.9000113.9P426F424-P426 WeakPolarHBondContact O-CD 3.4Å
425I96Very high95.9Very high11 Ų1155.4 Ų55.46%0.05628%0.279CS..SBendtrans-96.5110.8168.5-49.7178000107.6Y423 W429 F430 V433 T434Y423-I425 HydrophobicContact CD1-CB 4.03Å; Y423-I425 HydrophobicContact CD1-CG1 4.27Å; Y423-I425 HydrophobicContact CE1-CB 4.28Å; Y423-I425 HydrophobicContact CE1-CD1 4.19Å; Y423-I425 HydrophobicContact CE1-CG1 4.06Å; Y423-I425 CarbonylContact O-C 3.53Å; Y423-I425 PolarHBondContact O-N 2.91Å; I425-W429 HydrophobicContact CG2-CB 4.46Å; I425-F430 HydrophobicContact CB-CD2 4.28Å; I425-F430 HydrophobicContact CG2-CB 4.5Å; I425-F430 HydrophobicContact CG2-CD2 4.41Å; I425-V433 HydrophobicContact CD1-CG1 3.97Å; I425-V433 HydrophobicContact CG2-CB 4.2Å; I425-V433 HydrophobicContact CG2-CG1 4.5Å; I425-V433 HydrophobicContact CG2-CG2 4.34Å; I425-T434 HydrophobicContact CD1-CG2 3.8Å
426P95.9Very high96Very high65 Ų6554.2 Ų54.242%0.42228%0.276SS..  trans-60.1148.5-177.4-24.734000112.4F424 L428 W429 F430F424-P426 WeakPolarHBondContact O-CD 3.4Å; P426-L428 PolarHBondContact O-N 3.48Å; P426-W429 PolarHBondContact O-N 2.7Å; P426-F430 PolarHBondContact O-N 2.83Å
427P96Very high96Very high72 Ų7256 Ų5647%0.46829%0.286SS..Hα-helixtrans-52.2-33.5179.7-28.334.3000114.2P418 W429 F430P418-P427 HydrophobicContact CG-CB 4.04Å; P418-P427 HydrophobicContact CG-CG 3.97Å; P427-W429 VanDerWaalsContact C-N 3.26Å; P427-W429 PolarHBondContact O-N 2.88Å; P427-F430 PolarHBondContact O-N 3.21Å
428L94.3Very high96.1Very high92 Ų9252.7 Ų52.748%0.48227%0.274SS..Hα-helixtrans-58.7-34.7176.9-179.561.2000113.4K175 L179 P426K175-L428 PolarHBondContact NZ-O 3.46Å; L179-L428 HydrophobicContact CD1-CD2 3.82Å; P426-L428 PolarHBondContact O-N 3.48Å
429W96.1Very high96.2Very high52 Ų5252.3 Ų52.320%0.19727%0.271CS..Hα-helixtrans-110.4-7.5-174.5-60.2107.9000113.2I172 K175 L179 I425 P426 P427 V431 D432 V433I172-W429 HydrophobicContact CG2-CZ3 4.17Å; K175-W429 HydrophobicContact CB-CH2 4Å; K175-W429 HydrophobicContact CB-CZ3 3.86Å; K175-W429 HydrophobicContact CD-CE3 4.12Å; K175-W429 HydrophobicContact CD-CH2 4.03Å; K175-W429 HydrophobicContact CD-CZ3 3.54Å; K175-W429 HydrophobicContact CG-CH2 3.66Å; K175-W429 HydrophobicContact CG-CZ3 3.64Å; L179-W429 HydrophobicContact CD1-CH2 3.92Å; L179-W429 HydrophobicContact CD1-CZ2 3.61Å; I425-W429 HydrophobicContact CG2-CB 4.46Å; P426-W429 PolarHBondContact O-N 2.7Å; P427-W429 VanDerWaalsContact C-N 3.26Å; P427-W429 PolarHBondContact O-N 2.88Å; W429-V431 VanDerWaalsContact C-N 3.33Å; W429-V431 PolarHBondContact O-N 3.4Å; W429-D432 PolarHBondContact O-N 3.15Å; W429-V433 HydrophobicContact CB-CG2 4.27Å; W429-V433 WeakPolarHBondContact O-CB 3.25Å; W429-V433 WeakPolarHBondContact O-CG2 3.2Å; W429-V433 PolarHBondContact O-N 2.96Å
430F97.5Very high96.2Very high1 Ų150.1 Ų50.10%0.00426%0.26CS..Hα-helixtrans-52.2-50.4-172.3-171.8-96.2000112V416 P418 Y423 I425 P426 P427 T434 Y498V416-F430 HydrophobicContact CG1-CE1 4.34Å; P418-F430 HydrophobicContact CB-CD2 3.81Å; P418-F430 HydrophobicContact CB-CE2 3.77Å; P418-F430 HydrophobicContact CB-CG 4.22Å; P418-F430 HydrophobicContact CB-CZ 4.13Å; P418-F430 HydrophobicContact CG-CB 4.39Å; P418-F430 HydrophobicContact CG-CD1 4.49Å; P418-F430 HydrophobicContact CG-CD2 4.12Å; P418-F430 HydrophobicContact CG-CG 4.09Å; Y423-F430 HydrophobicContact CD1-CD2 4.31Å; Y423-F430 AromaticContact CD1-CE2 3.99Å; Y423-F430 HydrophobicContact CD1-CE2 3.99Å; Y423-F430 HydrophobicContact CE1-CE2 4.08Å; I425-F430 HydrophobicContact CB-CD2 4.28Å; I425-F430 HydrophobicContact CG2-CB 4.5Å; I425-F430 HydrophobicContact CG2-CD2 4.41Å; P426-F430 PolarHBondContact O-N 2.83Å; P427-F430 PolarHBondContact O-N 3.21Å; F430-T434 HydrophobicContact CD2-CG2 4.31Å; F430-T434 HydrophobicContact CE2-CG2 4.21Å; F430-T434 HydrophobicContact CZ-CG2 4.39Å; F430-T434 WeakPolarHBondContact O-CB 3.45Å; F430-T434 WeakPolarHBondContact O-CG2 3.45Å; F430-T434 PolarHBondContact O-N 3.28Å; F430-T434 PolarHBondContact O-OG1 3.34Å; F430-Y498 AromaticContact CE1-CD1 3.98Å; F430-Y498 HydrophobicContact CE1-CD1 3.98Å; F430-Y498 AromaticContact CE1-CE1 3.48Å; F430-Y498 HydrophobicContact CE1-CE1 3.48Å; F430-Y498 VanDerWaalsContact CE1-CE1 3.48Å; F430-Y498 AromaticContact CZ-CD1 3.54Å; F430-Y498 HydrophobicContact CZ-CD1 3.54Å; F430-Y498 AromaticContact CZ-CE1 3.52Å; F430-Y498 HydrophobicContact CZ-CE1 3.52Å
431V96.4Very high96.4Very high27 Ų2748.8 Ų48.816%0.16425%0.254CS..Hα-helixtrans-68.5-45.2-179.3176.20000112S414 R417 W429 V433 C435 F436S414-V431 WeakPolarHBondContact O-CG2 3.27Å; R417-V431 VanDerWaalsContact NH1-CG2 3.27Å; W429-V431 VanDerWaalsContact C-N 3.33Å; W429-V431 PolarHBondContact O-N 3.4Å; V431-V433 VanDerWaalsContact C-N 3.26Å; V431-V433 PolarHBondContact O-N 3.41Å; V431-C435 HydrophobicContact CG1-CB 4.11Å; V431-C435 WeakPolarHBondContact O-CA 3.17Å; V431-C435 WeakPolarHBondContact O-CB 3.47Å; V431-C435 PolarHBondContact O-N 3.26Å; V431-F436 HydrophobicContact CG1-CD2 4.24Å; V431-F436 HydrophobicContact CG1-CE2 3.84Å; V431-F436 PolarHBondContact O-N 3.46Å
432D95.9Very high96.6Very high32 Ų3246.4 Ų46.417%0.17123%0.234CC..Iπ-helixtrans-59.2-40.8-179.6-57.8-61000111.6I172 K175 W429 F436 L437I172-D432 HydrophobicContact CD1-CB 4.47Å; I172-D432 HydrophobicContact CG1-CB 4.02Å; K175-D432 IonicContact NZ-OD2 3.22Å; K175-D432 PolarHBondContact NZ-OD2 3.21Å; W429-D432 PolarHBondContact O-N 3.15Å; D432-F436 PolarHBondContact O-N 3Å; D432-L437 PolarHBondContact O-N 3.38Å
433V97.3Very high96.8Very high26 Ų2638.1 Ų38.116%0.15820%0.195CC..Iπ-helixtrans-78-56.2-179.1176.40000111.5I172 I425 W429 V431 L437 F438I172-V433 HydrophobicContact CD1-CG2 4.48Å; I425-V433 HydrophobicContact CD1-CG1 3.97Å; I425-V433 HydrophobicContact CG2-CB 4.2Å; I425-V433 HydrophobicContact CG2-CG1 4.5Å; I425-V433 HydrophobicContact CG2-CG2 4.34Å; W429-V433 HydrophobicContact CB-CG2 4.27Å; W429-V433 WeakPolarHBondContact O-CB 3.25Å; W429-V433 WeakPolarHBondContact O-CG2 3.2Å; W429-V433 PolarHBondContact O-N 2.96Å; V431-V433 VanDerWaalsContact C-N 3.26Å; V431-V433 PolarHBondContact O-N 3.41Å; V433-L437 WeakPolarHBondContact O-CB 3.45Å; V433-L437 PolarHBondContact O-N 2.94Å; V433-F438 HydrophobicContact CG1-CD1 3.95Å; V433-F438 HydrophobicContact CG1-CE1 3.49Å; V433-F438 VanDerWaalsContact CG1-CE1 3.49Å; V433-F438 HydrophobicContact CG1-CE2 4.43Å; V433-F438 HydrophobicContact CG1-CZ 3.77Å; V433-F438 WeakPolarHBondContact O-CB 3.2Å; V433-F438 WeakPolarHBondContact O-CD1 3.41Å; V433-F438 VanDerWaalsContact O-CG 3.31Å; V433-F438 WeakPolarHBondContact O-CG 3.33Å; V433-F438 PolarHBondContact O-N 3.16Å
434T97.5Very high96.8Very high0 Ų039.4 Ų39.40%020%0.202CC..Iπ-helixtrans-79.6-33.4-169.562.80000113.8Q413 I425 F430 Y498 V499Q413-T434 PolarHBondContact NE2-O 3.14Å; I425-T434 HydrophobicContact CD1-CG2 3.8Å; F430-T434 HydrophobicContact CD2-CG2 4.31Å; F430-T434 HydrophobicContact CE2-CG2 4.21Å; F430-T434 HydrophobicContact CZ-CG2 4.39Å; F430-T434 WeakPolarHBondContact O-CB 3.45Å; F430-T434 WeakPolarHBondContact O-CG2 3.45Å; F430-T434 PolarHBondContact O-N 3.28Å; F430-T434 PolarHBondContact O-OG1 3.34Å; T434-Y498 HydrophobicContact CG2-CE1 4.4Å; T434-V499 HydrophobicContact CG2-CG2 3.93Å
435C97.5Very high96.9Very high0 Ų036.6 Ų36.60%019%0.193CC..Iπ-helixtrans-85.5-60.7177.7-172.40000109.6F409 Q413 V431 F439F409-C435 VanDerWaalsContact CD2-SG 3.55Å; F409-C435 WeakPolarHBondContact CE2-O 3.46Å; Q413-C435 HydrophobicContact CG-CB 4.16Å; V431-C435 HydrophobicContact CG1-CB 4.11Å; V431-C435 WeakPolarHBondContact O-CA 3.17Å; V431-C435 WeakPolarHBondContact O-CB 3.47Å; V431-C435 PolarHBondContact O-N 3.26Å; C435-F439 WeakPolarHBondContact O-CB 3.41Å; C435-F439 PolarHBondContact O-N 2.9Å
436F96.5Very high97Very high64 Ų6436.1 Ų36.128%0.28119%0.191SC..Iπ-helixtrans-85.8-56.2-168.8-61.8-80.3000113.7S168 F409 P410 V431 D432 N440S168-F436 PolarHBondContact OG-O 3.21Å; F409-F436 HydrophobicContact CE2-CD1 4.13Å; F409-F436 HydrophobicContact CZ-CD1 4.12Å; P410-F436 HydrophobicContact CB-CE1 3.6Å; P410-F436 HydrophobicContact CB-CZ 3.81Å; P410-F436 HydrophobicContact CG-CE1 4.14Å; V431-F436 HydrophobicContact CG1-CD2 4.24Å; V431-F436 HydrophobicContact CG1-CE2 3.84Å; V431-F436 PolarHBondContact O-N 3.46Å; D432-F436 PolarHBondContact O-N 3Å; F436-N440 PolarHBondContact O-N 3.28Å; F436-N440 VanDerWaalsContact O-N 3.14Å; F436-N440 PolarHBondContact O-ND2 3.13Å
437L97.2Very high97Very high39 Ų3933 Ų3320%0.20417%0.171CC..Iπ-helixtrans-64-52.7-176179.666.1000111.6I172 D432 V433 F439 N440 V441I172-L437 HydrophobicContact CD1-CB 4.06Å; I172-L437 HydrophobicContact CD1-CD2 3.88Å; I172-L437 HydrophobicContact CD1-CG 4.41Å; D432-L437 PolarHBondContact O-N 3.38Å; V433-L437 WeakPolarHBondContact O-CB 3.45Å; V433-L437 PolarHBondContact O-N 2.94Å; L437-F439 PolarHBondContact O-N 2.96Å; L437-N440 PolarHBondContact O-N 3.28Å; L437-V441 HydrophobicContact CD1-CG2 3.91Å; L437-V441 HydrophobicContact CG-CG2 4.37Å; L437-V441 WeakPolarHBondContact O-CB 3.11Å; L437-V441 VanDerWaalsContact O-CG2 3.31Å; L437-V441 WeakPolarHBondContact O-CG2 3.34Å; L437-V441 PolarHBondContact O-N 2.91Å
438F97.8Very high96.9Very high40 Ų4031.9 Ų31.918%0.17516%0.16CC..Hα-helixtrans-61-46.1-179.2-79.212.9000110.8V433 N440 V441 F442 V499 I503V433-F438 HydrophobicContact CG1-CD1 3.95Å; V433-F438 HydrophobicContact CG1-CE1 3.49Å; V433-F438 VanDerWaalsContact CG1-CE1 3.49Å; V433-F438 HydrophobicContact CG1-CE2 4.43Å; V433-F438 HydrophobicContact CG1-CZ 3.77Å; V433-F438 WeakPolarHBondContact O-CB 3.2Å; V433-F438 WeakPolarHBondContact O-CD1 3.41Å; V433-F438 VanDerWaalsContact O-CG 3.31Å; V433-F438 WeakPolarHBondContact O-CG 3.33Å; V433-F438 PolarHBondContact O-N 3.16Å; F438-N440 VanDerWaalsContact C-N 3.34Å; F438-N440 PolarHBondContact O-N 3.34Å; F438-V441 PolarHBondContact O-N 2.75Å; F438-F442 HydrophobicContact CB-CD2 4Å; F438-F442 HydrophobicContact CB-CE2 4.27Å; F438-F442 HydrophobicContact CD1-CE2 4.25Å; F438-F442 HydrophobicContact CD2-CE2 4.35Å; F438-F442 HydrophobicContact CG-CD2 4.29Å; F438-F442 HydrophobicContact CG-CE2 4.04Å; F438-F442 VanDerWaalsContact O-CB 3.3Å; F438-F442 WeakPolarHBondContact O-CB 3.21Å; F438-F442 VanDerWaalsContact O-CD2 3.23Å; F438-F442 WeakPolarHBondContact O-CD2 3.24Å; F438-F442 PolarHBondContact O-N 2.71Å; F438-V499 HydrophobicContact CD2-CG1 4.29Å; F438-V499 HydrophobicContact CE2-CG1 3.78Å; F438-I503 HydrophobicContact CD2-CG1 4.25Å
439F98.3Very high96.9Very high10 Ų1030.8 Ų30.84%0.04416%0.155CC..Hα-helixtrans-56.6-49.7179.4-175.6-87.7000112T405 F409 C435 L437 A443 F505 A506 N509T405-F439 HydrophobicContact CG2-CE1 4.35Å; T405-F439 HydrophobicContact CG2-CE2 3.67Å; T405-F439 HydrophobicContact CG2-CZ 3.29Å; F409-F439 HydrophobicContact CB-CD2 4.38Å; F409-F439 HydrophobicContact CB-CE2 4.32Å; F409-F439 AromaticContact CD1-CD1 3.84Å; F409-F439 HydrophobicContact CD1-CD1 3.84Å; F409-F439 HydrophobicContact CD1-CD2 4.33Å; F409-F439 AromaticContact CD1-CE1 3.79Å; F409-F439 HydrophobicContact CD1-CE1 3.79Å; F409-F439 HydrophobicContact CD1-CE2 4.29Å; F409-F439 HydrophobicContact CD1-CG 4.14Å; F409-F439 HydrophobicContact CD1-CZ 4.04Å; F409-F439 HydrophobicContact CD2-CB 4.07Å; F409-F439 HydrophobicContact CD2-CD1 4.29Å; F409-F439 HydrophobicContact CD2-CD2 4.05Å; F409-F439 AromaticContact CD2-CG 3.85Å; F409-F439 HydrophobicContact CD2-CG 3.85Å; F409-F439 AromaticContact CE1-CD1 3.54Å; F409-F439 HydrophobicContact CE1-CD1 3.54Å; F409-F439 AromaticContact CE1-CE1 3.75Å; F409-F439 HydrophobicContact CE1-CE1 3.75Å; F409-F439 HydrophobicContact CE1-CG 4.1Å; F409-F439 HydrophobicContact CE1-CZ 4.46Å; F409-F439 HydrophobicContact CE2-CB 3.78Å; F409-F439 HydrophobicContact CE2-CD1 4.04Å; F409-F439 HydrophobicContact CE2-CD2 4.49Å; F409-F439 AromaticContact CE2-CG 3.83Å; F409-F439 HydrophobicContact CE2-CG 3.83Å; F409-F439 HydrophobicContact CG-CD1 4.21Å; F409-F439 AromaticContact CG-CD2 3.98Å; F409-F439 HydrophobicContact CG-CD2 3.98Å; F409-F439 HydrophobicContact CG-CE1 4.39Å; F409-F439 HydrophobicContact CG-CE2 4.17Å; F409-F439 HydrophobicContact CG-CG 4.02Å; F409-F439 HydrophobicContact CG-CZ 4.39Å; F409-F439 HydrophobicContact CZ-CB 4.14Å; F409-F439 AromaticContact CZ-CD1 3.64Å; F409-F439 HydrophobicContact CZ-CD1 3.64Å; F409-F439 HydrophobicContact CZ-CE1 4.33Å; F409-F439 AromaticContact CZ-CG 3.95Å; F409-F439 HydrophobicContact CZ-CG 3.95Å; C435-F439 WeakPolarHBondContact O-CB 3.41Å; C435-F439 PolarHBondContact O-N 2.9Å; L437-F439 PolarHBondContact O-N 2.96Å; F439-A443 HydrophobicContact CE1-CB 4.42Å; F439-A443 WeakPolarHBondContact O-CB 3.36Å; F439-A443 PolarHBondContact O-N 2.77Å; F439-F505 HydrophobicContact CD2-CD1 4.03Å; F439-F505 HydrophobicContact CD2-CE1 4.27Å; F439-F505 AromaticContact CE2-CD1 3.86Å; F439-F505 HydrophobicContact CE2-CD1 3.86Å; F439-F505 AromaticContact CE2-CE1 3.87Å; F439-F505 HydrophobicContact CE2-CE1 3.87Å; F439-A506 HydrophobicContact CB-CB 4.48Å; F439-A506 HydrophobicContact CD2-CB 3.93Å; F439-A506 HydrophobicContact CE2-CB 4.4Å; F439-A506 HydrophobicContact CG-CB 4.35Å; F439-N509 HydrophobicContact CE2-CB 4.38Å; F439-N509 HydrophobicContact CZ-CB 4.18Å; F439-N509 WeakPolarHBondContact CZ-ND2 3.33Å
