A0A087YLQ6_POEFO Loading...

Transmembrane protein 116

AlphaFold DB , UniProt , Accession A0A087YLQ6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 248 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
1M75.1Confident83.4Confident43 Ų4335.6 Ų35.621%0.21219%0.186CC..  0-56.50-73.4-175.8164.200114S3 F4 P52 M56 V109 F110M1-S3 PolarHBondContact O-N 2.81Å; M1-F4 VanDerWaalsContact O-CB 3.24Å; M1-F4 WeakPolarHBondContact O-CB 3.39Å; M1-F4 WeakPolarHBondContact O-CG 3.36Å; M1-F4 PolarHBondContact O-N 3.32Å; M1-P52 HydrophobicContact CB-CB 4.19Å; M1-M56 HydrophobicContact SD-CG 4.41Å; M1-M56 HydrophobicContact SD-SD 3.88Å; M1-V109 VanDerWaalsContact CE-C 3.43Å; M1-V109 HydrophobicContact CE-CB 3.96Å; M1-V109 HydrophobicContact CE-CG1 3.5Å; M1-V109 HydrophobicContact SD-CG1 4.11Å; M1-F110 HydrophobicContact CE-CB 3.72Å; M1-F110 HydrophobicContact CE-CD2 4.31Å
2A80.7Confident83.5Confident41 Ų4142.2 Ų42.234%0.33921%0.206SC..Hα-helixtrans-54.5-39.7-18000000113.5F4 F5 F6 P52A2-F4 PolarHBondContact O-N 3.01Å; A2-F4 VanDerWaalsContact O-N 3.12Å; A2-F5 PolarHBondContact O-N 3.36Å; A2-F6 HydrophobicContact CB-CD2 4.37Å; A2-F6 HydrophobicContact CB-CE2 4.37Å; A2-F6 WeakPolarHBondContact O-CD2 3.05Å; A2-F6 PolarHBondContact O-N 2.97Å; A2-P52 VanDerWaalsContact CA-CG 3.44Å; A2-P52 HydrophobicContact CB-CB 4.12Å; A2-P52 HydrophobicContact CB-CG 3.85Å
3S83.2Confident83.5Confident38 Ų3842.3 Ų42.327%0.26621%0.208SC..Hα-helixtrans-56.5-29.6174.8-1720000113.9M1 T7 Q204M1-S3 PolarHBondContact O-N 2.81Å; S3-T7 WeakPolarHBondContact O-CB 3.34Å; S3-T7 PolarHBondContact O-N 3.4Å; S3-T7 PolarHBondContact O-OG1 3.29Å; S3-Q204 PolarHBondContact OG-NE2 2.86Å
4F86.4Confident83.1Confident0 Ų040.9 Ų40.90%020%0.202CC..Hα-helixtrans-65.7-52-178.7-57.9-10.8000109.9M1 A2 F6 T7 L8 F110 F114 T117 F164 W168M1-F4 VanDerWaalsContact O-CB 3.24Å; M1-F4 WeakPolarHBondContact O-CB 3.39Å; M1-F4 WeakPolarHBondContact O-CG 3.36Å; M1-F4 PolarHBondContact O-N 3.32Å; A2-F4 PolarHBondContact O-N 3.01Å; A2-F4 VanDerWaalsContact O-N 3.12Å; F4-F6 VanDerWaalsContact C-N 3.33Å; F4-F6 PolarHBondContact O-N 2.99Å; F4-T7 PolarHBondContact O-N 3.24Å; F4-L8 PolarHBondContact O-N 2.96Å; F4-F110 HydrophobicContact CE2-CD2 4.07Å; F4-F110 AromaticContact CE2-CE2 3.84Å; F4-F110 HydrophobicContact CE2-CE2 3.84Å; F4-F110 HydrophobicContact CE2-CZ 4.5Å; F4-F110 HydrophobicContact CZ-CD2 4.18Å; F4-F110 AromaticContact CZ-CE2 3.49Å; F4-F110 HydrophobicContact CZ-CE2 3.49Å; F4-F110 VanDerWaalsContact CZ-CE2 3.49Å; F4-F110 HydrophobicContact CZ-CZ 4.01Å; F4-F114 HydrophobicContact CE2-CB 4.08Å; F4-F114 HydrophobicContact CZ-CD2 4.41Å; F4-T117 HydrophobicContact CB-CG2 3.57Å; F4-F164 HydrophobicContact CB-CE2 4.28Å; F4-F164 HydrophobicContact CB-CZ 4.4Å; F4-F164 AromaticContact CD1-CE2 3.41Å; F4-F164 HydrophobicContact CD1-CE2 3.41Å; F4-F164 VanDerWaalsContact CD1-CE2 3.41Å; F4-F164 AromaticContact CD1-CZ 3.81Å; F4-F164 HydrophobicContact CD1-CZ 3.81Å; F4-F164 AromaticContact CE1-CE2 3.82Å; F4-F164 HydrophobicContact CE1-CE2 3.82Å; F4-F164 HydrophobicContact CE1-CZ 4.07Å; F4-F164 HydrophobicContact CG-CE2 4.05Å; F4-F164 HydrophobicContact CG-CZ 4.11Å; F4-W168 AromaticContact CE1-CD1 3.9Å; F4-W168 AromaticContact CE1-CD2 3.42Å; F4-W168 HydrophobicContact CE1-CD2 3.42Å; F4-W168 VanDerWaalsContact CE1-CD2 3.42Å; F4-W168 AromaticContact CE1-CE2 3.39Å; F4-W168 AromaticContact CE1-CE3 3.83Å; F4-W168 HydrophobicContact CE1-CE3 3.83Å; F4-W168 AromaticContact CE1-CG 3.77Å; F4-W168 HydrophobicContact CE1-CG 3.77Å; F4-W168 HydrophobicContact CE1-CH2 4.14Å; F4-W168 AromaticContact CE1-CZ2 3.77Å; F4-W168 HydrophobicContact CE1-CZ2 3.77Å; F4-W168 HydrophobicContact CE1-CZ3 4.17Å; F4-W168 AromaticContact CE1-NE1 3.7Å; F4-W168 AromaticContact CZ-CD2 3.83Å; F4-W168 HydrophobicContact CZ-CD2 3.83Å; F4-W168 AromaticContact CZ-CE3 3.8Å; F4-W168 HydrophobicContact CZ-CE3 3.8Å; F4-W168 HydrophobicContact CZ-CG 4.26Å; F4-W168 HydrophobicContact CZ-CH2 4.48Å; F4-W168 HydrophobicContact CZ-CZ3 4.13Å
5F85.3Confident82.8Confident34 Ų3439.8 Ų39.815%0.14920%0.195CC..Hα-helixtrans-66-36.7179.6-64.8-84.2000111.5A2 L8 N9 V51 P52 L55A2-F5 PolarHBondContact O-N 3.36Å; F5-L8 PolarHBondContact O-N 3.35Å; F5-N9 VanDerWaalsContact O-CB 3.3Å; F5-N9 WeakPolarHBondContact O-CB 3.38Å; F5-N9 PolarHBondContact O-N 3.32Å; F5-V51 HydrophobicContact CE1-CG1 3.84Å; F5-V51 HydrophobicContact CE2-CG1 4.12Å; F5-V51 HydrophobicContact CZ-CG1 3.61Å; F5-P52 HydrophobicContact CD2-CG 3.68Å; F5-P52 HydrophobicContact CE2-CG 4.1Å; F5-L55 HydrophobicContact CZ-CD1 4.44Å
6F84.9Confident82.6Confident93 Ų9338.8 Ų38.841%0.40819%0.192SC..Hα-helixtrans-64.7-39.3172.4-80.7-63.3000113.1A2 F4 N9 Y10A2-F6 HydrophobicContact CB-CD2 4.37Å; A2-F6 HydrophobicContact CB-CE2 4.37Å; A2-F6 WeakPolarHBondContact O-CD2 3.05Å; A2-F6 PolarHBondContact O-N 2.97Å; F4-F6 VanDerWaalsContact C-N 3.33Å; F4-F6 PolarHBondContact O-N 2.99Å; F6-N9 PolarHBondContact O-N 3.17Å; F6-Y10 VanDerWaalsContact O-CB 3.31Å; F6-Y10 WeakPolarHBondContact O-CB 3.43Å; F6-Y10 PolarHBondContact O-N 2.95Å
7T84.6Confident82.2Confident15 Ų1541.2 Ų41.29%0.09221%0.205CC..Hα-helixtrans-63.4-44.4173.9-59.80000110.8S3 F4 Y10 V11 I121 F164S3-T7 WeakPolarHBondContact O-CB 3.34Å; S3-T7 PolarHBondContact O-N 3.4Å; S3-T7 PolarHBondContact O-OG1 3.29Å; F4-T7 PolarHBondContact O-N 3.24Å; T7-Y10 PolarHBondContact O-N 3.48Å; T7-V11 WeakPolarHBondContact O-CG2 3.37Å; T7-V11 PolarHBondContact O-N 3.39Å; T7-I121 HydrophobicContact CG2-CD1 3.86Å; T7-F164 HydrophobicContact CG2-CD2 4.37Å