440N96.2Very high96.7Very high20 Ų2028.3 Ų28.311%0.10715%0.145CC..Hα-helixtrans-70.3-40.5-176.9-72.4-68.5000113.2G164 A165 S168 F436 L437 F438 M444G164-N440 VanDerWaalsContact C-CB 3.49Å; G164-N440 WeakPolarHBondContact CA-OD1 3.36Å; G164-N440 PolarHBondContact O-ND2 3.41Å; A165-N440 HydrophobicContact CB-CB 3.98Å; S168-N440 PolarHBondContact OG-ND2 3.07Å; F436-N440 PolarHBondContact O-N 3.28Å; F436-N440 VanDerWaalsContact O-N 3.14Å; F436-N440 PolarHBondContact O-ND2 3.13Å; L437-N440 PolarHBondContact O-N 3.28Å; F438-N440 VanDerWaalsContact C-N 3.34Å; F438-N440 PolarHBondContact O-N 3.34Å; N440-M444 WeakPolarHBondContact O-CB 3.47Å; N440-M444 PolarHBondContact O-N 3Å
441V98.1Very high96.4Very high47 Ų4730.5 Ų30.529%0.28516%0.157SC..Hα-helixtrans-66.1-501781710000111A165 L437 F438 M444 L445A165-V441 HydrophobicContact CB-CG2 4.17Å; L437-V441 HydrophobicContact CD1-CG2 3.91Å; L437-V441 HydrophobicContact CG-CG2 4.37Å; L437-V441 WeakPolarHBondContact O-CB 3.11Å; L437-V441 VanDerWaalsContact O-CG2 3.31Å; L437-V441 WeakPolarHBondContact O-CG2 3.34Å; L437-V441 PolarHBondContact O-N 2.91Å; F438-V441 PolarHBondContact O-N 2.75Å; V441-M444 WeakPolarHBondContact O-CB 3.42Å; V441-M444 PolarHBondContact O-N 2.9Å; V441-L445 HydrophobicContact CG1-CD1 4.22Å; V441-L445 WeakPolarHBondContact O-CG 3.24Å; V441-L445 PolarHBondContact O-N 3.41Å
442F98.4Very high96Very high48 Ų4838.7 Ų38.721%0.21119%0.185CC..Hα-helixtrans-73.1-31.1-177.8-74.3-71000112.5F438 L445 G446 I503 A506 L507F438-F442 HydrophobicContact CB-CD2 4Å; F438-F442 HydrophobicContact CB-CE2 4.27Å; F438-F442 HydrophobicContact CD1-CE2 4.25Å; F438-F442 HydrophobicContact CD2-CE2 4.35Å; F438-F442 HydrophobicContact CG-CD2 4.29Å; F438-F442 HydrophobicContact CG-CE2 4.04Å; F438-F442 VanDerWaalsContact O-CB 3.3Å; F438-F442 WeakPolarHBondContact O-CB 3.21Å; F438-F442 VanDerWaalsContact O-CD2 3.23Å; F438-F442 WeakPolarHBondContact O-CD2 3.24Å; F438-F442 PolarHBondContact O-N 2.71Å; F442-L445 HydrophobicContact CD1-CD1 3.86Å; F442-L445 HydrophobicContact CE1-CD1 4.13Å; F442-L445 PolarHBondContact O-N 2.96Å; F442-G446 PolarHBondContact O-N 2.59Å; F442-I503 HydrophobicContact CD1-CG2 3.76Å; F442-I503 HydrophobicContact CD2-CB 4.38Å; F442-I503 HydrophobicContact CD2-CG1 3.86Å; F442-I503 HydrophobicContact CD2-CG2 4.24Å; F442-I503 HydrophobicContact CE1-CG2 3.8Å; F442-I503 HydrophobicContact CE2-CB 4.47Å; F442-I503 HydrophobicContact CE2-CD1 3.99Å; F442-I503 HydrophobicContact CE2-CG1 3.61Å; F442-I503 HydrophobicContact CE2-CG2 4.31Å; F442-I503 HydrophobicContact CG-CG1 4.46Å; F442-I503 HydrophobicContact CG-CG2 3.99Å; F442-I503 HydrophobicContact CZ-CD1 3.97Å; F442-I503 HydrophobicContact CZ-CG1 3.97Å; F442-I503 HydrophobicContact CZ-CG2 4.09Å; F442-A506 HydrophobicContact CB-CB 3.63Å; F442-L507 HydrophobicContact CB-CD2 4.45Å; F442-L507 HydrophobicContact CB-CG 4.14Å; F442-L507 HydrophobicContact CD1-CD1 4.45Å; F442-L507 HydrophobicContact CD1-CD2 4.25Å; F442-L507 HydrophobicContact CD1-CG 4.15Å; F442-L507 WeakPolarHBondContact O-CD2 3.47Å
443A98.1Very high95.9Very high0 Ų041.4 Ų41.40%020%0.199CC..Hα-helixtrans-63.8-41.6168.700000111.6N161 F439 G446 C447 A506 G510N161-A443 PolarHBondContact ND2-O 3.46Å; F439-A443 HydrophobicContact CE1-CB 4.42Å; F439-A443 WeakPolarHBondContact O-CB 3.36Å; F439-A443 PolarHBondContact O-N 2.77Å; A443-G446 PolarHBondContact O-N 3.47Å; A443-C447 PolarHBondContact O-N 3.5Å; A443-C447 PolarHBondContact O-SG 3.3Å; A443-A506 VanDerWaalsContact CA-O 3.27Å; A443-A506 WeakPolarHBondContact CA-O 3.3Å; A443-G510 WeakPolarHBondContact O-CA 3.37Å
444M96.9Very high95.7Very high43 Ų4344 Ų4421%0.21221%0.209CC..Hα-helixtrans-61.4-45.2174.1-174.7-179.965.500111.7V158 N161 A162 N440 V441 G446 C447 I448V158-M444 HydrophobicContact CG1-CG 4.11Å; N161-M444 HydrophobicContact CB-CB 3.82Å; N161-M444 HydrophobicContact CB-CG 4.45Å; A162-M444 HydrophobicContact CB-SD 3.66Å; N440-M444 WeakPolarHBondContact O-CB 3.47Å; N440-M444 PolarHBondContact O-N 3Å; V441-M444 WeakPolarHBondContact O-CB 3.42Å; V441-M444 PolarHBondContact O-N 2.9Å; M444-G446 VanDerWaalsContact C-N 3.32Å; M444-G446 PolarHBondContact O-N 3.45Å; M444-C447 WeakPolarHBondContact O-CB 3.36Å; M444-C447 PolarHBondContact O-N 3.27Å; M444-I448 HydrophobicContact CG-CD1 4.03Å; M444-I448 WeakPolarHBondContact O-CG1 3.28Å; M444-I448 PolarHBondContact O-N 3.18Å
445L97.1Very high95.6Very high79 Ų7951.3 Ų51.341%0.41424%0.241SC..Hα-helixtrans-60.4-41175.6-69.4173.8000111.9V441 F442 C447 I448 L449 L507V441-L445 HydrophobicContact CG1-CD1 4.22Å; V441-L445 WeakPolarHBondContact O-CG 3.24Å; V441-L445 PolarHBondContact O-N 3.41Å; F442-L445 HydrophobicContact CD1-CD1 3.86Å; F442-L445 HydrophobicContact CE1-CD1 4.13Å; F442-L445 PolarHBondContact O-N 2.96Å; L445-C447 VanDerWaalsContact C-N 3.33Å; L445-C447 PolarHBondContact O-N 3.46Å; L445-I448 PolarHBondContact O-N 3.01Å; L445-L449 WeakPolarHBondContact O-CB 3.35Å; L445-L449 PolarHBondContact O-N 3.48Å; L445-L507 HydrophobicContact CB-CD2 4.16Å
446G97.8Very high95.5Very high1 Ų151.9 Ų51.91%0.0125%0.245CC..Hα-helixtrans-59.5-40.7174.600000113F442 A443 M444 C450 H511F442-G446 PolarHBondContact O-N 2.59Å; A443-G446 PolarHBondContact O-N 3.47Å; M444-G446 VanDerWaalsContact C-N 3.32Å; M444-G446 PolarHBondContact O-N 3.45Å; G446-C450 PolarHBondContact O-N 2.62Å; G446-H511 WeakPolarHBondContact O-CA 3.24Å; G446-H511 PolarHBondContact O-ND1 2.88Å
447C96Very high95.4Very high0 Ų050 Ų500%024%0.244CC..Hα-helixtrans-66.6-45.6174.1-630000112.2N154 I157 V158 N161 A443 M444 L445 L449 C450 G510 S514N154-C447 PolarHBondContact ND2-O 3.36Å; N154-C447 PolarHBondContact OD1-O 3.08Å; I157-C447 VanDerWaalsContact CG2-SG 3.57Å; V158-C447 HydrophobicContact CB-CB 4.44Å; V158-C447 HydrophobicContact CG2-CB 3.55Å; N161-C447 PolarHBondContact ND2-SG 2.97Å; A443-C447 PolarHBondContact O-N 3.5Å; A443-C447 PolarHBondContact O-SG 3.3Å; M444-C447 WeakPolarHBondContact O-CB 3.36Å; M444-C447 PolarHBondContact O-N 3.27Å; L445-C447 VanDerWaalsContact C-N 3.33Å; L445-C447 PolarHBondContact O-N 3.46Å; C447-L449 VanDerWaalsContact C-N 3.25Å; C447-L449 PolarHBondContact O-N 3.47Å; C447-C450 WeakPolarHBondContact O-CB 3.42Å; C447-C450 PolarHBondContact O-N 3.44Å; C447-C450 VanDerWaalsContact O-N 3.13Å; C447-G510 VanDerWaalsContact SG-CA 3.51Å; C447-G510 PolarHBondContact SG-O 2.97Å; C447-S514 PolarHBondContact SG-OG 3.23Å
448I94.6Very high95.3Very high49 Ų4950 Ų5025%0.25125%0.246SC..Hα-helixtrans-60.6-40.8179.7-68.7168.7000110V158 M444 L445 C450 N451 W452V158-I448 HydrophobicContact CG1-CD1 4.23Å; V158-I448 HydrophobicContact CG1-CG1 3.77Å; V158-I448 HydrophobicContact CG2-CG1 4.23Å; M444-I448 HydrophobicContact CG-CD1 4.03Å; M444-I448 WeakPolarHBondContact O-CG1 3.28Å; M444-I448 PolarHBondContact O-N 3.18Å; L445-I448 PolarHBondContact O-N 3.01Å; I448-C450 PolarHBondContact O-N 3.27Å; I448-N451 WeakPolarHBondContact O-CB 3.38Å; I448-N451 PolarHBondContact O-N 3.04Å; I448-N451 PolarHBondContact O-ND2 3.24Å; I448-W452 HydrophobicContact CG2-CE3 4.45Å; I448-W452 HydrophobicContact CG2-CH2 3.69Å; I448-W452 HydrophobicContact CG2-CZ3 3.52Å
449L93.9Very high95.1Very high69 Ų6957.2 Ų57.236%0.36127%0.272SS..Hα-helixtrans-56-35.8176.6-173.462.5000112.7L445 C447 N451 W452 I453L445-L449 WeakPolarHBondContact O-CB 3.35Å; L445-L449 PolarHBondContact O-N 3.48Å; C447-L449 VanDerWaalsContact C-N 3.25Å; C447-L449 PolarHBondContact O-N 3.47Å; L449-N451 PolarHBondContact O-N 2.96Å; L449-N451 VanDerWaalsContact O-N 3.13Å; L449-W452 PolarHBondContact O-N 3.33Å; L449-I453 HydrophobicContact CD1-CB 4.4Å; L449-I453 HydrophobicContact CD1-CD1 3.78Å; L449-I453 HydrophobicContact CD1-CG1 4.08Å; L449-I453 HydrophobicContact CG-CB 4.36Å; L449-I453 HydrophobicContact CG-CD1 4.46Å; L449-I453 PolarHBondContact O-N 2.88Å
450C92.8Very high95.1Very high0 Ų062.9 Ų62.90%029%0.294CS..THydrogen-bonded Turntrans-61.4-19.5177.1-670000114.4G446 C447 I448 W452 I453 Q454 H511 L515 M518G446-C450 PolarHBondContact O-N 2.62Å; C447-C450 WeakPolarHBondContact O-CB 3.42Å; C447-C450 PolarHBondContact O-N 3.44Å; C447-C450 VanDerWaalsContact O-N 3.13Å; I448-C450 PolarHBondContact O-N 3.27Å; C450-W452 PolarHBondContact O-N 3.38Å; C450-I453 WeakPolarHBondContact CA-O 3.25Å; C450-Q454 VanDerWaalsContact O-CG 3.24Å; C450-Q454 WeakPolarHBondContact O-CG 3.43Å; C450-H511 PolarHBondContact SG-CE1 2.9Å; C450-H511 PolarHBondContact SG-ND1 3.48Å; C450-H511 PolarHBondContact SG-O 3.37Å; C450-L515 HydrophobicContact CB-CD2 4.38Å; C450-M518 HydrophobicContact CB-SD 4.13Å
451N89.2Confident95.2Very high47 Ų4762 Ų6225%0.25129%0.289SS..THydrogen-bonded Turntrans-69.7-24.7175.6-65.2-43.6000112.2N154 I448 L449N154-N451 VanDerWaalsContact ND2-CG 3.3Å; N154-N451 PolarHBondContact ND2-ND2 2.94Å; N154-N451 PolarHBondContact ND2-OD1 2.95Å; I448-N451 WeakPolarHBondContact O-CB 3.38Å; I448-N451 PolarHBondContact O-N 3.04Å; I448-N451 PolarHBondContact O-ND2 3.24Å; L449-N451 PolarHBondContact O-N 2.96Å; L449-N451 VanDerWaalsContact O-N 3.13Å
452W89.4Confident95.2Very high198 Ų19866.5 Ų66.575%0.7530%0.302SS*.THydrogen-bonded Turntrans-111.6-34.8-179.6-56.8-60.7000112.7I448 L449 C450I448-W452 HydrophobicContact CG2-CE3 4.45Å; I448-W452 HydrophobicContact CG2-CH2 3.69Å; I448-W452 HydrophobicContact CG2-CZ3 3.52Å; L449-W452 PolarHBondContact O-N 3.33Å; C450-W452 PolarHBondContact O-N 3.38Å
453I92.8Very high95.2Very high89 Ų8967.6 Ų67.646%0.45631%0.309SS..  trans-121.3103.8-176.6-54.3-173.4000109.3L449 C450 F455 H511L449-I453 HydrophobicContact CD1-CB 4.4Å; L449-I453 HydrophobicContact CD1-CD1 3.78Å; L449-I453 HydrophobicContact CD1-CG1 4.08Å; L449-I453 HydrophobicContact CG-CB 4.36Å; L449-I453 HydrophobicContact CG-CD1 4.46Å; L449-I453 PolarHBondContact O-N 2.88Å; C450-I453 WeakPolarHBondContact CA-O 3.25Å; I453-F455 HydrophobicContact CG2-CB 4.09Å; I453-F455 PolarHBondContact O-N 3.49Å; I453-H511 PolarHBondContact O-CE1 3.05Å; I453-H511 VanDerWaalsContact O-CE1 3.23Å
454Q94.2Very high95.2Very high82 Ų8269.5 Ų69.538%0.38332%0.321SS..  trans-100.963.7177.7-65.9174.5-2.200110.5C450 L515 M518 Y519C450-Q454 VanDerWaalsContact O-CG 3.24Å; C450-Q454 WeakPolarHBondContact O-CG 3.43Å; Q454-L515 HydrophobicContact CB-CD2 4.22Å; Q454-L515 HydrophobicContact CG-CD2 4.4Å; Q454-M518 HydrophobicContact CG-CE 4.45Å; Q454-M518 VanDerWaalsContact NE2-CE 3.32Å; Q454-Y519 PolarHBondContact O-OH 3.48Å
455F94.5Very high95.3Very high153 Ų15367.6 Ų67.667%0.67131%0.312SS*.  trans-126.8132.8-179.5176.7-90.6000110.5I453 H511 L515I453-F455 HydrophobicContact CG2-CB 4.09Å; I453-F455 PolarHBondContact O-N 3.49Å; F455-H511 PolarHBondContact O-NE2 3.3Å; F455-L515 WeakPolarHBondContact O-CD1 3.17Å
456P95.3Very high95.4Very high11 Ų1169.2 Ų69.27%0.07132%0.316CS..SBendcis-75.4163.92.134-41.6000113.6L461 P464 Y519P456-L461 HydrophobicContact CG-CB 4.27Å; P456-L461 HydrophobicContact CG-CD1 3.77Å; P456-P464 HydrophobicContact CG-CG 3.71Å; P456-Y519 WeakPolarHBondContact O-CE2 3.25Å; P456-Y519 PolarHBondContact O-OH 3.08Å
457G93.9Very high95.4Very high26 Ų2673.2 Ų73.227%0.26834%0.337SS..  trans-66.9164.7170.800000112.9R459 Y460 L461G457-R459 PolarHBondContact O-N 3.05Å; G457-R459 VanDerWaalsContact O-N 3.1Å; G457-Y460 PolarHBondContact O-N 3.15Å; G457-L461 PolarHBondContact O-N 3.22Å; G457-L461 VanDerWaalsContact O-N 3.12Å
458P95.2Very high95.5Very high39 Ų3973.5 Ų73.525%0.25334%0.338SS..THydrogen-bonded Turntrans-58-31.6-171.421-33.5000114.4Q394 Y460 Y519Q394-P458 PolarHBondContact NE2-O 2.89Å; P458-Y460 VanDerWaalsContact C-N 3.34Å; P458-Y519 HydrophobicContact CB-CD2 3.71Å; P458-Y519 HydrophobicContact CB-CE2 4.17Å; P458-Y519 HydrophobicContact CB-CG 3.9Å
459R95.5Very high95.7Very high191 Ų19172.3 Ų72.372%0.72133%0.333SS*.THydrogen-bonded Turntrans-68.3-30.5177.9-177.5175.2-179.7172.6-0.2113.4G457 W462G457-R459 PolarHBondContact O-N 3.05Å; G457-R459 VanDerWaalsContact O-N 3.1Å; R459-W462 VanDerWaalsContact O-CD1 3.29Å; R459-W462 PolarHBondContact O-NE1 3.31Å
460Y97.7Very high95.9Very high129 Ų12973.5 Ų73.551%0.50634%0.338SS..THydrogen-bonded Turntrans-109.7-2.7-172.1-58.1-71.2000113.2G457 P458 W462 I463 P464G457-Y460 PolarHBondContact O-N 3.15Å; P458-Y460 VanDerWaalsContact C-N 3.34Å; Y460-W462 PolarHBondContact O-N 3.02Å; Y460-W462 VanDerWaalsContact O-N 3.15Å; Y460-I463 HydrophobicContact CD1-CD1 4.09Å; Y460-I463 WeakPolarHBondContact O-CB 3.32Å; Y460-I463 PolarHBondContact O-N 3.18Å; Y460-P464 WeakPolarHBondContact O-CD 3.33Å
461L98.2Very high96.1Very high0 Ų078 Ų780%036%0.361CS..THydrogen-bonded Turntrans-56.3-32.7-177.9-177.162.9000113.7N397 P456 G457 I463 P464 V465 L512 L515 Y519N397-L461 HydrophobicContact CB-CD2 4.16Å; N397-L461 HydrophobicContact CB-CG 4.41Å; P456-L461 HydrophobicContact CG-CB 4.27Å; P456-L461 HydrophobicContact CG-CD1 3.77Å; G457-L461 PolarHBondContact O-N 3.22Å; G457-L461 VanDerWaalsContact O-N 3.12Å; L461-I463 PolarHBondContact O-N 3.15Å; L461-P464 VanDerWaalsContact O-CD 3.26Å; L461-P464 WeakPolarHBondContact O-CD 3.31Å; L461-P464 WeakPolarHBondContact O-CG 3.48Å; L461-V465 HydrophobicContact CD1-CG2 4.24Å; L461-V465 HydrophobicContact CG-CG2 4.13Å; L461-V465 WeakPolarHBondContact O-CB 3.48Å; L461-V465 WeakPolarHBondContact O-CG2 3.38Å; L461-V465 PolarHBondContact O-N 3.38Å; L461-L512 HydrophobicContact CD1-CB 4.46Å; L461-L512 HydrophobicContact CD1-CD2 3.7Å; L461-L515 HydrophobicContact CD1-CB 3.96Å; L461-L515 HydrophobicContact CD1-CD1 3.89Å; L461-L515 HydrophobicContact CD2-CB 3.97Å; L461-Y519 HydrophobicContact CD2-CD2 4.04Å; L461-Y519 HydrophobicContact CD2-CE2 4.37Å
462W98.3Very high96.5Very high143 Ų14376.9 Ų76.954%0.54235%0.354SS..Hα-helixtrans-62.3-26.1179.371.8-91.5000113.4N397 R459 Y460 V465 F466N397-W462 WeakPolarHBondContact OD1-CA 3.38Å; N397-W462 VanDerWaalsContact OD1-CB 3.29Å; N397-W462 WeakPolarHBondContact OD1-CB 3.45Å; R459-W462 VanDerWaalsContact O-CD1 3.29Å; R459-W462 PolarHBondContact O-NE1 3.31Å; Y460-W462 PolarHBondContact O-N 3.02Å; Y460-W462 VanDerWaalsContact O-N 3.15Å; W462-V465 PolarHBondContact O-N 3.5Å; W462-F466 VanDerWaalsContact O-CB 3.27Å; W462-F466 WeakPolarHBondContact O-CB 3.36Å; W462-F466 PolarHBondContact O-N 2.96Å
463I98.5Very high96.9Very high70 Ų7068.7 Ų68.736%0.35933%0.325SS..Hα-helixtrans-64.8-61-177.7-59.7173.8000110.7Y460 L461 V465 F466 L467Y460-I463 HydrophobicContact CD1-CD1 4.09Å; Y460-I463 WeakPolarHBondContact O-CB 3.32Å; Y460-I463 PolarHBondContact O-N 3.18Å; L461-I463 PolarHBondContact O-N 3.15Å; I463-V465 PolarHBondContact O-N 2.84Å; I463-F466 PolarHBondContact O-N 2.95Å; I463-L467 HydrophobicContact CG2-CD1 3.99Å; I463-L467 VanDerWaalsContact O-CG 3.32Å; I463-L467 WeakPolarHBondContact O-CG 3.17Å; I463-L467 PolarHBondContact O-N 3.32Å
464P98.3Very high97.1Very high41 Ų4167.7 Ų67.727%0.26632%0.324SS..Hα-helixtrans-66.6-25.9176.825.9-34.3000113.2P456 Y460 L461 R468 L512P456-P464 HydrophobicContact CG-CG 3.71Å; Y460-P464 WeakPolarHBondContact O-CD 3.33Å; L461-P464 VanDerWaalsContact O-CD 3.26Å; L461-P464 WeakPolarHBondContact O-CD 3.31Å; L461-P464 WeakPolarHBondContact O-CG 3.48Å; P464-R468 WeakPolarHBondContact O-CB 3.37Å; P464-R468 PolarHBondContact O-N 3.2Å; P464-L512 HydrophobicContact CB-CD1 4.14Å; P464-L512 HydrophobicContact CB-CD2 4.14Å; P464-L512 HydrophobicContact CG-CD2 3.87Å
465V98.7Very high97.3Very high2 Ų265.6 Ų65.61%0.01231%0.314CS..Hα-helixtrans-68.5-35.8174.6171.10000112.2N397 C400 V401 L461 W462 I463 R468 T469 L512N397-V465 HydrophobicContact CB-CG1 4.43Å; N397-V465 HydrophobicContact CB-CG2 4.28Å; C400-V465 HydrophobicContact CB-CG1 3.63Å; V401-V465 HydrophobicContact CG2-CB 4.32Å; V401-V465 HydrophobicContact CG2-CG1 3.84Å; V401-V465 HydrophobicContact CG2-CG2 3.66Å; L461-V465 HydrophobicContact CD1-CG2 4.24Å; L461-V465 HydrophobicContact CG-CG2 4.13Å; L461-V465 WeakPolarHBondContact O-CB 3.48Å; L461-V465 WeakPolarHBondContact O-CG2 3.38Å; L461-V465 PolarHBondContact O-N 3.38Å; W462-V465 PolarHBondContact O-N 3.5Å; I463-V465 PolarHBondContact O-N 2.84Å; V465-R468 WeakPolarHBondContact O-CG 3.22Å; V465-T469 PolarHBondContact O-OG1 3.42Å; V465-L512 HydrophobicContact CG2-CB 4.04Å; V465-L512 HydrophobicContact CG2-CD1 4.08Å; V465-L512 HydrophobicContact CG2-CG 4.47Å
466F98.1Very high97.4Very high114 Ų11458.3 Ų58.350%0.528%0.282SS..Hα-helixtrans-76.3-44.4174.2-173.3-114.2000111.1W462 I463 R468 T469 I470W462-F466 VanDerWaalsContact O-CB 3.27Å; W462-F466 WeakPolarHBondContact O-CB 3.36Å; W462-F466 PolarHBondContact O-N 2.96Å; I463-F466 PolarHBondContact O-N 2.95Å; F466-R468 PolarHBondContact O-N 2.77Å; F466-T469 WeakPolarHBondContact O-CB 3.49Å; F466-T469 PolarHBondContact O-N 3.35Å; F466-I470 HydrophobicContact CD1-CD1 3.75Å; F466-I470 HydrophobicContact CE1-CD1 3.17Å; F466-I470 HydrophobicContact CE1-CG1 4.27Å; F466-I470 HydrophobicContact CE2-CD1 4.2Å; F466-I470 HydrophobicContact CG-CD1 4.48Å; F466-I470 HydrophobicContact CZ-CD1 3.44Å; F466-I470 VanDerWaalsContact CZ-CD1 3.44Å; F466-I470 HydrophobicContact CZ-CG1 4.26Å; F466-I470 PolarHBondContact O-N 3.19Å
467L98.4Very high97.4Very high85 Ų8558.9 Ų58.945%0.44528%0.284SS..Hα-helixtrans-58.1-42.8177.5-71.4173000112.4I463 T469 I470 I471I463-L467 HydrophobicContact CG2-CD1 3.99Å; I463-L467 VanDerWaalsContact O-CG 3.32Å; I463-L467 WeakPolarHBondContact O-CG 3.17Å; I463-L467 PolarHBondContact O-N 3.32Å; L467-T469 PolarHBondContact O-N 3.37Å; L467-I470 PolarHBondContact O-N 3.45Å; L467-I471 HydrophobicContact CB-CD1 4.26Å; L467-I471 WeakPolarHBondContact O-CB 3.41Å; L467-I471 VanDerWaalsContact O-CG1 3.23Å; L467-I471 WeakPolarHBondContact O-CG1 3.27Å; L467-I471 PolarHBondContact O-N 2.99Å
468R98.1Very high97.5Very high6 Ų658.7 Ų58.72%0.02328%0.279CS..Hα-helixtrans-56.2-37.2175.871170.7-59.7100.7-0.9111.6T405 P464 V465 F466 F472 F505 S508 N509T405-R468 PolarHBondContact OG1-NH2 3.36Å; P464-R468 WeakPolarHBondContact O-CB 3.37Å; P464-R468 PolarHBondContact O-N 3.2Å; V465-R468 WeakPolarHBondContact O-CG 3.22Å; F466-R468 PolarHBondContact O-N 2.77Å; R468-F472 HydrophobicContact CB-CD2 3.7Å; R468-F472 HydrophobicContact CB-CE2 3.88Å; R468-F472 VanDerWaalsContact O-CB 3.31Å; R468-F472 WeakPolarHBondContact O-CB 3.11Å; R468-F472 VanDerWaalsContact O-CD2 3.22Å; R468-F472 WeakPolarHBondContact O-CD2 3.44Å; R468-F472 PolarHBondContact O-N 3.3Å; R468-F505 PolarHBondContact NH2-O 3.39Å; R468-F505 VanDerWaalsContact NH2-O 3.15Å; R468-S508 PolarHBondContact NH1-O 3.19Å; R468-S508 PolarHBondContact NH1-OG 3.44Å; R468-N509 VanDerWaalsContact NH1-N 3.18Å
469T98.1Very high97.6Very high24 Ų2457 Ų5715%0.14727%0.268CS..Hα-helixtrans-71.6-44.6-176.2-55.70000110.7C400 C404 V465 F466 L467 I471 I473C400-T469 PolarHBondContact SG-OG1 2.89Å; C400-T469 VanDerWaalsContact SG-OG1 3.37Å; C404-T469 HydrophobicContact CB-CG2 4.24Å; C404-T469 WeakPolarHBondContact CB-OG1 3.04Å; V465-T469 PolarHBondContact O-OG1 3.42Å; F466-T469 WeakPolarHBondContact O-CB 3.49Å; F466-T469 PolarHBondContact O-N 3.35Å; L467-T469 PolarHBondContact O-N 3.37Å; T469-I471 VanDerWaalsContact C-N 3.34Å; T469-I473 HydrophobicContact CG2-CD1 3.81Å
470I97.8Very high97.6Very high93 Ų9349.6 Ų49.648%0.47724%0.242SC..Hα-helixtrans-68.4-33.8177.6-68.1179.3000111.9F466 L467 P474F466-I470 HydrophobicContact CD1-CD1 3.75Å; F466-I470 HydrophobicContact CE1-CD1 3.17Å; F466-I470 HydrophobicContact CE1-CG1 4.27Å; F466-I470 HydrophobicContact CE2-CD1 4.2Å; F466-I470 HydrophobicContact CG-CD1 4.48Å; F466-I470 HydrophobicContact CZ-CD1 3.44Å; F466-I470 VanDerWaalsContact CZ-CD1 3.44Å; F466-I470 HydrophobicContact CZ-CG1 4.26Å; F466-I470 PolarHBondContact O-N 3.19Å; L467-I470 PolarHBondContact O-N 3.45Å; I470-P474 WeakPolarHBondContact O-CD 3.49Å; I470-P474 VanDerWaalsContact O-CG 3.25Å; I470-P474 WeakPolarHBondContact O-CG 3.16Å
471I98Very high97.5Very high95 Ų9544.2 Ų44.249%0.48722%0.222SC..Hα-helixtrans-85.6-53-175.5-66167.9000111.2L467 T469 F475L467-I471 HydrophobicContact CB-CD1 4.26Å; L467-I471 WeakPolarHBondContact O-CB 3.41Å; L467-I471 VanDerWaalsContact O-CG1 3.23Å; L467-I471 WeakPolarHBondContact O-CG1 3.27Å; L467-I471 PolarHBondContact O-N 2.99Å; T469-I471 VanDerWaalsContact C-N 3.34Å; I471-F475 WeakPolarHBondContact O-CB 3.44Å; I471-F475 PolarHBondContact O-N 3.33Å; I471-F475 VanDerWaalsContact O-N 3.15Å
472F98.4Very high97.1Very high24 Ų2446.8 Ų46.811%0.10525%0.248CC..Hα-helixtrans-76.1-35.6-168.7-70.1-65.3000113.6R468 F475 F476 L504 F505R468-F472 HydrophobicContact CB-CD2 3.7Å; R468-F472 HydrophobicContact CB-CE2 3.88Å; R468-F472 VanDerWaalsContact O-CB 3.31Å; R468-F472 WeakPolarHBondContact O-CB 3.11Å; R468-F472 VanDerWaalsContact O-CD2 3.22Å; R468-F472 WeakPolarHBondContact O-CD2 3.44Å; R468-F472 PolarHBondContact O-N 3.3Å; F472-F475 PolarHBondContact O-N 3.17Å; F472-F476 HydrophobicContact CB-CD2 4.26Å; F472-F476 HydrophobicContact CB-CE2 4.28Å; F472-F476 HydrophobicContact CD1-CE2 4.08Å; F472-F476 WeakPolarHBondContact O-CD2 3.24Å; F472-F476 PolarHBondContact O-N 3.31Å; F472-L504 HydrophobicContact CE1-CB 4.27Å; F472-L504 HydrophobicContact CZ-CB 4.06Å; F472-F505 HydrophobicContact CB-CD2 3.68Å; F472-F505 HydrophobicContact CB-CE2 3.82Å; F472-F505 HydrophobicContact CD1-CB 3.85Å; F472-F505 AromaticContact CD1-CD2 3.89Å; F472-F505 HydrophobicContact CD1-CD2 3.89Å; F472-F505 HydrophobicContact CD1-CG 4.25Å; F472-F505 AromaticContact CD2-CD2 3.57Å; F472-F505 HydrophobicContact CD2-CD2 3.57Å; F472-F505 HydrophobicContact CD2-CE2 4.27Å; F472-F505 HydrophobicContact CE1-CB 3.74Å; F472-F505 HydrophobicContact CE1-CD2 4.4Å; F472-F505 HydrophobicContact CE2-CB 4.47Å; F472-F505 HydrophobicContact CE2-CD2 4.13Å; F472-F505 HydrophobicContact CG-CB 4.28Å; F472-F505 AromaticContact CG-CD2 3.45Å; F472-F505 HydrophobicContact CG-CD2 3.45Å; F472-F505 VanDerWaalsContact CG-CD2 3.45Å; F472-F505 HydrophobicContact CG-CE2 4.1Å; F472-F505 HydrophobicContact CG-CG 4.26Å; F472-F505 HydrophobicContact CZ-CB 4.08Å
473I97.5Very high96.7Very high26 Ų2642.2 Ų42.213%0.13323%0.234CC..Hα-helixtrans-60.7-54.3-179.9-66.1176.1000110.7V408 T469 F475 F476 L477 L554V408-I473 HydrophobicContact CG2-CG1 4Å; T469-I473 HydrophobicContact CG2-CD1 3.81Å; I473-F475 PolarHBondContact O-N 2.66Å; I473-F476 PolarHBondContact O-N 3.47Å; I473-L477 HydrophobicContact CG2-CD1 3.94Å; I473-L477 WeakPolarHBondContact O-CG 3.28Å; I473-L477 PolarHBondContact O-N 3.45Å; I473-L477 VanDerWaalsContact O-N 3.15Å; I473-L554 HydrophobicContact CG2-CD1 3.86Å; I473-L554 HydrophobicContact CG2-CD2 4.43Å
474P96.3Very high95.9Very high67 Ų6746.1 Ų46.144%0.43526%0.255SS..Hα-helixtrans-62.2-40.5174.9-23.836.2000113.2I470 F476 L477 S478I470-P474 WeakPolarHBondContact O-CD 3.49Å; I470-P474 VanDerWaalsContact O-CG 3.25Å; I470-P474 WeakPolarHBondContact O-CG 3.16Å; P474-F476 VanDerWaalsContact C-N 3.32Å; P474-F476 PolarHBondContact O-N 3.44Å; P474-L477 PolarHBondContact O-N 3.36Å; P474-S478 PolarHBondContact O-N 3.5Å; P474-S478 PolarHBondContact O-OG 2.93Å
475F97.7Very high95.2Very high39 Ų3951.5 Ų51.517%0.17128%0.282CS..Hα-helixtrans-53.2-48.4178.3173.2-91.5000112.3I471 F472 I473 S478 C479 I492 I497I471-F475 WeakPolarHBondContact O-CB 3.44Å; I471-F475 PolarHBondContact O-N 3.33Å; I471-F475 VanDerWaalsContact O-N 3.15Å; F472-F475 PolarHBondContact O-N 3.17Å; I473-F475 PolarHBondContact O-N 2.66Å; F475-S478 PolarHBondContact O-N 2.93Å; F475-C479 PolarHBondContact O-SG 3.49Å; F475-I492 HydrophobicContact CD2-CD1 3.82Å; F475-I492 HydrophobicContact CD2-CG1 4.18Å; F475-I492 HydrophobicContact CE2-CD1 3.62Å; F475-I492 HydrophobicContact CE2-CG1 3.99Å; F475-I492 HydrophobicContact CZ-CD1 4.49Å; F475-I492 HydrophobicContact CZ-CG1 4.47Å; F475-I497 HydrophobicContact CE2-CG2 4.1Å; F475-I497 HydrophobicContact CZ-CG2 4.42Å