8L84.8Confident81.5Confident44 Ų4439.9 Ų39.923%0.2320%0.2CC..Hα-helixtrans-61.8-45.5176.4-178.464.1000111.9F4 F5 Y10 V11 W12 T117 I121 L124F4-L8 PolarHBondContact O-N 2.96Å; F5-L8 PolarHBondContact O-N 3.35Å; L8-Y10 VanDerWaalsContact C-N 3.35Å; L8-Y10 PolarHBondContact O-N 3.04Å; L8-V11 PolarHBondContact O-N 3.49Å; L8-W12 WeakPolarHBondContact O-CB 3.48Å; L8-W12 PolarHBondContact O-N 3.39Å; L8-T117 HydrophobicContact CB-CG2 4.36Å; L8-T117 HydrophobicContact CD2-CG2 4.45Å; L8-I121 HydrophobicContact CD1-CG1 3.94Å; L8-L124 HydrophobicContact CD1-CD1 4.03Å
9N87.2Confident81.3Confident11 Ų1143.5 Ų43.56%0.05921%0.211CC..Hα-helixtrans-62.4-40.9176.2-177.514.2000111.9F5 F6 W12 N13 I44 A45F5-N9 VanDerWaalsContact O-CB 3.3Å; F5-N9 WeakPolarHBondContact O-CB 3.38Å; F5-N9 PolarHBondContact O-N 3.32Å; F6-N9 PolarHBondContact O-N 3.17Å; N9-W12 WeakPolarHBondContact O-CB 3.26Å; N9-W12 PolarHBondContact O-N 3.27Å; N9-N13 WeakPolarHBondContact O-CB 3.4Å; N9-N13 PolarHBondContact O-N 3.36Å; N9-N13 PolarHBondContact O-ND2 3.12Å; N9-N13 PolarHBondContact OD1-ND2 3.41Å; N9-I44 HydrophobicContact CB-CG2 4.11Å; N9-I44 WeakPolarHBondContact OD1-CG2 3.46Å; N9-A45 WeakPolarHBondContact ND2-CA 3.35Å; N9-A45 PolarHBondContact ND2-N 3.12Å
10Y82.8Confident80.9Confident72 Ų7246.1 Ų46.128%0.28222%0.223SC..Hα-helixtrans-59.8-48.7174.8177.1-92.8000111.6F6 T7 L8 W12 N13 L14 Y160F6-Y10 VanDerWaalsContact O-CB 3.31Å; F6-Y10 WeakPolarHBondContact O-CB 3.43Å; F6-Y10 PolarHBondContact O-N 2.95Å; T7-Y10 PolarHBondContact O-N 3.48Å; L8-Y10 VanDerWaalsContact C-N 3.35Å; L8-Y10 PolarHBondContact O-N 3.04Å; Y10-W12 VanDerWaalsContact C-N 3.32Å; Y10-W12 PolarHBondContact O-N 3.33Å; Y10-N13 PolarHBondContact O-N 2.92Å; Y10-L14 WeakPolarHBondContact O-CB 3.37Å; Y10-L14 PolarHBondContact O-N 3.32Å; Y10-Y160 HydrophobicContact CD1-CD2 4.32Å; Y10-Y160 HydrophobicContact CD1-CE2 4.49Å; Y10-Y160 HydrophobicContact CD1-CG 4.48Å; Y10-Y160 HydrophobicContact CE1-CD1 4.49Å; Y10-Y160 AromaticContact CE1-CD2 3.55Å; Y10-Y160 HydrophobicContact CE1-CD2 3.55Å; Y10-Y160 HydrophobicContact CE1-CE1 4.4Å; Y10-Y160 AromaticContact CE1-CE2 3.44Å; Y10-Y160 HydrophobicContact CE1-CE2 3.44Å; Y10-Y160 VanDerWaalsContact CE1-CE2 3.44Å; Y10-Y160 HydrophobicContact CE1-CG 4.11Å; Y10-Y160 AromaticContact CE1-CZ 3.9Å; Y10-Y160 AromaticContact CZ-CE2 3.74Å; Y10-Y160 AromaticContact CZ-CZ 3.96Å; Y10-Y160 WeakPolarHBondContact OH-CE2 3.29Å
11V82.6Confident80.3Confident1 Ų149.4 Ų49.41%0.00624%0.236CC..Hα-helixtrans-64.5-38.7178.4175.20000111T7 L8 L14 Y15 I121 L124T7-V11 WeakPolarHBondContact O-CG2 3.37Å; T7-V11 PolarHBondContact O-N 3.39Å; L8-V11 PolarHBondContact O-N 3.49Å; V11-L14 PolarHBondContact O-N 3.24Å; V11-Y15 WeakPolarHBondContact O-CB 2.94Å; V11-Y15 PolarHBondContact O-N 3.34Å; V11-I121 HydrophobicContact CB-CG1 4.49Å; V11-I121 HydrophobicContact CG2-CG1 4.29Å; V11-L124 HydrophobicContact CB-CD1 4.46Å; V11-L124 HydrophobicContact CG1-CB 4.01Å; V11-L124 HydrophobicContact CG1-CD1 3.98Å
12W84.9Confident80Confident114 Ų11449 Ų4943%0.43223%0.233SC..Hα-helixtrans-59.7-51.5173.8177.1-88.9000111.9L8 N9 Y10 L14 Y15 T16 L124L8-W12 WeakPolarHBondContact O-CB 3.48Å; L8-W12 PolarHBondContact O-N 3.39Å; N9-W12 WeakPolarHBondContact O-CB 3.26Å; N9-W12 PolarHBondContact O-N 3.27Å; Y10-W12 VanDerWaalsContact C-N 3.32Å; Y10-W12 PolarHBondContact O-N 3.33Å; W12-L14 VanDerWaalsContact C-N 3.29Å; W12-L14 PolarHBondContact O-N 3.29Å; W12-Y15 WeakPolarHBondContact O-CB 3.49Å; W12-Y15 PolarHBondContact O-N 2.87Å; W12-Y15 VanDerWaalsContact O-N 3.13Å; W12-T16 HydrophobicContact CZ2-CG2 4.28Å; W12-T16 WeakPolarHBondContact O-CG2 3.47Å; W12-T16 PolarHBondContact O-N 3.42Å; W12-T16 PolarHBondContact O-OG1 2.98Å; W12-L124 HydrophobicContact CB-CD1 4.07Å; W12-L124 HydrophobicContact CD2-CD2 4.4Å; W12-L124 HydrophobicContact CE3-CD1 4.04Å; W12-L124 HydrophobicContact CE3-CD2 3.42Å; W12-L124 VanDerWaalsContact CE3-CD2 3.42Å; W12-L124 HydrophobicContact CE3-CG 4.28Å; W12-L124 HydrophobicContact CZ3-CD2 3.75Å
13N83.3Confident79.4Confident44 Ų4451 Ų5124%0.23524%0.238CC..Hα-helixtrans-62.5-38.3178.5-73.7-33.4000111.8N9 Y10 Y15 T16 L17N9-N13 WeakPolarHBondContact O-CB 3.4Å; N9-N13 PolarHBondContact O-N 3.36Å; N9-N13 PolarHBondContact O-ND2 3.12Å; N9-N13 PolarHBondContact OD1-ND2 3.41Å; Y10-N13 PolarHBondContact O-N 2.92Å; N13-Y15 VanDerWaalsContact C-N 3.35Å; N13-T16 WeakPolarHBondContact CA-OG1 3.3Å; N13-T16 PolarHBondContact O-N 3.18Å; N13-T16 PolarHBondContact O-OG1 2.83Å; N13-L17 WeakPolarHBondContact O-CB 3.45Å; N13-L17 WeakPolarHBondContact O-CD1 3.26Å; N13-L17 WeakPolarHBondContact O-CG 3.47Å; N13-L17 PolarHBondContact O-N 3.37Å
14L77.2Confident78.6Confident23 Ų2350.1 Ų50.112%0.1223%0.232CC..Hα-helixtrans-60.4-47.9174-168.272.2000110.1Y10 V11 W12 L17 T18 R156 M157Y10-L14 WeakPolarHBondContact O-CB 3.37Å; Y10-L14 PolarHBondContact O-N 3.32Å; V11-L14 PolarHBondContact O-N 3.24Å; W12-L14 VanDerWaalsContact C-N 3.29Å; W12-L14 PolarHBondContact O-N 3.29Å; L14-L17 PolarHBondContact O-N 3.43Å; L14-T18 WeakPolarHBondContact O-CB 3.4Å; L14-T18 PolarHBondContact O-N 2.93Å; L14-T18 PolarHBondContact O-OG1 2.71Å; L14-R156 HydrophobicContact CD2-CB 4.09Å; L14-M157 HydrophobicContact CD2-CE 4.26Å; L14-M157 HydrophobicContact CD2-CG 3.63Å; L14-M157 HydrophobicContact CG-CE 4.26Å