476F97.6Very high94.5Very high0 Ų054 Ų540%030%0.298CS..Hα-helixtrans-75.3-29.1-179.9-76.2-71.5000113.4V408 Q413 F472 I473 P474 S478 C479 F481 Y498 F505V408-F476 HydrophobicContact CB-CD2 4.46Å; V408-F476 HydrophobicContact CG1-CB 3.48Å; V408-F476 VanDerWaalsContact CG1-CB 3.48Å; V408-F476 HydrophobicContact CG1-CD1 4.19Å; V408-F476 HydrophobicContact CG1-CD2 3.51Å; V408-F476 HydrophobicContact CG1-CE2 4.25Å; V408-F476 HydrophobicContact CG1-CG 3.47Å; V408-F476 VanDerWaalsContact CG1-CG 3.47Å; Q413-F476 HydrophobicContact CG-CD1 4.25Å; Q413-F476 HydrophobicContact CG-CE1 3.96Å; F472-F476 HydrophobicContact CB-CD2 4.26Å; F472-F476 HydrophobicContact CB-CE2 4.28Å; F472-F476 HydrophobicContact CD1-CE2 4.08Å; F472-F476 WeakPolarHBondContact O-CD2 3.24Å; F472-F476 PolarHBondContact O-N 3.31Å; I473-F476 PolarHBondContact O-N 3.47Å; P474-F476 VanDerWaalsContact C-N 3.32Å; P474-F476 PolarHBondContact O-N 3.44Å; F476-S478 VanDerWaalsContact C-N 3.26Å; F476-S478 PolarHBondContact O-N 2.83Å; F476-C479 WeakPolarHBondContact O-CB 3.42Å; F476-C479 PolarHBondContact O-N 2.64Å; F476-F481 VanDerWaalsContact O-CZ 3.3Å; F476-F481 WeakPolarHBondContact O-CZ 3.4Å; F476-Y498 HydrophobicContact CD1-CD2 4.47Å; F476-Y498 AromaticContact CD1-CE2 3.94Å; F476-Y498 HydrophobicContact CD1-CE2 3.94Å; F476-Y498 HydrophobicContact CE1-CD2 4.26Å; F476-Y498 AromaticContact CE1-CE2 3.73Å; F476-Y498 HydrophobicContact CE1-CE2 3.73Å; F476-F505 HydrophobicContact CE2-CB 3.93Å; F476-F505 AromaticContact CE2-CD1 3.75Å; F476-F505 HydrophobicContact CE2-CD1 3.75Å; F476-F505 HydrophobicContact CE2-CD2 4.1Å; F476-F505 HydrophobicContact CE2-CE1 4.13Å; F476-F505 HydrophobicContact CE2-CE2 4.44Å; F476-F505 AromaticContact CE2-CG 3.69Å; F476-F505 HydrophobicContact CE2-CG 3.69Å; F476-F505 HydrophobicContact CE2-CZ 4.41Å; F476-F505 HydrophobicContact CZ-CB 4.11Å; F476-F505 HydrophobicContact CZ-CD1 4.01Å; F476-F505 HydrophobicContact CZ-CG 4.17Å
477L96.1Very high93.8Very high22 Ų2255.6 Ų55.612%0.11531%0.307CS..Hα-helixtrans-69.8-22.7173-71.7172.3000113.2V412 I473 P474 F481 L488 L554 I558V412-L477 HydrophobicContact CG1-CD2 4.39Å; I473-L477 HydrophobicContact CG2-CD1 3.94Å; I473-L477 WeakPolarHBondContact O-CG 3.28Å; I473-L477 PolarHBondContact O-N 3.45Å; I473-L477 VanDerWaalsContact O-N 3.15Å; P474-L477 PolarHBondContact O-N 3.36Å; L477-F481 WeakPolarHBondContact O-CE2 3.28Å; L477-L488 HydrophobicContact CB-CD1 4.37Å; L477-L554 HydrophobicContact CD1-CD2 3.98Å; L477-L554 HydrophobicContact CD2-CB 4.21Å; L477-I558 HydrophobicContact CD2-CD1 4.09Å; L477-I558 HydrophobicContact CD2-CG1 4.12Å
478S95.6Very high93.2Very high23 Ų2354.6 Ų54.616%0.16130%0.302CS..THydrogen-bonded Turntrans-94.612.3176.4-57.80000113.8P474 F475 F476 L491 I492P474-S478 PolarHBondContact O-N 3.5Å; P474-S478 PolarHBondContact O-OG 2.93Å; F475-S478 PolarHBondContact O-N 2.93Å; F476-S478 VanDerWaalsContact C-N 3.26Å; F476-S478 PolarHBondContact O-N 2.83Å; S478-L491 PolarHBondContact O-N 3.01Å; S478-I492 PolarHBondContact O-N 3.32Å; S478-I492 VanDerWaalsContact O-N 3.12Å
479C96.6Very high92.7Very high2 Ų258.8 Ų58.81%0.01433%0.332CS..SBendtrans-82.5166.1175.3-70.60000112.2V416 F475 F476 F481 Y498V416-C479 HydrophobicContact CG1-CB 4.02Å; V416-C479 HydrophobicContact CG2-CB 3.82Å; F475-C479 PolarHBondContact O-SG 3.49Å; F476-C479 WeakPolarHBondContact O-CB 3.42Å; F476-C479 PolarHBondContact O-N 2.64Å; C479-F481 WeakPolarHBondContact O-CD2 3.37Å; C479-F481 WeakPolarHBondContact O-CE2 3.38Å; C479-F481 PolarHBondContact O-N 2.87Å; C479-Y498 HydrophobicContact CB-CD2 4.48Å
480N95.6Very high92.3Very high36 Ų3659.9 Ų59.919%0.19334%0.339CS..  trans-75.1119.3177.5178.531000112V416 R417 I419 G482 V490V416-N480 CarbonylContact C-O 3.55Å; V416-N480 VanDerWaalsContact CA-O 3.29Å; V416-N480 WeakPolarHBondContact CA-O 3.41Å; V416-N480 WeakPolarHBondContact CG1-O 3.35Å; R417-N480 PolarHBondContact N-O 2.89Å; R417-N480 PolarHBondContact O-ND2 2.76Å; I419-N480 HydrophobicContact CD1-CB 3.91Å; I419-N480 HydrophobicContact CG1-CB 3.58Å; I419-N480 WeakPolarHBondContact CG1-ND2 3.4Å; N480-G482 PolarHBondContact OD1-N 3.35Å; N480-V490 HydrophobicContact CB-CG1 4.08Å
481F94.8Very high92.1Very high17 Ų1761.3 Ų61.38%0.07535%0.347CS..  trans-100.21175.7-63.5-75.6000114V412 R415 V416 F476 L477 C479 I483 I558V412-F481 HydrophobicContact CG1-CE1 3.92Å; V412-F481 HydrophobicContact CG1-CZ 3.83Å; R415-F481 HydrophobicContact CB-CD1 3.8Å; R415-F481 HydrophobicContact CB-CE1 4.21Å; V416-F481 HydrophobicContact CG2-CD1 4.33Å; V416-F481 HydrophobicContact CG2-CE1 3.87Å; V416-F481 HydrophobicContact CG2-CZ 4.45Å; F476-F481 VanDerWaalsContact O-CZ 3.3Å; F476-F481 WeakPolarHBondContact O-CZ 3.4Å; L477-F481 WeakPolarHBondContact O-CE2 3.28Å; C479-F481 WeakPolarHBondContact O-CD2 3.37Å; C479-F481 WeakPolarHBondContact O-CE2 3.38Å; C479-F481 PolarHBondContact O-N 2.87Å; F481-I483 VanDerWaalsContact C-N 3.33Å; F481-I483 HydrophobicContact CB-CD1 3.83Å; F481-I483 HydrophobicContact CB-CG1 4.04Å; F481-I558 HydrophobicContact CB-CG2 4.13Å; F481-I558 HydrophobicContact CD1-CD1 4.27Å; F481-I558 HydrophobicContact CD1-CG2 4.19Å; F481-I558 HydrophobicContact CD2-CD1 4.42Å; F481-I558 HydrophobicContact CD2-CG1 4.37Å; F481-I558 HydrophobicContact CD2-CG2 3.65Å; F481-I558 HydrophobicContact CE1-CD1 3.66Å; F481-I558 HydrophobicContact CE2-CD1 3.83Å; F481-I558 HydrophobicContact CE2-CG1 3.93Å; F481-I558 HydrophobicContact CE2-CG2 4.08Å; F481-I558 HydrophobicContact CG-CG2 3.71Å; F481-I558 HydrophobicContact CZ-CD1 3.41Å; F481-I558 VanDerWaalsContact CZ-CD1 3.41Å; F481-I558 HydrophobicContact CZ-CG1 4.04Å
482G91.2Very high92Very high53 Ų5358.2 Ų58.255%0.54633%0.33SS..  trans66.432.5-178.300000113.8N480N480-G482 PolarHBondContact OD1-N 3.35Å
483I89.3Confident91.7Very high48 Ų4861.9 Ų61.925%0.24636%0.355CS..  trans-100.8133.4179.3-59.1168000108.8F481 N485 I558 Y559F481-I483 VanDerWaalsContact C-N 3.33Å; F481-I483 HydrophobicContact CB-CD1 3.83Å; F481-I483 HydrophobicContact CB-CG1 4.04Å; I483-N485 PolarHBondContact O-N 3.22Å; I483-I558 HydrophobicContact CD1-CG2 3.61Å; I483-Y559 HydrophobicContact CD1-CD1 3.57Å; I483-Y559 HydrophobicContact CD1-CE1 3.3Å; I483-Y559 HydrophobicContact CD1-CG 4.35Å; I483-Y559 HydrophobicContact CG1-CD1 4.31Å; I483-Y559 HydrophobicContact CG1-CE1 3.79Å
484D82.8Confident91.7Very high152 Ų15264 Ų6481%0.81337%0.367SS*.SBendtrans-73114170.1-59.9-38.4000109.1
485N82.7Confident91.7Very high153 Ų15361.3 Ų61.382%0.81835%0.348SS*.SBendtrans6470.8-173.7-52.3-60.8000114.7I483I483-N485 PolarHBondContact O-N 3.22Å
486P83.7Confident91.7Very high55 Ų5564.9 Ų64.936%0.35737%0.365SS..  trans-68.4142.7-179.831.1-35.8000112.1L488 V490P486-L488 WeakPolarHBondContact CB-O 3.42Å; P486-L488 WeakPolarHBondContact CG-O 3.26Å; P486-L488 PolarHBondContact O-N 2.69Å; P486-V490 HydrophobicContact CG-CG2 4.2Å
487H83Confident91.7Very high147 Ų14768.8 Ų68.868%0.68139%0.386SS*.SBendtrans-62-30.5173.1-71.2-65.7000112.8Y559H487-Y559 PolarHBondContact CD2-O 3.34Å; H487-Y559 PolarHBondContact NE2-O 3.42Å
488L86.7Confident91.8Very high64 Ų6468 Ų6834%0.33538%0.381SS..SBendtrans-106.4135.1176.3-65.8171.1000110L477 P486 V490 L557 I558L477-L488 HydrophobicContact CB-CD1 4.37Å; P486-L488 WeakPolarHBondContact CB-O 3.42Å; P486-L488 WeakPolarHBondContact CG-O 3.26Å; P486-L488 PolarHBondContact O-N 2.69Å; L488-V490 PolarHBondContact O-N 3.22Å; L488-L557 HydrophobicContact CD1-CB 4.25Å; L488-L557 WeakPolarHBondContact CD1-O 3.47Å; L488-I558 HydrophobicContact CD1-CG1 4.47Å
489S87.1Confident91.9Very high94 Ų9467.6 Ų67.666%0.65738%0.378SS*.  trans-66.3132.7176.6-53.60000111.5L491S489-L491 PolarHBondContact O-N 3.3Å
490V90.7Very high92Very high48 Ų4872.3 Ų72.329%0.29140%0.402SS..  trans-77102.3174-1780000108.8N480 P486 L488N480-V490 HydrophobicContact CB-CG1 4.08Å; P486-V490 HydrophobicContact CG-CG2 4.2Å; L488-V490 PolarHBondContact O-N 3.22Å
491L93.3Very high92.1Very high123 Ų12370.9 Ų70.964%0.64440%0.396SS*.  trans-89.6-31.2178.2-57.1179000112S478 S489 T493S478-L491 PolarHBondContact O-N 3.01Å; S489-L491 PolarHBondContact O-N 3.3Å; L491-T493 PolarHBondContact O-N 3.47Å
492I94.8Very high92.3Very high29 Ų2970.1 Ų70.115%0.14939%0.393CS..  trans-87.592.7178.9-52.9-55.6000108.5I419 F475 S478 I497I419-I492 VanDerWaalsContact CD1-O 3.25Å; I419-I492 WeakPolarHBondContact CD1-O 3.22Å; F475-I492 HydrophobicContact CD2-CD1 3.82Å; F475-I492 HydrophobicContact CD2-CG1 4.18Å; F475-I492 HydrophobicContact CE2-CD1 3.62Å; F475-I492 HydrophobicContact CE2-CG1 3.99Å; F475-I492 HydrophobicContact CZ-CD1 4.49Å; F475-I492 HydrophobicContact CZ-CG1 4.47Å; S478-I492 PolarHBondContact O-N 3.32Å; S478-I492 VanDerWaalsContact O-N 3.12Å; I492-I497 HydrophobicContact CD1-CG2 4.38Å; I492-I497 HydrophobicContact CG2-CB 4.31Å; I492-I497 HydrophobicContact CG2-CG2 4.17Å
493T93.3Very high92.6Very high101 Ų10169.3 Ų69.362%0.6238%0.376SS*.  trans-96.51.4-176.4560000114.6I419 L491I419-T493 WeakPolarHBondContact CD1-O 3.03Å; L491-T493 PolarHBondContact O-N 3.47Å
494N95.8Very high93Very high71 Ų7171.2 Ų71.238%0.3839%0.386SS..  trans-123.4119.9-178.9-175.7-31.3000111H496 I497 Y498N494-H496 PolarHBondContact O-N 3.45Å; N494-H496 VanDerWaalsContact OD1-CB 3.32Å; N494-H496 WeakPolarHBondContact OD1-CB 2.99Å; N494-H496 PolarHBondContact OD1-N 2.98Å; N494-I497 HydrophobicContact CB-CB 4.41Å; N494-I497 HydrophobicContact CB-CD1 3.9Å; N494-I497 HydrophobicContact CB-CG1 3.97Å; N494-I497 WeakPolarHBondContact O-CB 3.25Å; N494-I497 PolarHBondContact O-N 2.97Å; N494-Y498 PolarHBondContact O-N 3.5Å
495D97.2Very high93.8Very high10 Ų1064 Ų645%0.05335%0.347CS..Hα-helixtrans-61-29.2-177.9-65.1-42.5000113.2P418 I419 N420 Y423 Y498 V499P418-D495 WeakPolarHBondContact CA-OD1 3.15Å; I419-D495 PolarHBondContact N-OD1 3.08Å; I419-D495 PolarHBondContact N-OD2 2.78Å; I419-D495 VanDerWaalsContact N-OD2 3.16Å; N420-D495 PolarHBondContact N-OD2 2.93Å; Y423-D495 HydrophobicContact CD1-CB 4.25Å; Y423-D495 HydrophobicContact CD2-CB 3.7Å; Y423-D495 HydrophobicContact CE1-CB 4.09Å; Y423-D495 HydrophobicContact CE2-CB 3.53Å; Y423-D495 HydrophobicContact CG-CB 4.05Å; Y423-D495 PolarHBondContact OH-O 2.81Å; D495-Y498 PolarHBondContact O-N 3.28Å; D495-V499 WeakPolarHBondContact O-CG2 3.25Å; D495-V499 PolarHBondContact O-N 3.18Å
496H97.5Very high94.5Very high114 Ų11456.7 Ų56.753%0.52831%0.308SS..Hα-helixtrans-67.2-36.5174.3-65.6-65.5000112.4Y423 N494 V499 L500Y423-H496 AromaticContact CE2-CE1 3.47Å; Y423-H496 VanDerWaalsContact CE2-CE1 3.47Å; Y423-H496 WeakPolarHBondContact CE2-CE1 2.95Å; Y423-H496 AromaticContact CE2-ND1 3.67Å; Y423-H496 AromaticContact CE2-NE2 3.75Å; Y423-H496 AromaticContact CZ-ND1 3.86Å; Y423-H496 PolarHBondContact OH-ND1 3.12Å; N494-H496 PolarHBondContact O-N 3.45Å; N494-H496 VanDerWaalsContact OD1-CB 3.32Å; N494-H496 WeakPolarHBondContact OD1-CB 2.99Å; N494-H496 PolarHBondContact OD1-N 2.98Å; H496-V499 PolarHBondContact O-N 3.05Å; H496-L500 WeakPolarHBondContact O-CB 3.32Å; H496-L500 PolarHBondContact O-N 3.31Å
497I97.6Very high95.2Very high83 Ų8356.7 Ų56.743%0.42631%0.305SS..Hα-helixtrans-67.1-43.1176.2-61.6179.8000109.4F475 I492 N494 L500 G501F475-I497 HydrophobicContact CE2-CG2 4.1Å; F475-I497 HydrophobicContact CZ-CG2 4.42Å; I492-I497 HydrophobicContact CD1-CG2 4.38Å; I492-I497 HydrophobicContact CG2-CB 4.31Å; I492-I497 HydrophobicContact CG2-CG2 4.17Å; N494-I497 HydrophobicContact CB-CB 4.41Å; N494-I497 HydrophobicContact CB-CD1 3.9Å; N494-I497 HydrophobicContact CB-CG1 3.97Å; N494-I497 WeakPolarHBondContact O-CB 3.25Å; N494-I497 PolarHBondContact O-N 2.97Å; I497-L500 PolarHBondContact O-N 3Å; I497-G501 PolarHBondContact O-N 2.95Å
498Y98Very high95.9Very high5 Ų550.9 Ų50.92%0.0228%0.281CS..Hα-helixtrans-57.5-49.8173.5169.5-104.6000111.8Q413 V416 F430 T434 F476 C479 N494 D495 L500 G501 C502Q413-Y498 WeakPolarHBondContact CG-OH 3.45Å; Q413-Y498 PolarHBondContact O-OH 3.44Å; V416-Y498 HydrophobicContact CB-CE2 3.94Å; V416-Y498 HydrophobicContact CG1-CD1 4.49Å; V416-Y498 HydrophobicContact CG1-CD2 3.99Å; V416-Y498 HydrophobicContact CG1-CE1 4.14Å; V416-Y498 HydrophobicContact CG1-CE2 3.58Å; V416-Y498 HydrophobicContact CG1-CG 4.41Å; V416-Y498 HydrophobicContact CG2-CE2 3.91Å; F430-Y498 AromaticContact CE1-CD1 3.98Å; F430-Y498 HydrophobicContact CE1-CD1 3.98Å; F430-Y498 AromaticContact CE1-CE1 3.48Å; F430-Y498 HydrophobicContact CE1-CE1 3.48Å; F430-Y498 VanDerWaalsContact CE1-CE1 3.48Å; F430-Y498 AromaticContact CZ-CD1 3.54Å; F430-Y498 HydrophobicContact CZ-CD1 3.54Å; F430-Y498 AromaticContact CZ-CE1 3.52Å; F430-Y498 HydrophobicContact CZ-CE1 3.52Å; T434-Y498 HydrophobicContact CG2-CE1 4.4Å; F476-Y498 HydrophobicContact CD1-CD2 4.47Å; F476-Y498 AromaticContact CD1-CE2 3.94Å; F476-Y498 HydrophobicContact CD1-CE2 3.94Å; F476-Y498 HydrophobicContact CE1-CD2 4.26Å; F476-Y498 AromaticContact CE1-CE2 3.73Å; F476-Y498 HydrophobicContact CE1-CE2 3.73Å; C479-Y498 HydrophobicContact CB-CD2 4.48Å; N494-Y498 PolarHBondContact O-N 3.5Å; D495-Y498 PolarHBondContact O-N 3.28Å; Y498-L500 PolarHBondContact O-N 3.49Å; Y498-G501 WeakPolarHBondContact O-CA 3.31Å; Y498-G501 PolarHBondContact O-N 3.44Å; Y498-G501 VanDerWaalsContact O-N 3.16Å; Y498-C502 PolarHBondContact O-N 2.8Å; Y498-C502 PolarHBondContact O-SG 2.89Å
499V98.1Very high96.5Very high14 Ų1448 Ų489%0.08527%0.266CS..Hα-helixtrans-61.1-44.2179.1168.50000111.6Y423 T434 F438 D495 H496 G501 C502 I503Y423-V499 HydrophobicContact CE1-CG2 4.23Å; Y423-V499 WeakPolarHBondContact OH-CG2 3.27Å; T434-V499 HydrophobicContact CG2-CG2 3.93Å; F438-V499 HydrophobicContact CD2-CG1 4.29Å; F438-V499 HydrophobicContact CE2-CG1 3.78Å; D495-V499 WeakPolarHBondContact O-CG2 3.25Å; D495-V499 PolarHBondContact O-N 3.18Å; H496-V499 PolarHBondContact O-N 3.05Å; V499-G501 VanDerWaalsContact C-N 3.3Å; V499-G501 PolarHBondContact O-N 3.31Å; V499-C502 WeakPolarHBondContact O-CB 3.5Å; V499-C502 PolarHBondContact O-N 3.25Å; V499-I503 HydrophobicContact CG1-CD1 4.09Å; V499-I503 WeakPolarHBondContact O-CG1 3.2Å; V499-I503 PolarHBondContact O-N 3.01Å
500L98.1Very high97Very high101 Ų10143.6 Ų43.653%0.52924%0.235SC..Hα-helixtrans-59.6-42.8175179.561.9000111.4H496 I497 Y498 C502 I503 L504H496-L500 WeakPolarHBondContact O-CB 3.32Å; H496-L500 PolarHBondContact O-N 3.31Å; I497-L500 PolarHBondContact O-N 3Å; Y498-L500 PolarHBondContact O-N 3.49Å; L500-C502 PolarHBondContact O-N 3.42Å; L500-I503 PolarHBondContact O-N 3.12Å; L500-L504 HydrophobicContact CD1-CD1 4.28Å; L500-L504 HydrophobicContact CD1-CG 4.26Å; L500-L504 HydrophobicContact CG-CD1 4.13Å; L500-L504 HydrophobicContact CG-CG 4.5Å; L500-L504 WeakPolarHBondContact O-CG 3.15Å; L500-L504 PolarHBondContact O-N 3.24Å
501G98.2Very high97.3Very high6 Ų642.5 Ų42.56%0.06223%0.227CC..Hα-helixtrans-58.9-42.917400000112.9I497 Y498 V499 I503 L504 F505I497-G501 PolarHBondContact O-N 2.95Å; Y498-G501 WeakPolarHBondContact O-CA 3.31Å; Y498-G501 PolarHBondContact O-N 3.44Å; Y498-G501 VanDerWaalsContact O-N 3.16Å; V499-G501 VanDerWaalsContact C-N 3.3Å; V499-G501 PolarHBondContact O-N 3.31Å; G501-I503 PolarHBondContact O-N 3.19Å; G501-L504 PolarHBondContact O-N 3.16Å; G501-F505 WeakPolarHBondContact O-CB 3.39Å; G501-F505 PolarHBondContact O-N 3.46Å
502C98.3Very high97.6Very high1 Ų137.1 Ų37.11%0.00720%0.198CC..Hα-helixtrans-59-46.2174.9-630000112Q413 Y498 V499 L500 F505 A506Q413-C502 PolarHBondContact NE2-SG 3.25Å; Y498-C502 PolarHBondContact O-N 2.8Å; Y498-C502 PolarHBondContact O-SG 2.89Å; V499-C502 WeakPolarHBondContact O-CB 3.5Å; V499-C502 PolarHBondContact O-N 3.25Å; L500-C502 PolarHBondContact O-N 3.42Å; C502-F505 PolarHBondContact O-N 2.8Å; C502-A506 VanDerWaalsContact O-CB 3.3Å; C502-A506 WeakPolarHBondContact O-CB 3.41Å; C502-A506 PolarHBondContact O-N 3.13Å
503I98.4Very high97.7Very high37 Ų3735.8 Ų35.819%0.1919%0.192CC..Hα-helixtrans-63.6-48.9179.7-66.7173000110.7F438 F442 V499 L500 G501 F505 A506 L507F438-I503 HydrophobicContact CD2-CG1 4.25Å; F442-I503 HydrophobicContact CD1-CG2 3.76Å; F442-I503 HydrophobicContact CD2-CB 4.38Å; F442-I503 HydrophobicContact CD2-CG1 3.86Å; F442-I503 HydrophobicContact CD2-CG2 4.24Å; F442-I503 HydrophobicContact CE1-CG2 3.8Å; F442-I503 HydrophobicContact CE2-CB 4.47Å; F442-I503 HydrophobicContact CE2-CD1 3.99Å; F442-I503 HydrophobicContact CE2-CG1 3.61Å; F442-I503 HydrophobicContact CE2-CG2 4.31Å; F442-I503 HydrophobicContact CG-CG1 4.46Å; F442-I503 HydrophobicContact CG-CG2 3.99Å; F442-I503 HydrophobicContact CZ-CD1 3.97Å; F442-I503 HydrophobicContact CZ-CG1 3.97Å; F442-I503 HydrophobicContact CZ-CG2 4.09Å; V499-I503 HydrophobicContact CG1-CD1 4.09Å; V499-I503 WeakPolarHBondContact O-CG1 3.2Å; V499-I503 PolarHBondContact O-N 3.01Å; L500-I503 PolarHBondContact O-N 3.12Å; G501-I503 PolarHBondContact O-N 3.19Å; I503-F505 PolarHBondContact O-N 3.01Å; I503-A506 PolarHBondContact O-N 3.48Å; I503-L507 HydrophobicContact CG2-CD1 3.83Å; I503-L507 HydrophobicContact CG2-CG 4.42Å; I503-L507 WeakPolarHBondContact O-CB 3.33Å; I503-L507 WeakPolarHBondContact O-CG 3.46Å; I503-L507 PolarHBondContact O-N 3.42Å
504L98.4Very high97.9Very high87 Ų8731 Ų3146%0.45516%0.162SC..Hα-helixtrans-64.9-39.4179.8-68.7176.9000112F472 L500 G501 S508F472-L504 HydrophobicContact CE1-CB 4.27Å; F472-L504 HydrophobicContact CZ-CB 4.06Å; L500-L504 HydrophobicContact CD1-CD1 4.28Å; L500-L504 HydrophobicContact CD1-CG 4.26Å; L500-L504 HydrophobicContact CG-CD1 4.13Å; L500-L504 HydrophobicContact CG-CG 4.5Å; L500-L504 WeakPolarHBondContact O-CG 3.15Å; L500-L504 PolarHBondContact O-N 3.24Å; G501-L504 PolarHBondContact O-N 3.16Å; L504-S508 VanDerWaalsContact O-CB 3.23Å; L504-S508 WeakPolarHBondContact O-CB 3.39Å; L504-S508 PolarHBondContact O-N 2.91Å; L504-S508 PolarHBondContact O-OG 2.91Å
505F98.6Very high98.1Very high0 Ų027.6 Ų27.60%014%0.144CC..Hα-helixtrans-61-44.7176.6-179.8-124.7000112.2T405 V408 F409 F439 R468 F472 F476 G501 C502 I503 S508 N509T405-F505 HydrophobicContact CG2-CE1 4.45Å; T405-F505 HydrophobicContact CG2-CZ 4.33Å; V408-F505 HydrophobicContact CB-CZ 4.11Å; F409-F505 HydrophobicContact CB-CE1 3.96Å; F439-F505 HydrophobicContact CD2-CD1 4.03Å; F439-F505 HydrophobicContact CD2-CE1 4.27Å; F439-F505 AromaticContact CE2-CD1 3.86Å; F439-F505 HydrophobicContact CE2-CD1 3.86Å; F439-F505 AromaticContact CE2-CE1 3.87Å; F439-F505 HydrophobicContact CE2-CE1 3.87Å; R468-F505 PolarHBondContact NH2-O 3.39Å; R468-F505 VanDerWaalsContact NH2-O 3.15Å; F472-F505 HydrophobicContact CB-CD2 3.68Å; F472-F505 HydrophobicContact CB-CE2 3.82Å; F472-F505 HydrophobicContact CD1-CB 3.85Å; F472-F505 AromaticContact CD1-CD2 3.89Å; F472-F505 HydrophobicContact CD1-CD2 3.89Å; F472-F505 HydrophobicContact CD1-CG 4.25Å; F472-F505 AromaticContact CD2-CD2 3.57Å; F472-F505 HydrophobicContact CD2-CD2 3.57Å; F472-F505 HydrophobicContact CD2-CE2 4.27Å; F472-F505 HydrophobicContact CE1-CB 3.74Å; F472-F505 HydrophobicContact CE1-CD2 4.4Å; F472-F505 HydrophobicContact CE2-CB 4.47Å; F472-F505 HydrophobicContact CE2-CD2 4.13Å; F472-F505 HydrophobicContact CG-CB 4.28Å; F472-F505 AromaticContact CG-CD2 3.45Å; F472-F505 HydrophobicContact CG-CD2 3.45Å; F472-F505 VanDerWaalsContact CG-CD2 3.45Å; F472-F505 HydrophobicContact CG-CE2 4.1Å; F472-F505 HydrophobicContact CG-CG 4.26Å; F472-F505 HydrophobicContact CZ-CB 4.08Å; F476-F505 HydrophobicContact CE2-CB 3.93Å; F476-F505 AromaticContact CE2-CD1 3.75Å; F476-F505 HydrophobicContact CE2-CD1 3.75Å; F476-F505 HydrophobicContact CE2-CD2 4.1Å; F476-F505 HydrophobicContact CE2-CE1 4.13Å; F476-F505 HydrophobicContact CE2-CE2 4.44Å; F476-F505 AromaticContact CE2-CG 3.69Å; F476-F505 HydrophobicContact CE2-CG 3.69Å; F476-F505 HydrophobicContact CE2-CZ 4.41Å; F476-F505 HydrophobicContact CZ-CB 4.11Å; F476-F505 HydrophobicContact CZ-CD1 4.01Å; F476-F505 HydrophobicContact CZ-CG 4.17Å; G501-F505 WeakPolarHBondContact O-CB 3.39Å; G501-F505 PolarHBondContact O-N 3.46Å; C502-F505 PolarHBondContact O-N 2.8Å; I503-F505 PolarHBondContact O-N 3.01Å; F505-S508 PolarHBondContact O-OG 2.91Å; F505-S508 VanDerWaalsContact O-OG 3.05Å; F505-N509 WeakPolarHBondContact O-CB 3.37Å; F505-N509 PolarHBondContact O-N 3.36Å
506A98.5Very high98.1Very high0 Ų027.1 Ų27.10%014%0.142CC..Hα-helixtrans-68.9-50.5178.600000112.6F439 F442 A443 C502 I503 S508 N509 G510F439-A506 HydrophobicContact CB-CB 4.48Å; F439-A506 HydrophobicContact CD2-CB 3.93Å; F439-A506 HydrophobicContact CE2-CB 4.4Å; F439-A506 HydrophobicContact CG-CB 4.35Å; F442-A506 HydrophobicContact CB-CB 3.63Å; A443-A506 VanDerWaalsContact CA-O 3.27Å; A443-A506 WeakPolarHBondContact CA-O 3.3Å; C502-A506 VanDerWaalsContact O-CB 3.3Å; C502-A506 WeakPolarHBondContact O-CB 3.41Å; C502-A506 PolarHBondContact O-N 3.13Å; I503-A506 PolarHBondContact O-N 3.48Å; A506-S508 VanDerWaalsContact C-N 3.31Å; A506-S508 PolarHBondContact O-N 2.62Å; A506-N509 WeakPolarHBondContact O-CB 3.38Å; A506-N509 PolarHBondContact O-N 3.18Å; A506-N509 VanDerWaalsContact O-N 3.13Å; A506-G510 PolarHBondContact O-N 2.87Å
507L98.1Very high98.1Very high55 Ų5521.8 Ų21.829%0.28812%0.117SC..Hα-helixtrans-54.3-49.1176.1-81.8170.4000111.2F442 L445 I503 N509 G510 H511F442-L507 HydrophobicContact CB-CD2 4.45Å; F442-L507 HydrophobicContact CB-CG 4.14Å; F442-L507 HydrophobicContact CD1-CD1 4.45Å; F442-L507 HydrophobicContact CD1-CD2 4.25Å; F442-L507 HydrophobicContact CD1-CG 4.15Å; F442-L507 WeakPolarHBondContact O-CD2 3.47Å; L445-L507 HydrophobicContact CB-CD2 4.16Å; I503-L507 HydrophobicContact CG2-CD1 3.83Å; I503-L507 HydrophobicContact CG2-CG 4.42Å; I503-L507 WeakPolarHBondContact O-CB 3.33Å; I503-L507 WeakPolarHBondContact O-CG 3.46Å; I503-L507 PolarHBondContact O-N 3.42Å; L507-N509 VanDerWaalsContact C-N 3.35Å; L507-N509 PolarHBondContact O-N 3.44Å; L507-G510 PolarHBondContact O-N 2.94Å; L507-H511 VanDerWaalsContact O-CB 3.24Å; L507-H511 WeakPolarHBondContact O-CB 3.32Å; L507-H511 PolarHBondContact O-N 3.18Å
508S98.1Very high98.1Very high26 Ų2617.9 Ų17.918%0.18210%0.097CC..Hα-helixtrans-69-31.9-179.459.90000112.4R468 L504 F505 A506 L512R468-S508 PolarHBondContact NH1-O 3.19Å; R468-S508 PolarHBondContact NH1-OG 3.44Å; L504-S508 VanDerWaalsContact O-CB 3.23Å; L504-S508 WeakPolarHBondContact O-CB 3.39Å; L504-S508 PolarHBondContact O-N 2.91Å; L504-S508 PolarHBondContact O-OG 2.91Å; F505-S508 PolarHBondContact O-OG 2.91Å; F505-S508 VanDerWaalsContact O-OG 3.05Å; A506-S508 VanDerWaalsContact C-N 3.31Å; A506-S508 PolarHBondContact O-N 2.62Å; S508-L512 VanDerWaalsContact O-CB 3.24Å; S508-L512 WeakPolarHBondContact O-CB 3.48Å; S508-L512 WeakPolarHBondContact O-CG 3.45Å; S508-L512 PolarHBondContact O-N 2.9Å
509N98.1Very high98.1Very high4 Ų417.9 Ų17.92%0.02110%0.097CC..Hα-helixtrans-61-55.3172.6172.563.5000110.3V401 T405 F439 R468 F505 A506 L507 H511 A513V401-N509 WeakPolarHBondContact CG1-OD1 3.23Å; T405-N509 HydrophobicContact CG2-CB 4.5Å; T405-N509 PolarHBondContact OG1-OD1 3.02Å; F439-N509 HydrophobicContact CE2-CB 4.38Å; F439-N509 HydrophobicContact CZ-CB 4.18Å; F439-N509 WeakPolarHBondContact CZ-ND2 3.33Å; R468-N509 VanDerWaalsContact NH1-N 3.18Å; F505-N509 WeakPolarHBondContact O-CB 3.37Å; F505-N509 PolarHBondContact O-N 3.36Å; A506-N509 WeakPolarHBondContact O-CB 3.38Å; A506-N509 PolarHBondContact O-N 3.18Å; A506-N509 VanDerWaalsContact O-N 3.13Å; L507-N509 VanDerWaalsContact C-N 3.35Å; L507-N509 PolarHBondContact O-N 3.44Å; N509-H511 VanDerWaalsContact C-N 3.35Å; N509-H511 PolarHBondContact O-N 2.91Å; N509-A513 WeakPolarHBondContact O-CB 3.49Å; N509-A513 PolarHBondContact O-N 3.31Å
510G97.5Very high98Very high1 Ų117.3 Ų17.31%0.019%0.093CC..Hα-helixtrans-58.9-46.6179.900000112.5A443 C447 A506 L507 S514A443-G510 WeakPolarHBondContact O-CA 3.37Å; C447-G510 VanDerWaalsContact SG-CA 3.51Å; C447-G510 PolarHBondContact SG-O 2.97Å; A506-G510 PolarHBondContact O-N 2.87Å; L507-G510 PolarHBondContact O-N 2.94Å; G510-S514 VanDerWaalsContact O-CB 3.23Å; G510-S514 WeakPolarHBondContact O-CB 3.31Å; G510-S514 PolarHBondContact O-N 3.03Å; G510-S514 PolarHBondContact O-OG 3.27Å
511H98Very high97.8Very high24 Ų2412.6 Ų12.611%0.1117%0.069CC..Hα-helixtrans-65.9-55.9-177.7-163.475.1000112.4G446 C450 I453 F455 L507 N509 A513 S514 L515G446-H511 WeakPolarHBondContact O-CA 3.24Å; G446-H511 PolarHBondContact O-ND1 2.88Å; C450-H511 PolarHBondContact SG-CE1 2.9Å; C450-H511 PolarHBondContact SG-ND1 3.48Å; C450-H511 PolarHBondContact SG-O 3.37Å; I453-H511 PolarHBondContact O-CE1 3.05Å; I453-H511 VanDerWaalsContact O-CE1 3.23Å; F455-H511 PolarHBondContact O-NE2 3.3Å; L507-H511 VanDerWaalsContact O-CB 3.24Å; L507-H511 WeakPolarHBondContact O-CB 3.32Å; L507-H511 PolarHBondContact O-N 3.18Å; N509-H511 VanDerWaalsContact C-N 3.35Å; N509-H511 PolarHBondContact O-N 2.91Å; H511-A513 PolarHBondContact O-N 2.72Å; H511-S514 PolarHBondContact O-N 2.98Å; H511-L515 WeakPolarHBondContact O-CG 3.46Å; H511-L515 PolarHBondContact O-N 2.89Å