15Y79.8Confident77.5Confident24 Ų2453.8 Ų53.89%0.09426%0.257CS..Hα-helixtrans-60.8-44.5176.8166.7-105.5000113.3V11 W12 N13 T18 R19 L124 K127 A128V11-Y15 WeakPolarHBondContact O-CB 2.94Å; V11-Y15 PolarHBondContact O-N 3.34Å; W12-Y15 WeakPolarHBondContact O-CB 3.49Å; W12-Y15 PolarHBondContact O-N 2.87Å; W12-Y15 VanDerWaalsContact O-N 3.13Å; N13-Y15 VanDerWaalsContact C-N 3.35Å; Y15-T18 WeakPolarHBondContact O-CB 3.34Å; Y15-T18 PolarHBondContact O-N 2.83Å; Y15-R19 WeakPolarHBondContact O-CB 3.32Å; Y15-R19 PolarHBondContact O-N 3.2Å; Y15-L124 HydrophobicContact CD1-CD2 3.71Å; Y15-L124 HydrophobicContact CE1-CD2 4.24Å; Y15-L124 HydrophobicContact CG-CD2 4.06Å; Y15-K127 HydrophobicContact CE2-CB 4.06Å; Y15-A128 HydrophobicContact CD2-CB 3.91Å; Y15-A128 HydrophobicContact CE2-CB 4.4Å
16T79.8Confident76.4Confident24 Ų2458.9 Ų58.915%0.14728%0.279CS..Hα-helixtrans-64.7-44.3179.654.80000111.4W12 N13 T18 R19 E20W12-T16 HydrophobicContact CZ2-CG2 4.28Å; W12-T16 WeakPolarHBondContact O-CG2 3.47Å; W12-T16 PolarHBondContact O-N 3.42Å; W12-T16 PolarHBondContact O-OG1 2.98Å; N13-T16 WeakPolarHBondContact CA-OG1 3.3Å; N13-T16 PolarHBondContact O-N 3.18Å; N13-T16 PolarHBondContact O-OG1 2.83Å; T16-T18 VanDerWaalsContact C-N 3.3Å; T16-T18 PolarHBondContact O-N 2.72Å; T16-R19 PolarHBondContact O-N 2.95Å; T16-E20 WeakPolarHBondContact O-CB 3.31Å; T16-E20 WeakPolarHBondContact O-CG 3.46Å; T16-E20 PolarHBondContact O-N 3.47Å
17L75.6Confident75.4Confident80 Ų8058.3 Ų58.342%0.41929%0.287SS..Hα-helixtrans-60.5-40.7176.1-73.2169.9000111.7N13 L14 K21N13-L17 WeakPolarHBondContact O-CB 3.45Å; N13-L17 WeakPolarHBondContact O-CD1 3.26Å; N13-L17 WeakPolarHBondContact O-CG 3.47Å; N13-L17 PolarHBondContact O-N 3.37Å; L14-L17 PolarHBondContact O-N 3.43Å; L17-K21 WeakPolarHBondContact O-CB 3.47Å; L17-K21 WeakPolarHBondContact O-CG 3.33Å; L17-K21 PolarHBondContact O-N 2.95Å
18T69.6Low74.1Confident17 Ų1761.1 Ų61.110%0.10432%0.318CS..Hα-helixtrans-62-49.2174.6-59.10000111.7L14 Y15 T16 E20 K21 F22 M153L14-T18 WeakPolarHBondContact O-CB 3.4Å; L14-T18 PolarHBondContact O-N 2.93Å; L14-T18 PolarHBondContact O-OG1 2.71Å; Y15-T18 WeakPolarHBondContact O-CB 3.34Å; Y15-T18 PolarHBondContact O-N 2.83Å; T16-T18 VanDerWaalsContact C-N 3.3Å; T16-T18 PolarHBondContact O-N 2.72Å; T18-E20 VanDerWaalsContact C-N 3.3Å; T18-E20 PolarHBondContact O-N 3.36Å; T18-K21 PolarHBondContact O-N 3.33Å; T18-F22 WeakPolarHBondContact O-CB 3.3Å; T18-F22 PolarHBondContact O-N 3.38Å; T18-M153 HydrophobicContact CG2-CE 3.38Å; T18-M153 HydrophobicContact CG2-SD 3.25Å; T18-M153 WeakPolarHBondContact CG2-SD 3.5Å; T18-M153 PolarHBondContact OG1-SD 2.98Å
19R76.6Confident72.6Confident109 Ų10967.9 Ų67.941%0.41134%0.342SS..Hα-helixtrans-62.2-41.9-178.2-170.2-177.379.4171.44.4110.9Y15 T16 F22 N23Y15-R19 WeakPolarHBondContact O-CB 3.32Å; Y15-R19 PolarHBondContact O-N 3.2Å; T16-R19 PolarHBondContact O-N 2.95Å; R19-F22 PolarHBondContact O-N 3.32Å; R19-N23 WeakPolarHBondContact O-CB 3.38Å; R19-N23 VanDerWaalsContact O-CG 3.25Å; R19-N23 PolarHBondContact O-N 3.2Å; R19-N23 PolarHBondContact O-OD1 3.43Å
20E74.3Confident70.6Confident95 Ų9572.8 Ų72.844%0.44438%0.377SS..Hα-helixtrans-63.6-51.9177.1-75.3171.4-174.300111.3T16 T18 F22 N23 S24T16-E20 WeakPolarHBondContact O-CB 3.31Å; T16-E20 WeakPolarHBondContact O-CG 3.46Å; T16-E20 PolarHBondContact O-N 3.47Å; T18-E20 VanDerWaalsContact C-N 3.3Å; T18-E20 PolarHBondContact O-N 3.36Å; E20-F22 PolarHBondContact O-N 2.97Å; E20-N23 PolarHBondContact O-N 3.33Å; E20-N23 VanDerWaalsContact O-N 3.11Å; E20-S24 PolarHBondContact O-N 3.49Å; E20-S24 PolarHBondContact O-OG 3.36Å
21K68.3Low69Low116 Ų11673.9 Ų73.950%0.50439%0.387SS..Hα-helixtrans-55-39.5175.4-78.3-178.1178.5-175.20112.6L17 T18 C25 F33L17-K21 WeakPolarHBondContact O-CB 3.47Å; L17-K21 WeakPolarHBondContact O-CG 3.33Å; L17-K21 PolarHBondContact O-N 2.95Å; T18-K21 PolarHBondContact O-N 3.33Å; K21-C25 PolarHBondContact O-N 3.4Å; K21-F33 HydrophobicContact CD-CZ 4.38Å; K21-F33 VanDerWaalsContact CE-CZ 3.49Å; K21-F33 HydrophobicContact CG-CE2 4.45Å; K21-F33 HydrophobicContact CG-CZ 3.95Å
22F68.6Low67.1Low35 Ų3582.5 Ų82.515%0.15443%0.427CS..Hα-helixtrans-66.1-48.4177.5-179.7-106000111.7T18 R19 E20 S24 C25 F26 V131 A135T18-F22 WeakPolarHBondContact O-CB 3.3Å; T18-F22 PolarHBondContact O-N 3.38Å; R19-F22 PolarHBondContact O-N 3.32Å; E20-F22 PolarHBondContact O-N 2.97Å; F22-S24 VanDerWaalsContact C-N 3.32Å; F22-S24 PolarHBondContact O-N 2.91Å; F22-C25 PolarHBondContact O-N 3.27Å; F22-F26 PolarHBondContact O-N 2.89Å; F22-V131 HydrophobicContact CD1-CG1 3.82Å; F22-V131 HydrophobicContact CE1-CG1 4.31Å; F22-V131 HydrophobicContact CG-CG1 4.37Å; F22-A135 HydrophobicContact CD2-CB 3.8Å; F22-A135 HydrophobicContact CE1-CB 4.04Å; F22-A135 HydrophobicContact CE2-CB 3.03Å; F22-A135 HydrophobicContact CZ-CB 3.16Å
23N68.4Low65.3Low83 Ų8382.5 Ų82.544%0.44443%0.43SS..Hα-helixtrans-62.3-37.1177.9-72.4-5.2000112.4R19 E20 F26 S27R19-N23 WeakPolarHBondContact O-CB 3.38Å; R19-N23 VanDerWaalsContact O-CG 3.25Å; R19-N23 PolarHBondContact O-N 3.2Å; R19-N23 PolarHBondContact O-OD1 3.43Å; E20-N23 PolarHBondContact O-N 3.33Å; E20-N23 VanDerWaalsContact O-N 3.11Å; N23-F26 PolarHBondContact O-N 3.45Å; N23-S27 WeakPolarHBondContact O-CB 3.43Å; N23-S27 PolarHBondContact O-N 3.37Å