512L98.5Very high97.6Very high10 Ų1016.5 Ų16.55%0.0528%0.082CC..Hα-helixtrans-70.9-35.6-173.2-59.1174.7000112.5V401 L461 P464 V465 S508 S514 G516V401-L512 HydrophobicContact CG2-CB 3.84Å; L461-L512 HydrophobicContact CD1-CB 4.46Å; L461-L512 HydrophobicContact CD1-CD2 3.7Å; P464-L512 HydrophobicContact CB-CD1 4.14Å; P464-L512 HydrophobicContact CB-CD2 4.14Å; P464-L512 HydrophobicContact CG-CD2 3.87Å; V465-L512 HydrophobicContact CG2-CB 4.04Å; V465-L512 HydrophobicContact CG2-CD1 4.08Å; V465-L512 HydrophobicContact CG2-CG 4.47Å; S508-L512 VanDerWaalsContact O-CB 3.24Å; S508-L512 WeakPolarHBondContact O-CB 3.48Å; S508-L512 WeakPolarHBondContact O-CG 3.45Å; S508-L512 PolarHBondContact O-N 2.9Å; L512-S514 VanDerWaalsContact C-N 3.32Å; L512-G516 PolarHBondContact O-N 2.77Å
513A97.7Very high97.3Very high1 Ų118.4 Ų18.41%0.00810%0.095CC..Hα-helixtrans-62.7-41.3173.100000111.4V401 Y402 N509 H511 G516 L517V401-A513 HydrophobicContact CG1-CB 3.92Å; Y402-A513 HydrophobicContact CE2-CB 3.74Å; N509-A513 WeakPolarHBondContact O-CB 3.49Å; N509-A513 PolarHBondContact O-N 3.31Å; H511-A513 PolarHBondContact O-N 2.72Å; A513-G516 PolarHBondContact O-N 3.24Å; A513-L517 PolarHBondContact O-N 3.02Å
514S97.9Very high96.9Very high0 Ų017.3 Ų17.30%09%0.091CC..Hα-helixtrans-64.4-46.6178.6-58.90000112.1N154 C447 G510 H511 L512 G516 L517 M518N154-S514 VanDerWaalsContact OD1-CB 3.25Å; N154-S514 WeakPolarHBondContact OD1-CB 3.2Å; N154-S514 PolarHBondContact OD1-OG 3.44Å; N154-S514 VanDerWaalsContact OD1-OG 3.1Å; C447-S514 PolarHBondContact SG-OG 3.23Å; G510-S514 VanDerWaalsContact O-CB 3.23Å; G510-S514 WeakPolarHBondContact O-CB 3.31Å; G510-S514 PolarHBondContact O-N 3.03Å; G510-S514 PolarHBondContact O-OG 3.27Å; H511-S514 PolarHBondContact O-N 2.98Å; L512-S514 VanDerWaalsContact C-N 3.32Å; S514-G516 VanDerWaalsContact C-N 3.33Å; S514-G516 PolarHBondContact O-N 3.27Å; S514-L517 PolarHBondContact O-N 3.5Å; S514-M518 VanDerWaalsContact O-CB 3.29Å; S514-M518 WeakPolarHBondContact O-CB 3.46Å; S514-M518 WeakPolarHBondContact O-CG 3.04Å; S514-M518 PolarHBondContact O-N 2.69Å
515L98.3Very high96.3Very high0 Ų014.7 Ų14.70%08%0.08CC..Hα-helixtrans-57.1-46.5174.3-65.7178.3000111.7C450 Q454 F455 L461 H511 L517 M518 Y519C450-L515 HydrophobicContact CB-CD2 4.38Å; Q454-L515 HydrophobicContact CB-CD2 4.22Å; Q454-L515 HydrophobicContact CG-CD2 4.4Å; F455-L515 WeakPolarHBondContact O-CD1 3.17Å; L461-L515 HydrophobicContact CD1-CB 3.96Å; L461-L515 HydrophobicContact CD1-CD1 3.89Å; L461-L515 HydrophobicContact CD2-CB 3.97Å; H511-L515 WeakPolarHBondContact O-CG 3.46Å; H511-L515 PolarHBondContact O-N 2.89Å; L515-L517 PolarHBondContact O-N 2.98Å; L515-M518 PolarHBondContact O-N 3.48Å; L515-Y519 HydrophobicContact CB-CD2 4.17Å; L515-Y519 HydrophobicContact CB-CE2 3.78Å; L515-Y519 HydrophobicContact CD2-CE2 4.26Å; L515-Y519 HydrophobicContact CG-CE2 4.42Å; L515-Y519 VanDerWaalsContact O-CB 3.29Å; L515-Y519 WeakPolarHBondContact O-CB 3.42Å; L515-Y519 WeakPolarHBondContact O-CD2 3.36Å; L515-Y519 PolarHBondContact O-N 2.81Å
516G97.9Very high95.6Very high0 Ų017.3 Ų17.30%010%0.097CC..Hα-helixtrans-58.4-47.8178.400000112.7L512 A513 S514 M518 Y519 A520L512-G516 PolarHBondContact O-N 2.77Å; A513-G516 PolarHBondContact O-N 3.24Å; S514-G516 VanDerWaalsContact C-N 3.33Å; S514-G516 PolarHBondContact O-N 3.27Å; G516-M518 PolarHBondContact O-N 3.22Å; G516-Y519 PolarHBondContact O-N 3.26Å; G516-A520 WeakPolarHBondContact O-CB 3.45Å; G516-A520 PolarHBondContact O-N 3.26Å
517L97.7Very high94.9Very high2 Ų219.1 Ų19.11%0.0111%0.106CC..Hα-helixtrans-71.6-26.3179.9-78.9161.2000113.6F142 I157 I398 A513 S514 L515 P521 L540F142-L517 HydrophobicContact CD1-CD2 4.05Å; F142-L517 HydrophobicContact CE1-CB 4.41Å; F142-L517 HydrophobicContact CE1-CD1 3.98Å; F142-L517 HydrophobicContact CE1-CD2 3.93Å; F142-L517 HydrophobicContact CE1-CG 4.33Å; F142-L517 HydrophobicContact CZ-CD1 3.99Å; F142-L517 HydrophobicContact CZ-CD2 4.37Å; I157-L517 HydrophobicContact CD1-CB 3.59Å; I157-L517 HydrophobicContact CD1-CD1 3.33Å; I157-L517 HydrophobicContact CD1-CG 4.08Å; I157-L517 HydrophobicContact CG1-CD1 3.77Å; I398-L517 HydrophobicContact CD1-CD2 3.82Å; I398-L517 HydrophobicContact CD1-CG 3.81Å; I398-L517 HydrophobicContact CG1-CG 4.09Å; I398-L517 HydrophobicContact CG2-CG 4.44Å; A513-L517 PolarHBondContact O-N 3.02Å; S514-L517 PolarHBondContact O-N 3.5Å; L515-L517 PolarHBondContact O-N 2.98Å; L517-P521 WeakPolarHBondContact O-CD 3.36Å; L517-L540 HydrophobicContact CD1-CD1 4.08Å
518M97Very high94.4Very high1 Ų117.2 Ų17.21%0.00510%0.095CC..Hα-helixtrans-75.5-42.1172.3-73.2171.57600111.8M150 N154 C450 Q454 S514 L515 G516 R522M150-M518 HydrophobicContact CB-CB 4.04Å; M150-M518 HydrophobicContact CB-CE 3.62Å; M150-M518 HydrophobicContact CB-CG 4.18Å; M150-M518 HydrophobicContact CG-CB 4.34Å; M150-M518 HydrophobicContact SD-CB 4.22Å; N154-M518 HydrophobicContact CB-CE 4.49Å; N154-M518 HydrophobicContact CB-CG 4.09Å; N154-M518 HydrophobicContact CB-SD 3.73Å; C450-M518 HydrophobicContact CB-SD 4.13Å; Q454-M518 HydrophobicContact CG-CE 4.45Å; Q454-M518 VanDerWaalsContact NE2-CE 3.32Å; S514-M518 VanDerWaalsContact O-CB 3.29Å; S514-M518 WeakPolarHBondContact O-CB 3.46Å; S514-M518 WeakPolarHBondContact O-CG 3.04Å; S514-M518 PolarHBondContact O-N 2.69Å; L515-M518 PolarHBondContact O-N 3.48Å; G516-M518 PolarHBondContact O-N 3.22Å; M518-R522 WeakPolarHBondContact O-CG 3.4Å
519Y97.8Very high94.1Very high6 Ų616.4 Ų16.42%0.0249%0.09CC..Hα-helixtrans-77.6-35.6-176.7-63.6-25.4000113.1M150 Q454 P456 P458 L461 L515 G516 R522 C523M150-Y519 HydrophobicContact SD-CD1 4.14Å; M150-Y519 HydrophobicContact SD-CE1 4.49Å; Q454-Y519 PolarHBondContact O-OH 3.48Å; P456-Y519 WeakPolarHBondContact O-CE2 3.25Å; P456-Y519 PolarHBondContact O-OH 3.08Å; P458-Y519 HydrophobicContact CB-CD2 3.71Å; P458-Y519 HydrophobicContact CB-CE2 4.17Å; P458-Y519 HydrophobicContact CB-CG 3.9Å; L461-Y519 HydrophobicContact CD2-CD2 4.04Å; L461-Y519 HydrophobicContact CD2-CE2 4.37Å; L515-Y519 HydrophobicContact CB-CD2 4.17Å; L515-Y519 HydrophobicContact CB-CE2 3.78Å; L515-Y519 HydrophobicContact CD2-CE2 4.26Å; L515-Y519 HydrophobicContact CG-CE2 4.42Å; L515-Y519 VanDerWaalsContact O-CB 3.29Å; L515-Y519 WeakPolarHBondContact O-CB 3.42Å; L515-Y519 WeakPolarHBondContact O-CD2 3.36Å; L515-Y519 PolarHBondContact O-N 2.81Å; G516-Y519 PolarHBondContact O-N 3.26Å; Y519-R522 WeakPolarHBondContact O-CA 3.44Å; Y519-R522 WeakPolarHBondContact O-CB 3.49Å; Y519-R522 PolarHBondContact O-N 3.29Å; Y519-C523 PolarHBondContact O-N 3.38Å; Y519-C523 PolarHBondContact O-SG 3.02Å; Y519-C523 VanDerWaalsContact O-SG 3.36Å
520A97Very high93.8Very high1 Ų117 Ų171%0.0089%0.094CC..G310 helixtrans-52.9-47.6-175.900000113.5C391 Q394 I398 G516 R522 C523C391-A520 HydrophobicContact CB-CB 4.22Å; C391-A520 VanDerWaalsContact CB-O 3.29Å; C391-A520 WeakPolarHBondContact CB-O 3.3Å; Q394-A520 HydrophobicContact CB-CB 3.76Å; I398-A520 HydrophobicContact CD1-CB 4.39Å; G516-A520 WeakPolarHBondContact O-CB 3.45Å; G516-A520 PolarHBondContact O-N 3.26Å; A520-R522 VanDerWaalsContact C-N 3.25Å; A520-R522 PolarHBondContact O-N 2.9Å; A520-C523 PolarHBondContact O-N 3.02Å
521P93.9Very high93.6Very high3 Ų317 Ų172%0.0199%0.094CC..G310 helixtrans-63.9-26.4174.4-25.437000115.1A146 L517 C524 A529A146-P521 HydrophobicContact CB-CB 3.73Å; A146-P521 HydrophobicContact CB-CG 3.45Å; A146-P521 VanDerWaalsContact CB-CG 3.45Å; L517-P521 WeakPolarHBondContact O-CD 3.36Å; P521-C524 PolarHBondContact O-N 3.17Å; P521-A529 HydrophobicContact CB-CB 4.14Å
522R93.8Very high93.4Very high87 Ų8715.9 Ų15.933%0.3289%0.089SC..G310 helixtrans-86.2-17.6-174.9-61.5-69.4160.2159.9-8.5113.4L148 M150 E300 M518 Y519 A520 C524L148-R522 PolarHBondContact O-NH2 3.2Å; M150-R522 HydrophobicContact CG-CG 3.58Å; M150-R522 HydrophobicContact SD-CG 3.67Å; E300-R522 IonicContact OE2-NH1 3.58Å; M518-R522 WeakPolarHBondContact O-CG 3.4Å; Y519-R522 WeakPolarHBondContact O-CA 3.44Å; Y519-R522 WeakPolarHBondContact O-CB 3.49Å; Y519-R522 PolarHBondContact O-N 3.29Å; A520-R522 VanDerWaalsContact C-N 3.25Å; A520-R522 PolarHBondContact O-N 2.9Å; R522-C524 PolarHBondContact O-N 3.17Å
523C92.1Very high93.3Very high42 Ų4215.6 Ų15.628%0.2849%0.087SC..G310 helixtrans-67.8-16.1167-61.30000112.3E390 C391 Y519 A520E390-C523 WeakPolarHBondContact O-CB 3.32Å; C391-C523 HydrophobicContact CB-CB 4.36Å; Y519-C523 PolarHBondContact O-N 3.38Å; Y519-C523 PolarHBondContact O-SG 3.02Å; Y519-C523 VanDerWaalsContact O-SG 3.36Å; A520-C523 PolarHBondContact O-N 3.02Å
524C89.3Confident93.2Very high14 Ų1416 Ų1610%0.0959%0.089CC..SBendtrans-111.9158.4-174.9-63.70000112.5E390 P521 R522 R528 A532E390-C524 VanDerWaalsContact OE2-CA 3.32Å; E390-C524 WeakPolarHBondContact OE2-CA 3.32Å; E390-C524 PolarHBondContact OE2-SG 3.37Å; P521-C524 PolarHBondContact O-N 3.17Å; R522-C524 PolarHBondContact O-N 3.17Å; C524-R528 HydrophobicContact CB-CB 4.17Å; C524-A532 HydrophobicContact CB-CB 4.3Å
525S86.5Confident93.1Very high32 Ų3216 Ų1622%0.2249%0.089CC..  trans-63.6151.9171.354.60000111.4D527 R528 A529S525-D527 WeakPolarHBondContact CB-OD1 3.45Å; S525-D527 PolarHBondContact O-N 3.33Å; S525-D527 VanDerWaalsContact O-N 3.1Å; S525-D527 PolarHBondContact OG-OD1 3.3Å; S525-R528 PolarHBondContact O-N 3.22Å; S525-R528 PolarHBondContact OG-NE 2.78Å; S525-R528 PolarHBondContact OG-NH2 3.22Å; S525-A529 PolarHBondContact O-N 2.87Å; S525-A529 VanDerWaalsContact O-N 3.08Å
526P84.2Confident93.1Very high55 Ų5516 Ų1636%0.3579%0.089SC..THydrogen-bonded Turntrans-52.9-36-175.2-30.236.7000114.3R226 R528 A529R226-P526 HydrophobicContact CB-CB 4.48Å; R226-P526 VanDerWaalsContact CD-O 3.32Å; R226-P526 WeakPolarHBondContact CD-O 3.46Å; R226-P526 HydrophobicContact CG-CB 3.98Å; R226-P526 PolarHBondContact NE-O 3.28Å; P526-R528 PolarHBondContact O-N 3.36Å; P526-A529 PolarHBondContact O-N 3.47Å
527D83.2Confident93.1Very high37 Ų3716 Ų1620%0.1989%0.089CC..THydrogen-bonded Turntrans-60.4-22.9173.362.2-52.4000115R226 N230 S525R226-D527 VanDerWaalsContact NE-CA 3.35Å; R226-D527 VanDerWaalsContact NH2-C 3.27Å; R226-D527 PolarHBondContact NH2-O 3.35Å; N230-D527 WeakPolarHBondContact OD1-CB 3.4Å; S525-D527 WeakPolarHBondContact CB-OD1 3.45Å; S525-D527 PolarHBondContact O-N 3.33Å; S525-D527 VanDerWaalsContact O-N 3.1Å; S525-D527 PolarHBondContact OG-OD1 3.3Å
528R88.5Confident93.1Very high16 Ų1617 Ų176%0.069%0.094CC..THydrogen-bonded Turntrans-111.3-8.9-178.9-70.9171.6-51.4120.4-7.1113.3K383 T387 E390 C524 S525 P526 L531 A532K383-R528 HydrophobicContact CG-CG 4.24Å; T387-R528 HydrophobicContact CG2-CB 4.31Å; T387-R528 WeakPolarHBondContact OG1-CD 3.44Å; T387-R528 PolarHBondContact OG1-NH1 3.41Å; E390-R528 VanDerWaalsContact CD-NH1 3.32Å; E390-R528 IonicContact OE1-CZ 2.69Å; E390-R528 IonicContact OE1-NH1 2.78Å; E390-R528 PolarHBondContact OE1-NH1 2.91Å; E390-R528 IonicContact OE1-NH2 2.78Å; E390-R528 PolarHBondContact OE1-NH2 2.89Å; E390-R528 IonicContact OE2-CZ 3.49Å; E390-R528 IonicContact OE2-NH1 2.66Å; E390-R528 PolarHBondContact OE2-NH1 3.21Å; E390-R528 IonicContact OE2-NH2 2.88Å; E390-R528 PolarHBondContact OE2-NH2 3.2Å; C524-R528 HydrophobicContact CB-CB 4.17Å; S525-R528 PolarHBondContact O-N 3.22Å; S525-R528 PolarHBondContact OG-NE 2.78Å; S525-R528 PolarHBondContact OG-NH2 3.22Å; P526-R528 PolarHBondContact O-N 3.36Å; R528-L531 WeakPolarHBondContact O-CA 3.32Å; R528-L531 WeakPolarHBondContact O-CB 3.36Å; R528-L531 PolarHBondContact O-N 3.25Å; R528-A532 PolarHBondContact O-N 3.05Å
529A91Very high93.2Very high8 Ų818.8 Ų18.87%0.06610%0.102CC..Hα-helixtrans-50.5-45.2178.500000113.9A146 P521 S525 P526 L531 A532 G533A146-A529 VanDerWaalsContact CB-O 3.29Å; A146-A529 WeakPolarHBondContact CB-O 3.36Å; P521-A529 HydrophobicContact CB-CB 4.14Å; S525-A529 PolarHBondContact O-N 2.87Å; S525-A529 VanDerWaalsContact O-N 3.08Å; P526-A529 PolarHBondContact O-N 3.47Å; A529-L531 VanDerWaalsContact C-N 3.33Å; A529-L531 PolarHBondContact O-N 3.07Å; A529-A532 WeakPolarHBondContact O-CB 3.43Å; A529-A532 PolarHBondContact O-N 2.96Å; A529-G533 PolarHBondContact O-N 3.22Å
530P92.2Very high93.2Very high16 Ų1619 Ų1910%0.10410%0.103CC..Hα-helixtrans-61-37.8174.7-29.239.6000114.4G143 R226 G533 M534G143-P530 WeakPolarHBondContact CA-O 3.46Å; G143-P530 WeakPolarHBondContact O-CA 3.26Å; G143-P530 VanDerWaalsContact O-CB 3.25Å; G143-P530 WeakPolarHBondContact O-CB 3.48Å; R226-P530 VanDerWaalsContact NH2-CD 3.32Å; P530-G533 PolarHBondContact O-N 3.23Å; P530-M534 WeakPolarHBondContact O-CG 3.02Å; P530-M534 PolarHBondContact O-N 3.33Å
531L92.3Very high93.3Very high3 Ų319.1 Ų19.12%0.01610%0.103CC..Hα-helixtrans-68.1-41.4177.2175.960.8000110.4K383 Y384 T387 R528 A529 G533 M534 F535K383-L531 HydrophobicContact CG-CD2 4.23Å; Y384-L531 HydrophobicContact CD1-CD1 3.96Å; Y384-L531 HydrophobicContact CD1-CD2 4.03Å; Y384-L531 HydrophobicContact CE1-CD1 3.5Å; Y384-L531 HydrophobicContact CE1-CD2 4.1Å; Y384-L531 HydrophobicContact CE1-CG 4.45Å; Y384-L531 HydrophobicContact CG-CD2 4.29Å; T387-L531 HydrophobicContact CG2-CB 4.36Å; T387-L531 HydrophobicContact CG2-CD2 4.18Å; T387-L531 HydrophobicContact CG2-CG 4.05Å; R528-L531 WeakPolarHBondContact O-CA 3.32Å; R528-L531 WeakPolarHBondContact O-CB 3.36Å; R528-L531 PolarHBondContact O-N 3.25Å; A529-L531 VanDerWaalsContact C-N 3.33Å; A529-L531 PolarHBondContact O-N 3.07Å; L531-G533 VanDerWaalsContact C-N 3.32Å; L531-G533 PolarHBondContact O-N 2.91Å; L531-M534 PolarHBondContact O-N 3.24Å; L531-F535 HydrophobicContact CD1-CD2 4.36Å; L531-F535 HydrophobicContact CD1-CE2 3.94Å; L531-F535 HydrophobicContact CD1-CZ 4.08Å; L531-F535 HydrophobicContact CD2-CE2 4.1Å; L531-F535 HydrophobicContact CG-CD2 4.08Å; L531-F535 HydrophobicContact CG-CE2 3.67Å; L531-F535 HydrophobicContact CG-CZ 4.26Å; L531-F535 WeakPolarHBondContact O-CD2 3.25Å; L531-F535 PolarHBondContact O-N 2.51Å
532A94.4Very high93.5Very high0 Ų020.9 Ų20.90%011%0.113CC..Hα-helixtrans-62.2-36.8172.800000112.7T387 C391 C524 R528 A529 F535 G536T387-A532 HydrophobicContact CG2-CB 3.87Å; C391-A532 HydrophobicContact CB-CB 4.14Å; C524-A532 HydrophobicContact CB-CB 4.3Å; R528-A532 PolarHBondContact O-N 3.05Å; A529-A532 WeakPolarHBondContact O-CB 3.43Å; A529-A532 PolarHBondContact O-N 2.96Å; A532-F535 PolarHBondContact O-N 3.18Å; A532-G536 PolarHBondContact O-N 2.89Å
533G95.7Very high93.7Very high3 Ų316.8 Ų16.83%0.03110%0.097CC..Hα-helixtrans-62.6-4417100000112.9F142 A529 P530 L531 F535 G536 A537F142-G533 WeakPolarHBondContact CB-O 3.38Å; A529-G533 PolarHBondContact O-N 3.22Å; P530-G533 PolarHBondContact O-N 3.23Å; L531-G533 VanDerWaalsContact C-N 3.32Å; L531-G533 PolarHBondContact O-N 2.91Å; G533-F535 VanDerWaalsContact C-N 3.34Å; G533-F535 PolarHBondContact O-N 3.41Å; G533-G536 PolarHBondContact O-N 2.69Å; G533-A537 PolarHBondContact O-N 3.06Å
534M95.9Very high93.9Very high9 Ų915.8 Ų15.84%0.0449%0.09CC..Hα-helixtrans-63.3-39.4174.2-68.4-177.1-170.100112T75 Q78 T139 L140 P530 L531 A537 F538T75-M534 HydrophobicContact CG2-CB 3.95Å; Q78-M534 HydrophobicContact CG-SD 4.46Å; Q78-M534 PolarHBondContact NE2-SD 3.31Å; T139-M534 VanDerWaalsContact O-CG 3.3Å; T139-M534 WeakPolarHBondContact O-CG 3.4Å; L140-M534 HydrophobicContact CD2-CE 3.92Å; P530-M534 WeakPolarHBondContact O-CG 3.02Å; P530-M534 PolarHBondContact O-N 3.33Å; L531-M534 PolarHBondContact O-N 3.24Å; M534-A537 PolarHBondContact O-N 3.24Å; M534-F538 WeakPolarHBondContact O-CB 3.43Å; M534-F538 PolarHBondContact O-N 2.88Å
535F97Very high94.2Very high0 Ų017 Ų170%09%0.093CC..Hα-helixtrans-60.9-45.4171.5-74.8-47.3000112.2T75 F76 Y384 T387 M388 L531 A532 G533 A537 F538 F539T75-F535 HydrophobicContact CG2-CD1 3.47Å; T75-F535 VanDerWaalsContact CG2-CD1 3.47Å; T75-F535 HydrophobicContact CG2-CE1 3.7Å; T75-F535 HydrophobicContact CG2-CG 4.26Å; F76-F535 HydrophobicContact CD1-CE1 4.13Å; F76-F535 AromaticContact CE1-CE1 3.5Å; F76-F535 HydrophobicContact CE1-CE1 3.5Å; F76-F535 VanDerWaalsContact CE1-CE1 3.5Å; F76-F535 HydrophobicContact CE1-CZ 4.18Å; F76-F535 HydrophobicContact CZ-CD1 4.39Å; F76-F535 AromaticContact CZ-CE1 3.77Å; F76-F535 HydrophobicContact CZ-CE1 3.77Å; Y384-F535 HydrophobicContact CD1-CE1 4.39Å; Y384-F535 AromaticContact CD1-CZ 3.72Å; Y384-F535 HydrophobicContact CD1-CZ 3.72Å; Y384-F535 HydrophobicContact CE1-CZ 4.5Å; T387-F535 HydrophobicContact CG2-CD2 3.83Å; T387-F535 HydrophobicContact CG2-CE2 3.76Å; M388-F535 HydrophobicContact CG-CD1 4.47Å; M388-F535 HydrophobicContact CG-CD2 4.21Å; M388-F535 HydrophobicContact CG-CE1 3.93Å; M388-F535 HydrophobicContact CG-CE2 3.61Å; M388-F535 HydrophobicContact CG-CZ 3.43Å; M388-F535 VanDerWaalsContact CG-CZ 3.43Å; M388-F535 HydrophobicContact SD-CB 4.2Å; M388-F535 HydrophobicContact SD-CD1 3.46Å; M388-F535 WeakPolarHBondContact SD-CD1 3.2Å; M388-F535 HydrophobicContact SD-CD2 3.54Å; M388-F535 VanDerWaalsContact SD-CD2 3.54Å; M388-F535 HydrophobicContact SD-CE1 3.51Å; M388-F535 VanDerWaalsContact SD-CE1 3.51Å; M388-F535 HydrophobicContact SD-CE2 3.56Å; M388-F535 VanDerWaalsContact SD-CE2 3.56Å; M388-F535 HydrophobicContact SD-CG 3.49Å; M388-F535 WeakPolarHBondContact SD-CG 3.09Å; M388-F535 HydrophobicContact SD-CZ 3.53Å; M388-F535 VanDerWaalsContact SD-CZ 3.53Å; L531-F535 HydrophobicContact CD1-CD2 4.36Å; L531-F535 HydrophobicContact CD1-CE2 3.94Å; L531-F535 HydrophobicContact CD1-CZ 4.08Å; L531-F535 HydrophobicContact CD2-CE2 4.1Å; L531-F535 HydrophobicContact CG-CD2 4.08Å; L531-F535 HydrophobicContact CG-CE2 3.67Å; L531-F535 HydrophobicContact CG-CZ 4.26Å; L531-F535 WeakPolarHBondContact O-CD2 3.25Å; L531-F535 PolarHBondContact O-N 2.51Å; A532-F535 PolarHBondContact O-N 3.18Å; G533-F535 VanDerWaalsContact C-N 3.34Å; G533-F535 PolarHBondContact O-N 3.41Å; F535-A537 VanDerWaalsContact C-N 3.31Å; F535-A537 PolarHBondContact O-N 3.16Å; F535-F538 PolarHBondContact O-N 3.12Å; F535-F538 VanDerWaalsContact O-N 3.16Å; F535-F539 WeakPolarHBondContact O-CD2 3.19Å; F535-F539 PolarHBondContact O-N 2.88Å
536G97.9Very high94.7Very high0 Ų017.2 Ų17.20%09%0.094CC..Hα-helixtrans-55.3-46.4175.300000112.4A532 G533 F539 L540A532-G536 PolarHBondContact O-N 2.89Å; G533-G536 PolarHBondContact O-N 2.69Å; G536-F539 PolarHBondContact O-N 3.22Å; G536-L540 WeakPolarHBondContact O-CB 3.33Å; G536-L540 PolarHBondContact O-N 2.88Å
537A97.9Very high95.4Very high0 Ų014.6 Ų14.60%08%0.077CC..Hα-helixtrans-64.6-40.9175.800000113.1T139 F142 G533 M534 F535 L540 I541T139-A537 HydrophobicContact CG2-CB 3.87Å; F142-A537 HydrophobicContact CB-CB 3.87Å; F142-A537 HydrophobicContact CD2-CB 3.55Å; F142-A537 HydrophobicContact CE2-CB 4.41Å; F142-A537 HydrophobicContact CG-CB 3.96Å; G533-A537 PolarHBondContact O-N 3.06Å; M534-A537 PolarHBondContact O-N 3.24Å; F535-A537 VanDerWaalsContact C-N 3.31Å; F535-A537 PolarHBondContact O-N 3.16Å; A537-L540 WeakPolarHBondContact O-CB 3.41Å; A537-L540 PolarHBondContact O-N 3.18Å; A537-I541 WeakPolarHBondContact O-CG1 3.45Å; A537-I541 PolarHBondContact O-N 3.41Å
538F97.9Very high95.9Very high25 Ų2514.4 Ų14.411%0.118%0.077CC..Hα-helixtrans-62-45.5175.2167.1-106.6000111.8L68 A71 A72 T75 F76 M534 F535 L540 I541 L542L68-F538 HydrophobicContact CD1-CD2 4.17Å; L68-F538 HydrophobicContact CD1-CE2 3.62Å; L68-F538 HydrophobicContact CD1-CZ 4.41Å; A71-F538 HydrophobicContact CB-CD2 4.43Å; A72-F538 HydrophobicContact CB-CD2 4.16Å; A72-F538 HydrophobicContact CB-CE2 3.71Å; T75-F538 HydrophobicContact CG2-CB 4.42Å; F76-F538 HydrophobicContact CE2-CD1 4.2Å; F76-F538 AromaticContact CE2-CE1 3.95Å; F76-F538 HydrophobicContact CE2-CE1 3.95Å; F76-F538 HydrophobicContact CE2-CE2 4.47Å; F76-F538 HydrophobicContact CE2-CZ 4.09Å; F76-F538 HydrophobicContact CZ-CD1 4.48Å; F76-F538 HydrophobicContact CZ-CE1 4.23Å; M534-F538 WeakPolarHBondContact O-CB 3.43Å; M534-F538 PolarHBondContact O-N 2.88Å; F535-F538 PolarHBondContact O-N 3.12Å; F535-F538 VanDerWaalsContact O-N 3.16Å; F538-L540 VanDerWaalsContact C-N 3.32Å; F538-L540 PolarHBondContact O-N 3.23Å; F538-I541 PolarHBondContact O-N 3.15Å; F538-L542 WeakPolarHBondContact O-CB 3.25Å; F538-L542 PolarHBondContact O-N 3.38Å
539F98.6Very high96Very high38 Ų3816.9 Ų16.917%0.1679%0.087CC..Hα-helixtrans-69.7-28.3178.1-86-99.8000112.8M388 C395 W399 F535 G536 L542 G543M388-F539 HydrophobicContact CE-CE2 3.6Å; M388-F539 HydrophobicContact CE-CZ 3.68Å; M388-F539 HydrophobicContact SD-CE2 4.19Å; C395-F539 HydrophobicContact CB-CB 4.19Å; C395-F539 HydrophobicContact CB-CD1 3.94Å; C395-F539 HydrophobicContact CB-CD2 3.67Å; C395-F539 HydrophobicContact CB-CE1 4.24Å; C395-F539 HydrophobicContact CB-CE2 3.98Å; C395-F539 HydrophobicContact CB-CG 3.66Å; C395-F539 HydrophobicContact CB-CZ 4.26Å; C395-F539 WeakPolarHBondContact O-CB 3.42Å; C395-F539 WeakPolarHBondContact O-CD1 3.3Å; W399-F539 WeakPolarHBondContact CA-O 3.29Å; W399-F539 HydrophobicContact CB-CB 4.26Å; W399-F539 HydrophobicContact CB-CD1 3.88Å; F535-F539 WeakPolarHBondContact O-CD2 3.19Å; F535-F539 PolarHBondContact O-N 2.88Å; G536-F539 PolarHBondContact O-N 3.22Å; F539-L542 HydrophobicContact CD1-CD2 4.22Å; F539-L542 HydrophobicContact CE1-CD2 4.31Å; F539-G543 PolarHBondContact O-N 3.02Å
540L98.3Very high96.2Very high10 Ų1017.9 Ų17.95%0.05210%0.095CC..Hα-helixtrans-59.5-54.3166.3174.6165.7000110.4Q138 I398 Y402 L517 G536 A537 F538 L542 G543 V544Q138-L540 VanDerWaalsContact NE2-CD2 3.29Å; I398-L540 HydrophobicContact CG2-CB 3.81Å; Y402-L540 HydrophobicContact CD1-CG 4.16Å; Y402-L540 HydrophobicContact CD2-CB 3.98Å; Y402-L540 HydrophobicContact CD2-CD1 4.29Å; Y402-L540 HydrophobicContact CD2-CG 3.65Å; Y402-L540 HydrophobicContact CE1-CD1 4.08Å; Y402-L540 HydrophobicContact CE1-CD2 4.44Å; Y402-L540 HydrophobicContact CE1-CG 3.9Å; Y402-L540 HydrophobicContact CE2-CB 3.93Å; Y402-L540 HydrophobicContact CE2-CD1 3.5Å; Y402-L540 VanDerWaalsContact CE2-CD1 3.5Å; Y402-L540 HydrophobicContact CE2-CG 3.38Å; Y402-L540 HydrophobicContact CG-CG 4.05Å; Y402-L540 VanDerWaalsContact OH-CD1 3.28Å; Y402-L540 WeakPolarHBondContact OH-CD1 3.46Å; L517-L540 HydrophobicContact CD1-CD1 4.08Å; G536-L540 WeakPolarHBondContact O-CB 3.33Å; G536-L540 PolarHBondContact O-N 2.88Å; A537-L540 WeakPolarHBondContact O-CB 3.41Å; A537-L540 PolarHBondContact O-N 3.18Å; F538-L540 VanDerWaalsContact C-N 3.32Å; F538-L540 PolarHBondContact O-N 3.23Å; L540-L542 VanDerWaalsContact C-N 3.28Å; L540-L542 PolarHBondContact O-N 3.45Å; L540-G543 WeakPolarHBondContact O-CA 3.47Å; L540-G543 PolarHBondContact O-N 3.32Å; L540-V544 HydrophobicContact CD2-CG2 4.04Å; L540-V544 WeakPolarHBondContact O-CG2 3.49Å; L540-V544 PolarHBondContact O-N 3.33Å
541I97.8Very high96.4Very high3 Ų317.5 Ų17.52%0.0159%0.092CC..Hα-helixtrans-63-38.2-178.7-63.2165.7000110.4L68 A71 T139 A537 F538 G543 V544 F545L68-I541 HydrophobicContact CB-CG2 4.02Å; L68-I541 HydrophobicContact CD1-CG2 4.12Å; A71-I541 HydrophobicContact CB-CD1 3.45Å; A71-I541 VanDerWaalsContact CB-CD1 3.45Å; T139-I541 HydrophobicContact CG2-CD1 4.48Å; A537-I541 WeakPolarHBondContact O-CG1 3.45Å; A537-I541 PolarHBondContact O-N 3.41Å; F538-I541 PolarHBondContact O-N 3.15Å; I541-G543 VanDerWaalsContact C-N 3.32Å; I541-G543 PolarHBondContact O-N 3Å; I541-V544 PolarHBondContact O-N 3.07Å; I541-F545 WeakPolarHBondContact O-CB 3.46Å; I541-F545 PolarHBondContact O-N 3.13Å
542L98.2Very high96.4Very high41 Ų4121.3 Ų21.322%0.21511%0.107CC..Hα-helixtrans-61.1-40.9172.7-177.563.8000111.8L68 F538 F539 L540 F545 T546L68-L542 HydrophobicContact CD1-CB 4.08Å; L68-L542 HydrophobicContact CD1-CD1 4.14Å; L68-L542 HydrophobicContact CD2-CD1 4.17Å; F538-L542 WeakPolarHBondContact O-CB 3.25Å; F538-L542 PolarHBondContact O-N 3.38Å; F539-L542 HydrophobicContact CD1-CD2 4.22Å; F539-L542 HydrophobicContact CE1-CD2 4.31Å; L540-L542 VanDerWaalsContact C-N 3.28Å; L540-L542 PolarHBondContact O-N 3.45Å; L542-F545 PolarHBondContact O-N 3.45Å; L542-T546 HydrophobicContact CD1-CG2 4.16Å; L542-T546 WeakPolarHBondContact O-CB 3.44Å; L542-T546 WeakPolarHBondContact O-CG2 3.46Å; L542-T546 PolarHBondContact O-N 3.46Å; L542-T546 PolarHBondContact O-OG1 3.2Å
543G98.3Very high96.3Very high0 Ų023.1 Ų23.10%013%0.125CC..Hα-helixtrans-65.5-43.1176.700000111.8W399 F403 F539 L540 I541 T546 G547W399-G543 VanDerWaalsContact CD1-CA 3.41Å; F403-G543 WeakPolarHBondContact CA-O 3.33Å; F403-G543 PolarHBondContact N-O 3.17Å; F539-G543 PolarHBondContact O-N 3.02Å; L540-G543 WeakPolarHBondContact O-CA 3.47Å; L540-G543 PolarHBondContact O-N 3.32Å; I541-G543 VanDerWaalsContact C-N 3.32Å; I541-G543 PolarHBondContact O-N 3Å; G543-T546 PolarHBondContact O-OG1 2.86Å; G543-G547 PolarHBondContact O-N 3.15Å