24S66.1Low63.3Low19 Ų1984.5 Ų84.513%0.13345%0.448CS..Hα-helixtrans-61.2-46.5174.7-43.30000111.8E20 F22 F26 S27 G28 I31E20-S24 PolarHBondContact O-N 3.49Å; E20-S24 PolarHBondContact O-OG 3.36Å; F22-S24 VanDerWaalsContact C-N 3.32Å; F22-S24 PolarHBondContact O-N 2.91Å; S24-F26 PolarHBondContact O-N 2.86Å; S24-S27 PolarHBondContact O-N 3.28Å; S24-G28 PolarHBondContact O-N 3.48Å; S24-I31 WeakPolarHBondContact OG-CD1 3.2Å; S24-I31 WeakPolarHBondContact OG-CG1 3.27Å
25C62.6Low62.1Low77 Ų7791 Ų9152%0.5248%0.482SS..Hα-helixtrans-64.6-31.2-180-162.70000111.8K21 F22 Q146K21-C25 PolarHBondContact O-N 3.4Å; F22-C25 PolarHBondContact O-N 3.27Å; C25-Q146 PolarHBondContact SG-NE2 3.27Å
26F63.5Low60.7Low141 Ų14194.6 Ų94.662%0.61851%0.507SS*.Hα-helixtrans-75.3-38.3175.1-173.9-95.7000112.8F22 N23 S24 G28F22-F26 PolarHBondContact O-N 2.89Å; N23-F26 PolarHBondContact O-N 3.45Å; S24-F26 PolarHBondContact O-N 2.86Å; F26-G28 VanDerWaalsContact C-N 3.35Å; F26-G28 PolarHBondContact O-N 2.95Å
27S63.5Low59.7Low81 Ų8197.6 Ų97.657%0.56653%0.525SS*.Hα-helixtrans-80-10.6-176.7-1790000114.2N23 S24 Y29N23-S27 WeakPolarHBondContact O-CB 3.43Å; N23-S27 PolarHBondContact O-N 3.37Å; S24-S27 PolarHBondContact O-N 3.28Å; S27-Y29 PolarHBondContact O-N 3.41Å; S27-Y29 VanDerWaalsContact O-N 3.08Å
28G57.5Low59.5Low73 Ų7397 Ų9775%0.75353%0.528SS*.THydrogen-bonded Turntrans69.2-1-17600000115S24 F26S24-G28 PolarHBondContact O-N 3.48Å; F26-G28 VanDerWaalsContact C-N 3.35Å; F26-G28 PolarHBondContact O-N 2.95Å
29Y53.8Low59.7Low186 Ų186102.8 Ų102.873%0.72956%0.558SS**  trans-88.3129.6178.3-116.6-91.6000110.6S27 I31S27-Y29 PolarHBondContact O-N 3.41Å; S27-Y29 VanDerWaalsContact O-N 3.08Å; Y29-I31 PolarHBondContact O-N 3.48Å
30S44.1Very low59.5Low115 Ų115105.2 Ų105.280%0.80457%0.571SS**  trans-67.7103.6167.552.50000108.5Q32S30-Q32 PolarHBondContact O-N 2.88Å
31I49.2Very low59.5Low95 Ų95101.5 Ų101.549%0.48756%0.556SS.*  trans-69.1108.6169.7-67.4-164.7000106.9S24 Y29 F33S24-I31 WeakPolarHBondContact OG-CD1 3.2Å; S24-I31 WeakPolarHBondContact OG-CG1 3.27Å; Y29-I31 PolarHBondContact O-N 3.48Å; I31-F33 VanDerWaalsContact C-N 3.34Å; I31-F33 PolarHBondContact O-N 3.43Å
32Q43.1Very low60Low182 Ų182101.7 Ų101.785%0.8556%0.557SS**  trans-57.1102.8163.2-163.9172.22.800106.4S30 S34S30-Q32 PolarHBondContact O-N 2.88Å; Q32-S34 VanDerWaalsContact C-N 3.32Å; Q32-S34 PolarHBondContact O-N 3.26Å
33F46.6Very low60.6Low114 Ų114105.9 Ų105.950%0.558%0.579SS.*  trans-59.698.7175.6-100.5-90000107.3K21 I31 N35K21-F33 HydrophobicContact CD-CZ 4.38Å; K21-F33 VanDerWaalsContact CE-CZ 3.49Å; K21-F33 HydrophobicContact CG-CE2 4.45Å; K21-F33 HydrophobicContact CG-CZ 3.95Å; I31-F33 VanDerWaalsContact C-N 3.34Å; I31-F33 PolarHBondContact O-N 3.43Å; F33-N35 PolarHBondContact O-N 2.93Å
34S42.5Very low61.2Low85 Ų85104.6 Ų104.659%0.59457%0.572SS**  trans-66.7107.3164.3-173.20000106.2Q32 T36Q32-S34 VanDerWaalsContact C-N 3.32Å; Q32-S34 PolarHBondContact O-N 3.26Å; S34-T36 PolarHBondContact O-N 3.48Å; S34-T36 WeakPolarHBondContact OG-CB 3.32Å; S34-T36 PolarHBondContact OG-OG1 3.11Å; S34-T36 VanDerWaalsContact OG-OG1 3.04Å
35N50Low61.9Low159 Ų159105.4 Ų105.485%0.8558%0.579SS**  trans-61.60172.1-87.5-22.5000112.4F33 V37F33-N35 PolarHBondContact O-N 2.93Å; N35-V37 PolarHBondContact O-N 3.31Å
36T50.9Low62.9Low101 Ų101106 Ų10662%0.6258%0.58SS**SBendtrans-74.8109.8173.7-41.20000109.6S34 S38S34-T36 PolarHBondContact O-N 3.48Å; S34-T36 WeakPolarHBondContact OG-CB 3.32Å; S34-T36 PolarHBondContact OG-OG1 3.11Å; S34-T36 VanDerWaalsContact OG-OG1 3.04Å; T36-S38 PolarHBondContact O-N 3.06Å
37V58.5Low63.9Low87 Ų87103.8 Ų103.853%0.52757%0.574SS.*  trans-50.5116168.7-179.90000108.4N35 L39 A41 K42N35-V37 PolarHBondContact O-N 3.31Å; V37-L39 PolarHBondContact O-N 3.34Å; V37-A41 HydrophobicContact CG1-CB 3.88Å; V37-K42 HydrophobicContact CB-CG 4.34Å; V37-K42 HydrophobicContact CG1-CG 3.76Å
38S71.6Confident64.9Low68 Ų68100.3 Ų100.348%0.47655%0.55SS..  trans-49.1136.8180178.30000110.4T36 K40 A41 K42T36-S38 PolarHBondContact O-N 3.06Å; S38-K40 PolarHBondContact O-N 3.23Å; S38-K40 PolarHBondContact OG-N 3.08Å; S38-A41 WeakPolarHBondContact O-CB 3.47Å; S38-A41 PolarHBondContact O-N 3.24Å; S38-K42 PolarHBondContact O-N 2.91Å; S38-K42 VanDerWaalsContact O-N 3.13Å
39L74.8Confident66.2Low138 Ų13899.5 Ų99.572%0.72353%0.533SS*.Hα-helixtrans-47.6-37.7174.2-17091.3000111V37 K42 M43V37-L39 PolarHBondContact O-N 3.34Å; L39-K42 PolarHBondContact O-N 2.92Å; L39-M43 VanDerWaalsContact O-CG 3.31Å; L39-M43 WeakPolarHBondContact O-CG 3.4Å; L39-M43 PolarHBondContact O-N 3.4Å
40K72.8Confident67.8Low159 Ų15994.9 Ų94.969%0.69152%0.52SS*.Hα-helixtrans-61.2-45.2176.7-64.5-177.6178.9178.80112.3S38 K42 M43 I44S38-K40 PolarHBondContact O-N 3.23Å; S38-K40 PolarHBondContact OG-N 3.08Å; K40-K42 VanDerWaalsContact C-N 3.35Å; K40-K42 PolarHBondContact O-N 3.5Å; K40-M43 PolarHBondContact O-N 3.18Å; K40-I44 WeakPolarHBondContact O-CD1 3.35Å; K40-I44 WeakPolarHBondContact O-CG1 3.44Å; K40-I44 PolarHBondContact O-N 3.34Å
41A73.8Confident69.8Low17 Ų1791.3 Ų91.314%0.1449%0.493CS..Hα-helixtrans-66.7-36.5178.600000112V37 S38 A45V37-A41 HydrophobicContact CG1-CB 3.88Å; S38-A41 WeakPolarHBondContact O-CB 3.47Å; S38-A41 PolarHBondContact O-N 3.24Å; A41-A45 WeakPolarHBondContact O-CB 3.31Å; A41-A45 PolarHBondContact O-N 3.24Å