544V96.2Very high96.2Very high21 Ų2124.3 Ų24.313%0.12713%0.131CC..Hα-helixtrans-60.5-51173.5173.40000110.6Y402 L406 L540 I541 G547 V548Y402-V544 HydrophobicContact CD1-CG2 3.91Å; Y402-V544 HydrophobicContact CG-CG2 4.35Å; L406-V544 HydrophobicContact CD2-CG2 4.03Å; L406-V544 HydrophobicContact CG-CB 4.39Å; L406-V544 HydrophobicContact CG-CG1 4.21Å; L406-V544 HydrophobicContact CG-CG2 4.27Å; L540-V544 HydrophobicContact CD2-CG2 4.04Å; L540-V544 WeakPolarHBondContact O-CG2 3.49Å; L540-V544 PolarHBondContact O-N 3.33Å; I541-V544 PolarHBondContact O-N 3.07Å; V544-G547 PolarHBondContact O-N 3.03Å; V544-V548 HydrophobicContact CG1-CG2 4.5Å; V544-V548 WeakPolarHBondContact O-CB 3.33Å; V544-V548 VanDerWaalsContact O-CG2 3.26Å; V544-V548 WeakPolarHBondContact O-CG2 3.46Å; V544-V548 PolarHBondContact O-N 3.47Å
545F96.3Very high96Very high39 Ų3924.8 Ų24.817%0.17113%0.133CC..Hα-helixtrans-54.1-62.5177.7177.8-91.7000110Q64 F65 L68 I541 L542 G547 V548 Y549Q64-F545 HydrophobicContact CB-CD2 4.13Å; F65-F545 HydrophobicContact CB-CE2 4.07Å; F65-F545 AromaticContact CD2-CE2 3.85Å; F65-F545 HydrophobicContact CD2-CE2 3.85Å; F65-F545 HydrophobicContact CD2-CZ 4.19Å; F65-F545 HydrophobicContact CG-CE2 4.48Å; L68-F545 HydrophobicContact CD2-CB 4.09Å; L68-F545 HydrophobicContact CD2-CD1 3.8Å; L68-F545 HydrophobicContact CD2-CD2 3.91Å; L68-F545 HydrophobicContact CD2-CE1 4.2Å; L68-F545 HydrophobicContact CD2-CE2 4.3Å; L68-F545 HydrophobicContact CD2-CG 3.66Å; L68-F545 HydrophobicContact CD2-CZ 4.44Å; I541-F545 WeakPolarHBondContact O-CB 3.46Å; I541-F545 PolarHBondContact O-N 3.13Å; L542-F545 PolarHBondContact O-N 3.45Å; F545-G547 VanDerWaalsContact C-N 3.34Å; F545-G547 PolarHBondContact O-N 3.37Å; F545-V548 PolarHBondContact O-N 3.47Å; F545-Y549 HydrophobicContact CD1-CD2 4.04Å; F545-Y549 HydrophobicContact CD1-CE2 4.01Å; F545-Y549 HydrophobicContact CD2-CD2 4.39Å; F545-Y549 AromaticContact CD2-CE2 3.62Å; F545-Y549 HydrophobicContact CD2-CE2 3.62Å; F545-Y549 AromaticContact CE1-CD2 3.88Å; F545-Y549 HydrophobicContact CE1-CD2 3.88Å; F545-Y549 AromaticContact CE1-CE2 3.72Å; F545-Y549 HydrophobicContact CE1-CE2 3.72Å; F545-Y549 HydrophobicContact CE2-CD2 4.25Å; F545-Y549 AromaticContact CE2-CE2 3.3Å; F545-Y549 HydrophobicContact CE2-CE2 3.3Å; F545-Y549 AromaticContact CE2-CZ 3.89Å; F545-Y549 HydrophobicContact CG-CD2 4.28Å; F545-Y549 AromaticContact CG-CE2 3.95Å; F545-Y549 HydrophobicContact CG-CE2 3.95Å; F545-Y549 AromaticContact CZ-CD2 3.98Å; F545-Y549 HydrophobicContact CZ-CD2 3.98Å; F545-Y549 AromaticContact CZ-CE2 3.35Å; F545-Y549 HydrophobicContact CZ-CE2 3.35Å; F545-Y549 AromaticContact CZ-CZ 3.94Å; F545-Y549 WeakPolarHBondContact O-CD2 3.41Å; F545-Y549 PolarHBondContact O-N 2.78Å
546T97.3Very high95.6Very high38 Ų3828.5 Ų28.523%0.23316%0.159CC..Hα-helixtrans-60.9-37.9-176.350.80000113.3W399 L542 G543 Y549 A550W399-T546 PolarHBondContact NE1-OG1 3.37Å; L542-T546 HydrophobicContact CD1-CG2 4.16Å; L542-T546 WeakPolarHBondContact O-CB 3.44Å; L542-T546 WeakPolarHBondContact O-CG2 3.46Å; L542-T546 PolarHBondContact O-N 3.46Å; L542-T546 PolarHBondContact O-OG1 3.2Å; G543-T546 PolarHBondContact O-OG1 2.86Å; T546-Y549 PolarHBondContact O-N 2.93Å; T546-A550 PolarHBondContact O-N 3.23Å
547G97.4Very high95.2Very high0 Ų033 Ų330%018%0.183CC..Hα-helixtrans-64-44.8176.300000112.8L406 S407 G543 V544 F545 Y549 A550 S551L406-G547 CarbonylContact C-O 3.33Å; L406-G547 CarbonylContact O-C 3.35Å; S407-G547 VanDerWaalsContact CA-O 3.3Å; S407-G547 WeakPolarHBondContact CA-O 3.05Å; S407-G547 PolarHBondContact N-O 3.39Å; G543-G547 PolarHBondContact O-N 3.15Å; V544-G547 PolarHBondContact O-N 3.03Å; F545-G547 VanDerWaalsContact C-N 3.34Å; F545-G547 PolarHBondContact O-N 3.37Å; G547-Y549 PolarHBondContact O-N 2.79Å; G547-A550 PolarHBondContact O-N 3.41Å; G547-A550 VanDerWaalsContact O-N 3.17Å; G547-S551 PolarHBondContact O-N 3.11Å
548V93.8Very high94.7Very high33 Ų3333.2 Ų33.220%0.218%0.184CC..Hα-helixtrans-60.9-28176.4169.20000112.3L406 V544 F545 S551 R552L406-V548 HydrophobicContact CB-CG2 4.2Å; L406-V548 HydrophobicContact CD1-CG2 4.39Å; L406-V548 HydrophobicContact CG-CG2 4.43Å; V544-V548 HydrophobicContact CG1-CG2 4.5Å; V544-V548 WeakPolarHBondContact O-CB 3.33Å; V544-V548 VanDerWaalsContact O-CG2 3.26Å; V544-V548 WeakPolarHBondContact O-CG2 3.46Å; V544-V548 PolarHBondContact O-N 3.47Å; F545-V548 PolarHBondContact O-N 3.47Å; V548-S551 PolarHBondContact O-OG 2.74Å; V548-R552 PolarHBondContact O-NH1 2.93Å
549Y91.8Very high93.9Very high68 Ų6838.7 Ų38.727%0.26721%0.205SC..Hα-helixtrans-80-43173.4-73.2-77.9000112.7F61 F545 T546 G547 S551 R552F61-Y549 HydrophobicContact CD1-CE1 4.12Å; F61-Y549 AromaticContact CD1-CZ 3.93Å; F61-Y549 WeakPolarHBondContact CD1-OH 3.21Å; F61-Y549 AromaticContact CE1-CE1 3.26Å; F61-Y549 HydrophobicContact CE1-CE1 3.26Å; F61-Y549 AromaticContact CE1-CZ 3.54Å; F61-Y549 WeakPolarHBondContact CE1-OH 3.32Å; F61-Y549 AromaticContact CZ-CE1 3.56Å; F61-Y549 HydrophobicContact CZ-CE1 3.56Å; F545-Y549 HydrophobicContact CD1-CD2 4.04Å; F545-Y549 HydrophobicContact CD1-CE2 4.01Å; F545-Y549 HydrophobicContact CD2-CD2 4.39Å; F545-Y549 AromaticContact CD2-CE2 3.62Å; F545-Y549 HydrophobicContact CD2-CE2 3.62Å; F545-Y549 AromaticContact CE1-CD2 3.88Å; F545-Y549 HydrophobicContact CE1-CD2 3.88Å; F545-Y549 AromaticContact CE1-CE2 3.72Å; F545-Y549 HydrophobicContact CE1-CE2 3.72Å; F545-Y549 HydrophobicContact CE2-CD2 4.25Å; F545-Y549 AromaticContact CE2-CE2 3.3Å; F545-Y549 HydrophobicContact CE2-CE2 3.3Å; F545-Y549 AromaticContact CE2-CZ 3.89Å; F545-Y549 HydrophobicContact CG-CD2 4.28Å; F545-Y549 AromaticContact CG-CE2 3.95Å; F545-Y549 HydrophobicContact CG-CE2 3.95Å; F545-Y549 AromaticContact CZ-CD2 3.98Å; F545-Y549 HydrophobicContact CZ-CD2 3.98Å; F545-Y549 AromaticContact CZ-CE2 3.35Å; F545-Y549 HydrophobicContact CZ-CE2 3.35Å; F545-Y549 AromaticContact CZ-CZ 3.94Å; F545-Y549 WeakPolarHBondContact O-CD2 3.41Å; F545-Y549 PolarHBondContact O-N 2.78Å; T546-Y549 PolarHBondContact O-N 2.93Å; G547-Y549 PolarHBondContact O-N 2.79Å; Y549-S551 PolarHBondContact O-N 3.12Å; Y549-R552 WeakPolarHBondContact O-CB 3.25Å; Y549-R552 PolarHBondContact O-N 3.22Å; Y549-R552 VanDerWaalsContact O-N 3.08Å
550A96Very high93.7Very high29 Ų2938.8 Ų38.824%0.2421%0.207CC..Hα-helixtrans-57.1-37.3174.300000111.3F403 S407 T546 G547 R552 G553 L554F403-A550 HydrophobicContact CE2-CB 3.65Å; F403-A550 HydrophobicContact CZ-CB 3.86Å; S407-A550 WeakPolarHBondContact OG-CB 3.1Å; T546-A550 PolarHBondContact O-N 3.23Å; G547-A550 PolarHBondContact O-N 3.41Å; G547-A550 VanDerWaalsContact O-N 3.17Å; A550-R552 PolarHBondContact O-N 2.9Å; A550-R552 VanDerWaalsContact O-N 3.17Å; A550-G553 PolarHBondContact O-N 3.12Å; A550-G553 VanDerWaalsContact O-N 3.11Å; A550-L554 WeakPolarHBondContact O-CG 3.44Å; A550-L554 PolarHBondContact O-N 3.39Å
551S94.9Very high93.5Very high7 Ų740.3 Ų40.35%0.04922%0.215CC..Hα-helixtrans-59.2-29.1177.787.20000113.8S407 A411 G547 V548 Y549 L554 N555S407-S551 VanDerWaalsContact O-CA 3.25Å; S407-S551 WeakPolarHBondContact O-CA 3.43Å; S407-S551 WeakPolarHBondContact O-CB 3.38Å; A411-S551 WeakPolarHBondContact CB-OG 3.46Å; G547-S551 PolarHBondContact O-N 3.11Å; V548-S551 PolarHBondContact O-OG 2.74Å; Y549-S551 PolarHBondContact O-N 3.12Å; S551-L554 PolarHBondContact O-N 2.77Å; S551-N555 WeakPolarHBondContact O-CB 3.35Å; S551-N555 PolarHBondContact O-N 3.42Å; S551-N555 PolarHBondContact O-ND2 3.46Å
552R91.8Very high93.2Very high84 Ų8442.3 Ų42.332%0.31723%0.226SC..Hα-helixtrans-68.3-46.6175.7-67-175.916888.2-0.2111.4F61 V548 Y549 A550 L554 N555 S556F61-R552 VanDerWaalsContact CE2-CZ 3.47Å; V548-R552 PolarHBondContact O-NH1 2.93Å; Y549-R552 WeakPolarHBondContact O-CB 3.25Å; Y549-R552 PolarHBondContact O-N 3.22Å; Y549-R552 VanDerWaalsContact O-N 3.08Å; A550-R552 PolarHBondContact O-N 2.9Å; A550-R552 VanDerWaalsContact O-N 3.17Å; R552-L554 VanDerWaalsContact C-N 3.29Å; R552-L554 PolarHBondContact O-N 3.47Å; R552-N555 PolarHBondContact O-N 3.16Å; R552-S556 PolarHBondContact O-N 3.24Å; R552-S556 VanDerWaalsContact O-N 3.12Å
553G92.5Very high92.9Very high38 Ų3842.4 Ų42.439%0.39223%0.227SC..Hα-helixtrans-64.1-35174.700000112.4A550 S556A550-G553 PolarHBondContact O-N 3.12Å; A550-G553 VanDerWaalsContact O-N 3.11Å; G553-S556 PolarHBondContact O-N 2.99Å; G553-S556 PolarHBondContact O-OG 3.2Å
554L94.2Very high92.6Very high28 Ų2845.1 Ų45.115%0.14724%0.241CC..Hα-helixtrans-67.3-39.1173.4-68.5-170.3000112.4V412 I473 L477 A550 S551 R552 S556 L557V412-L554 HydrophobicContact CG2-CB 4.06Å; I473-L554 HydrophobicContact CG2-CD1 3.86Å; I473-L554 HydrophobicContact CG2-CD2 4.43Å; L477-L554 HydrophobicContact CD1-CD2 3.98Å; L477-L554 HydrophobicContact CD2-CB 4.21Å; A550-L554 WeakPolarHBondContact O-CG 3.44Å; A550-L554 PolarHBondContact O-N 3.39Å; S551-L554 PolarHBondContact O-N 2.77Å; R552-L554 VanDerWaalsContact C-N 3.29Å; R552-L554 PolarHBondContact O-N 3.47Å; L554-S556 VanDerWaalsContact C-N 3.31Å; L554-S556 PolarHBondContact O-N 3.01Å; L554-L557 HydrophobicContact CD2-CD1 4.13Å; L554-L557 WeakPolarHBondContact O-CB 3.47Å; L554-L557 PolarHBondContact O-N 3.43Å; L554-L557 VanDerWaalsContact O-N 3.13Å
555N91Very high92.3Very high18 Ų1846.7 Ų46.710%0.09625%0.248CC..Hα-helixtrans-65.3-33.2175.6-80.6-65.3000112.7A411 R415 S551 R552 L557 I558 Y559A411-N555 PolarHBondContact O-OD1 2.9Å; R415-N555 WeakPolarHBondContact CD-OD1 2.9Å; R415-N555 PolarHBondContact NH1-ND2 3.37Å; R415-N555 PolarHBondContact NH1-OD1 3.36Å; S551-N555 WeakPolarHBondContact O-CB 3.35Å; S551-N555 PolarHBondContact O-N 3.42Å; S551-N555 PolarHBondContact O-ND2 3.46Å; R552-N555 PolarHBondContact O-N 3.16Å; N555-L557 PolarHBondContact O-N 3.29Å; N555-I558 PolarHBondContact O-N 3.35Å; N555-I558 VanDerWaalsContact O-N 3.16Å; N555-Y559 PolarHBondContact O-N 3.48Å
556S90Very high92.1Very high78 Ų7847.2 Ų47.255%0.54525%0.254SS..THydrogen-bonded Turntrans-74-2.5173.862.20000114.5R552 G553 L554 Y559R552-S556 PolarHBondContact O-N 3.24Å; R552-S556 VanDerWaalsContact O-N 3.12Å; G553-S556 PolarHBondContact O-N 2.99Å; G553-S556 PolarHBondContact O-OG 3.2Å; L554-S556 VanDerWaalsContact C-N 3.31Å; L554-S556 PolarHBondContact O-N 3.01Å; S556-Y559 VanDerWaalsContact O-OXT 3.09Å
557L89.2Confident91.7Very high94 Ų9447.9 Ų47.949%0.49226%0.256SS..THydrogen-bonded Turntrans-91.7-17.9168.9-62.8173.9000111.9L488 L554 N555L488-L557 HydrophobicContact CD1-CB 4.25Å; L488-L557 WeakPolarHBondContact CD1-O 3.47Å; L554-L557 HydrophobicContact CD2-CD1 4.13Å; L554-L557 WeakPolarHBondContact O-CB 3.47Å; L554-L557 PolarHBondContact O-N 3.43Å; L554-L557 VanDerWaalsContact O-N 3.13Å; N555-L557 PolarHBondContact O-N 3.29Å
558I87.2Confident91.2Very high5 Ų551.9 Ų51.93%0.02628%0.277CS..THydrogen-bonded Turntrans-86-40.5-178-64.2166.6000110.7V412 L477 F481 I483 L488 N555V412-I558 HydrophobicContact CG1-CD1 3.91Å; L477-I558 HydrophobicContact CD2-CD1 4.09Å; L477-I558 HydrophobicContact CD2-CG1 4.12Å; F481-I558 HydrophobicContact CB-CG2 4.13Å; F481-I558 HydrophobicContact CD1-CD1 4.27Å; F481-I558 HydrophobicContact CD1-CG2 4.19Å; F481-I558 HydrophobicContact CD2-CD1 4.42Å; F481-I558 HydrophobicContact CD2-CG1 4.37Å; F481-I558 HydrophobicContact CD2-CG2 3.65Å; F481-I558 HydrophobicContact CE1-CD1 3.66Å; F481-I558 HydrophobicContact CE2-CD1 3.83Å; F481-I558 HydrophobicContact CE2-CG1 3.93Å; F481-I558 HydrophobicContact CE2-CG2 4.08Å; F481-I558 HydrophobicContact CG-CG2 3.71Å; F481-I558 HydrophobicContact CZ-CD1 3.41Å; F481-I558 VanDerWaalsContact CZ-CD1 3.41Å; F481-I558 HydrophobicContact CZ-CG1 4.04Å; I483-I558 HydrophobicContact CD1-CG2 3.61Å; L488-I558 HydrophobicContact CD1-CG1 4.47Å; N555-I558 PolarHBondContact O-N 3.35Å; N555-I558 VanDerWaalsContact O-N 3.16Å
559Y81.9Confident90.9Very high141 Ų14153.6 Ų53.655%0.55328%0.284SS*.  trans-1180178.6-51.8-87.1000109.3I483 H487 N555 S556I483-Y559 HydrophobicContact CD1-CD1 3.57Å; I483-Y559 HydrophobicContact CD1-CE1 3.3Å; I483-Y559 HydrophobicContact CD1-CG 4.35Å; I483-Y559 HydrophobicContact CG1-CD1 4.31Å; I483-Y559 HydrophobicContact CG1-CE1 3.79Å; H487-Y559 PolarHBondContact CD2-O 3.34Å; H487-Y559 PolarHBondContact NE2-O 3.42Å; N555-Y559 PolarHBondContact O-N 3.48Å; S556-Y559 VanDerWaalsContact O-OXT 3.09Å

Retrieved 559 of 559 residues in 191.1 ms (Link to these results)

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