42K78.4Confident71.5Confident120 Ų12087.1 Ų87.152%0.52247%0.473SS..Hα-helixtrans-63.8-47.1173.1-65.9-174.3178.5-178.60111.7V37 S38 L39 K40 I44 A45 V46V37-K42 HydrophobicContact CB-CG 4.34Å; V37-K42 HydrophobicContact CG1-CG 3.76Å; S38-K42 PolarHBondContact O-N 2.91Å; S38-K42 VanDerWaalsContact O-N 3.13Å; L39-K42 PolarHBondContact O-N 2.92Å; K40-K42 VanDerWaalsContact C-N 3.35Å; K40-K42 PolarHBondContact O-N 3.5Å; K42-I44 PolarHBondContact O-N 3.2Å; K42-A45 WeakPolarHBondContact O-CB 3.26Å; K42-A45 PolarHBondContact O-N 3.08Å; K42-V46 WeakPolarHBondContact O-CG2 3.32Å; K42-V46 PolarHBondContact O-N 3.24Å
43M81Confident73.5Confident124 Ų12481 Ų8161%0.61145%0.453SS*.Hα-helixtrans-61.7-42.2177.9-70-59.4-7000112L39 K40 A45 V46 L47L39-M43 VanDerWaalsContact O-CG 3.31Å; L39-M43 WeakPolarHBondContact O-CG 3.4Å; L39-M43 PolarHBondContact O-N 3.4Å; K40-M43 PolarHBondContact O-N 3.18Å; M43-A45 VanDerWaalsContact C-N 3.32Å; M43-A45 PolarHBondContact O-N 2.95Å; M43-V46 PolarHBondContact O-N 3.22Å; M43-L47 WeakPolarHBondContact O-CB 3.42Å; M43-L47 PolarHBondContact O-N 3.46Å
44I80.9Confident75.4Confident56 Ų5680.7 Ų80.729%0.28746%0.456SS..Hα-helixtrans-65.2-37.3176.5-63.9163.8000110.9N9 K40 K42 L47 S48N9-I44 HydrophobicContact CB-CG2 4.11Å; N9-I44 WeakPolarHBondContact OD1-CG2 3.46Å; K40-I44 WeakPolarHBondContact O-CD1 3.35Å; K40-I44 WeakPolarHBondContact O-CG1 3.44Å; K40-I44 PolarHBondContact O-N 3.34Å; K42-I44 PolarHBondContact O-N 3.2Å; I44-L47 PolarHBondContact O-N 2.85Å; I44-S48 WeakPolarHBondContact O-CB 3.26Å; I44-S48 PolarHBondContact O-N 2.82Å; I44-S48 PolarHBondContact O-OG 3.11Å
45A80.5Confident77.4Confident35 Ų3579.1 Ų79.129%0.28944%0.441SS..Hα-helixtrans-64.8-43.8175.300000112.8N9 A41 K42 M43 L47 S48 S49N9-A45 WeakPolarHBondContact ND2-CA 3.35Å; N9-A45 PolarHBondContact ND2-N 3.12Å; A41-A45 WeakPolarHBondContact O-CB 3.31Å; A41-A45 PolarHBondContact O-N 3.24Å; K42-A45 WeakPolarHBondContact O-CB 3.26Å; K42-A45 PolarHBondContact O-N 3.08Å; M43-A45 VanDerWaalsContact C-N 3.32Å; M43-A45 PolarHBondContact O-N 2.95Å; A45-L47 VanDerWaalsContact C-N 3.34Å; A45-S48 WeakPolarHBondContact O-CB 3.23Å; A45-S48 PolarHBondContact O-N 3Å; A45-S49 PolarHBondContact O-N 3.46Å
46V84.4Confident79.1Confident89 Ų8972.6 Ų72.654%0.53941%0.406SS..Hα-helixtrans-64.1-41.6174.2174.40000110.8K42 M43 S48 S49 L50K42-V46 WeakPolarHBondContact O-CG2 3.32Å; K42-V46 PolarHBondContact O-N 3.24Å; M43-V46 PolarHBondContact O-N 3.22Å; V46-S48 VanDerWaalsContact C-N 3.26Å; V46-S48 PolarHBondContact O-N 3Å; V46-S49 PolarHBondContact O-N 3.13Å; V46-S49 PolarHBondContact O-OG 3.41Å; V46-L50 WeakPolarHBondContact O-CB 3.4Å; V46-L50 PolarHBondContact O-N 3Å
47L84Confident80.7Confident95 Ų9571.3 Ų71.350%0.49740%0.398SS..Hα-helixtrans-64.4-34.5177.4-168.865.1000111.8M43 I44 A45 S49 L50 V51M43-L47 WeakPolarHBondContact O-CB 3.42Å; M43-L47 PolarHBondContact O-N 3.46Å; I44-L47 PolarHBondContact O-N 2.85Å; A45-L47 VanDerWaalsContact C-N 3.34Å; L47-S49 PolarHBondContact O-N 3.18Å; L47-L50 PolarHBondContact O-N 3.35Å; L47-V51 HydrophobicContact CD1-CG2 3.69Å; L47-V51 HydrophobicContact CG-CG2 3.83Å; L47-V51 WeakPolarHBondContact O-CB 3.14Å; L47-V51 VanDerWaalsContact O-CG2 3.31Å; L47-V51 WeakPolarHBondContact O-CG2 3.34Å; L47-V51 PolarHBondContact O-N 3.34Å
48S85.2Confident81.8Confident8 Ų869.3 Ų69.36%0.05639%0.386CS..Hα-helixtrans-64-26.1178-58.70000113.2I44 A45 V46 P52I44-S48 WeakPolarHBondContact O-CB 3.26Å; I44-S48 PolarHBondContact O-N 2.82Å; I44-S48 PolarHBondContact O-OG 3.11Å; A45-S48 WeakPolarHBondContact O-CB 3.23Å; A45-S48 PolarHBondContact O-N 3Å; V46-S48 VanDerWaalsContact C-N 3.26Å; V46-S48 PolarHBondContact O-N 3Å; S48-P52 WeakPolarHBondContact O-CD 3.5Å; S48-P52 WeakPolarHBondContact O-CG 3.47Å
49S83.3Confident82.1Confident57 Ų5766.3 Ų66.340%0.39937%0.365SS..Hα-helixtrans-91.8-36.2172.956.20000112.9A45 V46 L47 P52A45-S49 PolarHBondContact O-N 3.46Å; V46-S49 PolarHBondContact O-N 3.13Å; V46-S49 PolarHBondContact O-OG 3.41Å; L47-S49 PolarHBondContact O-N 3.18Å; S49-P52 WeakPolarHBondContact O-CD 3.32Å
50L88.8Confident82.2Confident88 Ų8865 Ų6546%0.46135%0.354SS..Hα-helixtrans-70-42.6-177-171.168.8000112.8V46 L47 A53 L54V46-L50 WeakPolarHBondContact O-CB 3.4Å; V46-L50 PolarHBondContact O-N 3Å; L47-L50 PolarHBondContact O-N 3.35Å; L50-A53 WeakPolarHBondContact O-CB 3.44Å; L50-A53 PolarHBondContact O-N 3.46Å; L50-A53 VanDerWaalsContact O-N 3.13Å; L50-L54 HydrophobicContact CD2-CD1 4.3Å; L50-L54 HydrophobicContact CG-CD1 3.93Å; L50-L54 HydrophobicContact CG-CG 4.28Å; L50-L54 WeakPolarHBondContact O-CG 2.91Å; L50-L54 PolarHBondContact O-N 2.89Å
51V85.3Confident82.5Confident40 Ų4061.7 Ų61.724%0.24235%0.346CS..Hα-helixtrans-58.4-49.7-178.9169.20000112.4F5 L47 A53 L54 L55F5-V51 HydrophobicContact CE1-CG1 3.84Å; F5-V51 HydrophobicContact CE2-CG1 4.12Å; F5-V51 HydrophobicContact CZ-CG1 3.61Å; L47-V51 HydrophobicContact CD1-CG2 3.69Å; L47-V51 HydrophobicContact CG-CG2 3.83Å; L47-V51 WeakPolarHBondContact O-CB 3.14Å; L47-V51 VanDerWaalsContact O-CG2 3.31Å; L47-V51 WeakPolarHBondContact O-CG2 3.34Å; L47-V51 PolarHBondContact O-N 3.34Å; V51-A53 VanDerWaalsContact C-N 3.29Å; V51-A53 PolarHBondContact O-N 3.38Å; V51-L54 PolarHBondContact O-N 3.08Å; V51-L55 HydrophobicContact CG1-CD1 3.9Å; V51-L55 HydrophobicContact CG1-CG 4.42Å; V51-L55 VanDerWaalsContact O-CG 3.31Å; V51-L55 WeakPolarHBondContact O-CG 3.46Å; V51-L55 PolarHBondContact O-N 3.08Å
52P84.8Confident82.6Confident8 Ų865 Ų655%0.05236%0.359CS..Hα-helixtrans-56.5-40.3173-2023.2000113.7M1 A2 F5 S48 S49 L55 M56M1-P52 HydrophobicContact CB-CB 4.19Å; A2-P52 VanDerWaalsContact CA-CG 3.44Å; A2-P52 HydrophobicContact CB-CB 4.12Å; A2-P52 HydrophobicContact CB-CG 3.85Å; F5-P52 HydrophobicContact CD2-CG 3.68Å; F5-P52 HydrophobicContact CE2-CG 4.1Å; S48-P52 WeakPolarHBondContact O-CD 3.5Å; S48-P52 WeakPolarHBondContact O-CG 3.47Å; S49-P52 WeakPolarHBondContact O-CD 3.32Å; P52-L55 PolarHBondContact O-N 3.01Å; P52-M56 WeakPolarHBondContact O-CB 3.44Å; P52-M56 VanDerWaalsContact O-CG 3.24Å; P52-M56 WeakPolarHBondContact O-CG 3.43Å; P52-M56 PolarHBondContact O-N 2.9Å
53A85.2Confident82.2Confident54 Ų5459.3 Ų59.345%0.44633%0.334SS..Hα-helixtrans-63.7-50.1179.600000110.3L50 V51 L55 M56 V57L50-A53 WeakPolarHBondContact O-CB 3.44Å; L50-A53 PolarHBondContact O-N 3.46Å; L50-A53 VanDerWaalsContact O-N 3.13Å; V51-A53 VanDerWaalsContact C-N 3.29Å; V51-A53 PolarHBondContact O-N 3.38Å; A53-L55 VanDerWaalsContact C-N 3.33Å; A53-L55 PolarHBondContact O-N 2.89Å; A53-M56 PolarHBondContact O-N 2.82Å; A53-V57 WeakPolarHBondContact O-CG2 3.25Å; A53-V57 PolarHBondContact O-N 3.44Å
54L86.8Confident81.9Confident106 Ų10659.2 Ų59.256%0.55534%0.336SS*.Hα-helixtrans-57.9-42.8177.9-71.6170.8000112.5L50 V51 M56 V57 P58L50-L54 HydrophobicContact CD2-CD1 4.3Å; L50-L54 HydrophobicContact CG-CD1 3.93Å; L50-L54 HydrophobicContact CG-CG 4.28Å; L50-L54 WeakPolarHBondContact O-CG 2.91Å; L50-L54 PolarHBondContact O-N 2.89Å; V51-L54 PolarHBondContact O-N 3.08Å; L54-M56 PolarHBondContact O-N 3.48Å; L54-V57 PolarHBondContact O-N 3.49Å; L54-P58 VanDerWaalsContact O-CD 3.32Å; L54-P58 WeakPolarHBondContact O-CD 3.49Å
55L85.5Confident81.6Confident53 Ų5362 Ų6228%0.27736%0.356SS..Hα-helixtrans-64.3-28.6178.1-72.3172.5000113F5 V51 P52 A53 V109F5-L55 HydrophobicContact CZ-CD1 4.44Å; V51-L55 HydrophobicContact CG1-CD1 3.9Å; V51-L55 HydrophobicContact CG1-CG 4.42Å; V51-L55 VanDerWaalsContact O-CG 3.31Å; V51-L55 WeakPolarHBondContact O-CG 3.46Å; V51-L55 PolarHBondContact O-N 3.08Å; P52-L55 PolarHBondContact O-N 3.01Å; A53-L55 VanDerWaalsContact C-N 3.33Å; A53-L55 PolarHBondContact O-N 2.89Å; L55-V109 HydrophobicContact CB-CG1 3.9Å; L55-V109 HydrophobicContact CD1-CG1 3.98Å; L55-V109 HydrophobicContact CD2-CG1 4.21Å; L55-V109 HydrophobicContact CG-CG1 4.25Å
56M84.6Confident80.9Confident22 Ų2261.7 Ų61.711%0.10836%0.356CS..Hα-helixtrans-88.5-20.9-179.8-69.9-57.7-45.300113.9M1 P52 A53 L54 V59 F60 L80M1-M56 HydrophobicContact SD-CG 4.41Å; M1-M56 HydrophobicContact SD-SD 3.88Å; P52-M56 WeakPolarHBondContact O-CB 3.44Å; P52-M56 VanDerWaalsContact O-CG 3.24Å; P52-M56 WeakPolarHBondContact O-CG 3.43Å; P52-M56 PolarHBondContact O-N 2.9Å; A53-M56 PolarHBondContact O-N 2.82Å; L54-M56 PolarHBondContact O-N 3.48Å; M56-V59 HydrophobicContact CE-CB 3.83Å; M56-V59 HydrophobicContact CE-CG1 3.97Å; M56-V59 HydrophobicContact CE-CG2 3.98Å; M56-V59 WeakPolarHBondContact O-CB 3.47Å; M56-V59 PolarHBondContact O-N 3.19Å; M56-V59 VanDerWaalsContact O-N 3.07Å; M56-V59 HydrophobicContact SD-CG2 4.47Å; M56-F60 HydrophobicContact CB-CD2 4.12Å; M56-F60 HydrophobicContact CB-CE2 3.75Å; M56-F60 HydrophobicContact CE-CE2 4.16Å; M56-F60 HydrophobicContact CE-CZ 4.32Å; M56-F60 WeakPolarHBondContact O-CD2 3.39Å; M56-F60 PolarHBondContact O-N 3.4Å; M56-F60 VanDerWaalsContact O-N 3.12Å; M56-L80 HydrophobicContact CE-CD1 3.84Å; M56-L80 HydrophobicContact CE-CD2 3.22Å; M56-L80 HydrophobicContact CE-CG 3.94Å; M56-L80 HydrophobicContact SD-CD2 4.13Å
57V84.5Confident80.1Confident74 Ų7463.5 Ų63.545%0.44836%0.358SS..Hα-helixtrans-49.1-52.7176.1171.60000113.3A53 L54 V59 F60 V61A53-V57 WeakPolarHBondContact O-CG2 3.25Å; A53-V57 PolarHBondContact O-N 3.44Å; L54-V57 PolarHBondContact O-N 3.49Å; V57-V59 PolarHBondContact O-N 3.4Å; V57-F60 PolarHBondContact O-N 3.37Å; V57-F60 VanDerWaalsContact O-N 3.14Å; V57-V61 HydrophobicContact CG1-CG2 3.96Å; V57-V61 WeakPolarHBondContact O-CG2 3.44Å; V57-V61 PolarHBondContact O-N 2.94Å
58P82Confident79.1Confident45 Ų4560.8 Ų60.829%0.29235%0.347SS..Hα-helixtrans-63.4-30.7-17923.7-33.8000112.4L54 Q62 Y105L54-P58 VanDerWaalsContact O-CD 3.32Å; L54-P58 WeakPolarHBondContact O-CD 3.49Å; P58-Q62 WeakPolarHBondContact O-CB 3.42Å; P58-Q62 PolarHBondContact O-N 3.04Å; P58-Y105 HydrophobicContact CG-CE1 3.86Å; P58-Y105 WeakPolarHBondContact CG-OH 3.18Å
59V77.9Confident77.9Confident4 Ų464.8 Ų64.82%0.02436%0.364CS..Hα-helixtrans-64-44.9175.8-175.10000110.5M56 V57 G63 L80 L102 Y105M56-V59 HydrophobicContact CE-CB 3.83Å; M56-V59 HydrophobicContact CE-CG1 3.97Å; M56-V59 HydrophobicContact CE-CG2 3.98Å; M56-V59 WeakPolarHBondContact O-CB 3.47Å; M56-V59 PolarHBondContact O-N 3.19Å; M56-V59 VanDerWaalsContact O-N 3.07Å; M56-V59 HydrophobicContact SD-CG2 4.47Å; V57-V59 PolarHBondContact O-N 3.4Å; V59-G63 VanDerWaalsContact O-CA 3.32Å; V59-G63 WeakPolarHBondContact O-CA 3.4Å; V59-G63 PolarHBondContact O-N 3.47Å; V59-L80 HydrophobicContact CG1-CD1 4.46Å; V59-L102 HydrophobicContact CG1-CD2 4.32Å; V59-L102 HydrophobicContact CG1-CG 4.41Å; V59-Y105 HydrophobicContact CG2-CD1 3.93Å; V59-Y105 HydrophobicContact CG2-CE1 3.83Å
60F76.8Confident76.4Confident111 Ų11165.8 Ų65.849%0.48737%0.368SS..Hα-helixtrans-71.7-46.8179.1-68.9-62.7000112.7M56 V57 N64 L80M56-F60 HydrophobicContact CB-CD2 4.12Å; M56-F60 HydrophobicContact CB-CE2 3.75Å; M56-F60 HydrophobicContact CE-CE2 4.16Å; M56-F60 HydrophobicContact CE-CZ 4.32Å; M56-F60 WeakPolarHBondContact O-CD2 3.39Å; M56-F60 PolarHBondContact O-N 3.4Å; M56-F60 VanDerWaalsContact O-N 3.12Å; V57-F60 PolarHBondContact O-N 3.37Å; V57-F60 VanDerWaalsContact O-N 3.14Å; F60-N64 VanDerWaalsContact O-CB 3.25Å; F60-N64 WeakPolarHBondContact O-CB 3.38Å; F60-N64 PolarHBondContact O-N 2.91Å; F60-L80 HydrophobicContact CE1-CD1 4.25Å; F60-L80 HydrophobicContact CZ-CD1 4.42Å
61V79.4Confident74.5Confident89 Ų8967 Ų6754%0.53938%0.375SS..Hα-helixtrans-63.3-51.4-177.91740000110.2V57 N64 V65V57-V61 HydrophobicContact CG1-CG2 3.96Å; V57-V61 WeakPolarHBondContact O-CG2 3.44Å; V57-V61 PolarHBondContact O-N 2.94Å; V61-N64 PolarHBondContact O-N 2.89Å; V61-V65 VanDerWaalsContact O-CG2 3.3Å; V61-V65 WeakPolarHBondContact O-CG2 3.4Å; V61-V65 PolarHBondContact O-N 2.92Å
62Q75.6Confident72.7Confident87 Ų8772.4 Ų72.441%0.40740%0.396SS..Hα-helixtrans-79.3-26.8-175.6-161166.28.600112.2P58 G66 L102P58-Q62 WeakPolarHBondContact O-CB 3.42Å; P58-Q62 PolarHBondContact O-N 3.04Å; Q62-G66 WeakPolarHBondContact O-CA 3.12Å; Q62-G66 PolarHBondContact O-N 3.48Å; Q62-L102 HydrophobicContact CB-CD1 3.77Å; Q62-L102 HydrophobicContact CG-CD1 4.2Å
63G69.8Low70.8Confident0 Ų077.9 Ų77.90%043%0.434CS..Hα-helixtrans-65.6-37.9169.500000113V59 H67 C68V59-G63 VanDerWaalsContact O-CA 3.32Å; V59-G63 WeakPolarHBondContact O-CA 3.4Å; V59-G63 PolarHBondContact O-N 3.47Å; G63-H67 PolarHBondContact O-N 3.21Å; G63-C68 PolarHBondContact O-N 3.32Å
64N73.5Confident68.9Low123 Ų12378.5 Ų78.566%0.65843%0.428SS*.Hα-helixtrans-73.1-49.2176.6-167.340000111.8F60 V61 G66 H67F60-N64 VanDerWaalsContact O-CB 3.25Å; F60-N64 WeakPolarHBondContact O-CB 3.38Å; F60-N64 PolarHBondContact O-N 2.91Å; V61-N64 PolarHBondContact O-N 2.89Å; N64-G66 VanDerWaalsContact C-N 3.3Å; N64-G66 PolarHBondContact O-N 2.89Å; N64-H67 PolarHBondContact O-N 2.82Å; N64-H67 VanDerWaalsContact O-N 3.11Å
65V74.6Confident66.7Low114 Ų11477.5 Ų77.569%0.69143%0.428SS*.Hα-helixtrans-61.1-40.2176.8172.20000111.4V61 H67V61-V65 VanDerWaalsContact O-CG2 3.3Å; V61-V65 WeakPolarHBondContact O-CG2 3.4Å; V61-V65 PolarHBondContact O-N 2.92Å; V65-H67 PolarHBondContact O-N 2.85Å
66G66.8Low64.9Low29 Ų2980.7 Ų80.730%0.29944%0.437SS..THydrogen-bonded Turntrans-77.80.7178.900000114.5Q62 N64 C68Q62-G66 WeakPolarHBondContact O-CA 3.12Å; Q62-G66 PolarHBondContact O-N 3.48Å; N64-G66 VanDerWaalsContact C-N 3.3Å; N64-G66 PolarHBondContact O-N 2.89Å; G66-C68 PolarHBondContact O-N 3Å
67H66.9Low63.3Low127 Ų12784.2 Ų84.259%0.58845%0.449SS*.THydrogen-bonded Turntrans49.233.4-175.6-78.9-76.5000112.4G63 N64 V65 Q69 V70G63-H67 PolarHBondContact O-N 3.21Å; N64-H67 PolarHBondContact O-N 2.82Å; N64-H67 VanDerWaalsContact O-N 3.11Å; V65-H67 PolarHBondContact O-N 2.85Å; H67-Q69 PolarHBondContact O-N 3.4Å; H67-V70 HydrophobicContact CB-CG2 3.35Å; H67-V70 WeakPolarHBondContact ND1-CG2 3.45Å; H67-V70 WeakPolarHBondContact O-CG2 3.13Å
68C64.8Low61.9Low37 Ų3785.7 Ų85.725%0.2546%0.461CS..THydrogen-bonded Turntrans-74.3-11.6-175.9-58.90000112.3G63 G66 C99G63-C68 PolarHBondContact O-N 3.32Å; G66-C68 PolarHBondContact O-N 3Å; C68-C99 VanDerWaalsContact CA-SG 3.58Å; C68-C99 HydrophobicContact CB-CB 3.98Å; C68-C99 WeakPolarHBondContact CB-SG 3.31Å; C68-C99 WeakPolarHBondContact SG-CA 3.35Å; C68-C99 WeakPolarHBondContact SG-CB 3.21Å; C68-C99 CovalentContact SG-SG 2.03Å; C68-C99 PolarHBondContact SG-SG 2.79Å
69Q59.8Low60.6Low92 Ų9289 Ų8943%0.4348%0.476SS..THydrogen-bonded Turntrans-126.512.2-172-65.1-175.2-51.600114.7H67 N71H67-Q69 PolarHBondContact O-N 3.4Å; Q69-N71 VanDerWaalsContact C-N 3.31Å; Q69-N71 PolarHBondContact O-N 3.46Å; Q69-N71 VanDerWaalsContact O-N 3.13Å
70V51.9Low59.2Low78 Ų7892 Ų9247%0.47349%0.491SS..  trans-71.2-10.8-163.8-127.90000116.9H67 F72H67-V70 HydrophobicContact CB-CG2 3.35Å; H67-V70 WeakPolarHBondContact ND1-CG2 3.45Å; H67-V70 WeakPolarHBondContact O-CG2 3.13Å; V70-F72 PolarHBondContact O-N 3.02Å
71N48.9Very low57.7Low115 Ų11589.8 Ų89.862%0.61548%0.483SS*.  trans-96.979.9178.8-79.1-9.4000111.3Q69 S73Q69-N71 VanDerWaalsContact C-N 3.31Å; Q69-N71 PolarHBondContact O-N 3.46Å; Q69-N71 VanDerWaalsContact O-N 3.13Å; N71-S73 PolarHBondContact O-N 3.41Å
72F46.6Very low56.2Low152 Ų15289.3 Ų89.367%0.66748%0.475SS*.THydrogen-bonded Turntrans-69.5-2.1172.3-74.2-86.1000114.2V70V70-F72 PolarHBondContact O-N 3.02Å
73S45.8Very low55Low123 Ų12386.5 Ų86.586%0.8646%0.464SS*.THydrogen-bonded Turntrans-87.1-13.8-175.9-148.20000113.9N71N71-S73 PolarHBondContact O-N 3.41Å
74E44.7Very low53.8Low67 Ų6788 Ų8831%0.31348%0.48SS..SBendtrans-85.9134.3170-74.2-177.917200109.2R77E74-R77 HydrophobicContact CB-CG 4.33Å; E74-R77 IonicContact OE2-CZ 2.98Å; E74-R77 VanDerWaalsContact OE2-CZ 3.31Å; E74-R77 IonicContact OE2-NE 3.31Å; E74-R77 PolarHBondContact OE2-NE 2.88Å; E74-R77 IonicContact OE2-NH2 3.2Å; E74-R77 PolarHBondContact OE2-NH2 2.87Å; E74-R77 VanDerWaalsContact OE2-NH2 3.09Å
75P41Very low52.2Low85 Ų8583.2 Ų83.255%0.55246%0.457SS*.THydrogen-bonded Turntrans-58.2166.31737.7-2.8000109.8R77P75-R77 PolarHBondContact O-N 3.45Å
76Y47.6Very low50.6Low121 Ų12182.1 Ų82.148%0.47545%0.447SS..THydrogen-bonded Turntrans61.9-3.9172.547.4-96.5000119.4C78 A85Y76-C78 PolarHBondContact O-N 3.05Å; Y76-A85 HydrophobicContact CE2-CB 3.88Å
77R50.4Low49.4Very low95 Ų9586.1 Ų86.136%0.35846%0.456SS..THydrogen-bonded Turntrans-77.3-10.3176.3-74.5-155.9178.9-141.1-0.3116.4E74 P75 L79E74-R77 HydrophobicContact CB-CG 4.33Å; E74-R77 IonicContact OE2-CZ 2.98Å; E74-R77 VanDerWaalsContact OE2-CZ 3.31Å; E74-R77 IonicContact OE2-NE 3.31Å; E74-R77 PolarHBondContact OE2-NE 2.88Å; E74-R77 IonicContact OE2-NH2 3.2Å; E74-R77 PolarHBondContact OE2-NH2 2.87Å; E74-R77 VanDerWaalsContact OE2-NH2 3.09Å; P75-R77 PolarHBondContact O-N 3.45Å; R77-L79 VanDerWaalsContact C-N 3.29Å; R77-L79 PolarHBondContact O-N 3.3Å
78C54.1Low48Very low105 Ų10587.6 Ų87.671%0.70947%0.468SS*.THydrogen-bonded Turntrans-79.5-9.8178.3-60.30000113.7Y76 L80Y76-C78 PolarHBondContact O-N 3.05Å; C78-L80 PolarHBondContact O-N 2.92Å
79L55.5Low46.7Very low114 Ų11493.7 Ų93.760%0.59749%0.485SS*.SBendtrans-81.1106.7174.6-81.4160.5000108.5R77 M81 H82R77-L79 VanDerWaalsContact C-N 3.29Å; R77-L79 PolarHBondContact O-N 3.3Å; L79-M81 PolarHBondContact O-N 2.89Å; L79-H82 HydrophobicContact CB-CB 3.37Å; L79-H82 HydrophobicContact CD1-CB 4.11Å; L79-H82 HydrophobicContact CG-CB 4.39Å; L79-H82 PolarHBondContact O-N 3.41Å
80L49.2Very low45.6Very low67 Ų6795.3 Ų95.335%0.35150%0.504SS..THydrogen-bonded Turntrans-48.1-24.4-178.6-17268.4000114.1M56 V59 F60 C78 Q106M56-L80 HydrophobicContact CE-CD1 3.84Å; M56-L80 HydrophobicContact CE-CD2 3.22Å; M56-L80 HydrophobicContact CE-CG 3.94Å; M56-L80 HydrophobicContact SD-CD2 4.13Å; V59-L80 HydrophobicContact CG1-CD1 4.46Å; F60-L80 HydrophobicContact CE1-CD1 4.25Å; F60-L80 HydrophobicContact CZ-CD1 4.42Å; C78-L80 PolarHBondContact O-N 2.92Å; L80-Q106 PolarHBondContact O-NE2 2.78Å
81M45.9Very low44.8Very low65 Ų6598 Ų9832%0.3252%0.516SS..THydrogen-bonded Turntrans-112.6-1.7179.2-155.7168.3167.100114.1L79 T83 F110 A171L79-M81 PolarHBondContact O-N 2.89Å; M81-T83 PolarHBondContact O-N 3.23Å; M81-F110 HydrophobicContact CE-CD1 3.95Å; M81-F110 HydrophobicContact CE-CD2 4.1Å; M81-F110 HydrophobicContact CE-CE1 3.7Å; M81-F110 HydrophobicContact CE-CE2 3.84Å; M81-F110 HydrophobicContact CE-CG 4.15Å; M81-F110 HydrophobicContact CE-CZ 3.65Å; M81-F110 HydrophobicContact SD-CD2 4.12Å; M81-F110 HydrophobicContact SD-CE2 3.92Å; M81-F110 HydrophobicContact SD-CZ 4.3Å; M81-A171 HydrophobicContact CE-CB 4.02Å
82H46.8Very low44.4Very low79 Ų7999.2 Ų99.237%0.36652%0.518SS..  trans-93.496.4-179-166.575.2000110.8L79 G84L79-H82 HydrophobicContact CB-CB 3.37Å; L79-H82 HydrophobicContact CD1-CB 4.11Å; L79-H82 HydrophobicContact CG-CB 4.39Å; L79-H82 PolarHBondContact O-N 3.41Å; H82-G84 WeakPolarHBondContact NE2-CA 3.27Å; H82-G84 PolarHBondContact O-N 2.88Å; H82-G84 VanDerWaalsContact O-N 3.11Å
83T50.1Low44Very low29 Ų29100.6 Ų100.618%0.17853%0.526CS..  trans-84.545.4170.8620000111.3M81 A85 R178 Y194M81-T83 PolarHBondContact O-N 3.23Å; T83-A85 PolarHBondContact O-N 2.84Å; T83-A85 VanDerWaalsContact O-N 3.14Å; T83-R178 PolarHBondContact OG1-NH1 3.44Å; T83-R178 PolarHBondContact OG1-NH2 3.11Å; T83-Y194 PolarHBondContact OG1-OH 3.08Å
84G44.4Very low43.8Very low32 Ų32103.5 Ų103.533%0.3353%0.526SS..THydrogen-bonded Turntrans-66.1-12.5-168.500000116.3H82H82-G84 WeakPolarHBondContact NE2-CA 3.27Å; H82-G84 PolarHBondContact O-N 2.88Å; H82-G84 VanDerWaalsContact O-N 3.11Å
85A40.8Very low44.3Very low22 Ų22105 Ų10518%0.18254%0.535CS..THydrogen-bonded Turntrans-139.212.2-172.100000115.8Y76 T83Y76-A85 HydrophobicContact CE2-CB 3.88Å; T83-A85 PolarHBondContact O-N 2.84Å; T83-A85 VanDerWaalsContact O-N 3.14Å
86L41.2Very low45.4Very low90 Ų90104.1 Ų104.147%0.47153%0.531SS..SBendtrans-89.4-12177-116154.2000113.4
87F40.5Very low46.3Very low113 Ų113109.2 Ų109.250%0.49655%0.55SS..SBendtrans-106.1-5.5-179-72.6-79.4000114.5
88L39Very low47.2Very low158 Ų158107.4 Ų107.483%0.82755%0.552SS**SBendtrans-941.1176.1-101.3134.1000113.7
89R35.7Very low48Very low165 Ų165103.1 Ų103.162%0.62352%0.522SS*.  trans-122.4106.8175.8-137.2171.2-173.5161.10.3109.4D91R89-D91 PolarHBondContact O-N 3.49Å
90P36.5Very low48.9Very low126 Ų126100.7 Ų100.782%0.81852%0.515SS*.THydrogen-bonded Turntrans-69.47.1177.610.7-3.6000114
91D35.3Very low50.2Low135 Ų135103.6 Ų103.672%0.72253%0.525SS*.THydrogen-bonded Turntrans-128.226.6-157.6-111.2-11.6000115.7R89R89-D91 PolarHBondContact O-N 3.49Å
92Q40.6Very low51.6Low140 Ų140101.3 Ų101.365%0.65451%0.514SS*.  trans-118.365.7174.6-148.4140.8-1300112.2H94Q92-H94 PolarHBondContact O-N 3.39Å
93Q39Very low52.9Low182 Ų182100.9 Ų100.985%0.8551%0.512SS*.  trans-68.324.5179.2-127.5165.8-13.100115
94H41.7Very low54.3Low183 Ų183103.5 Ų103.585%0.84753%0.528SS*.  trans-141.243.2179.2-105.2-86.7000112.5Q92 S96Q92-H94 PolarHBondContact O-N 3.39Å; H94-S96 PolarHBondContact O-N 3.25Å
95L54.6Low56.1Low99 Ų99105.8 Ų105.852%0.51853%0.528SS..  trans-74.1107.5167.9-164.972.1000109R97 C99L95-R97 PolarHBondContact O-N 3.42Å; L95-C99 HydrophobicContact CD1-CB 3.99Å; L95-C99 HydrophobicContact CG-CB 4.05Å
96S63.5Low58Low66 Ų66106.4 Ų106.446%0.46253%0.527SS..  trans-48.7136.7178-178.10000111.5H94 S98 C99 S100H94-S96 PolarHBondContact O-N 3.25Å; S96-S98 PolarHBondContact O-N 3.03Å; S96-C99 PolarHBondContact O-N 3.14Å; S96-S100 PolarHBondContact O-N 3.13Å
97R67.4Low59.9Low229 Ų229103.2 Ų103.286%0.86451%0.51SS*.Hα-helixtrans-48.9-32.7-178.9-172.3173.2-177.9154-0.3112.4L95 F101L95-R97 PolarHBondContact O-N 3.42Å; R97-F101 WeakPolarHBondContact O-CB 3.26Å; R97-F101 PolarHBondContact O-N 3.35Å; R97-F101 VanDerWaalsContact O-N 3.09Å
98S68.8Low62.1Low57 Ų5799.6 Ų99.640%0.39950%0.504SS..Hα-helixtrans-63.5-39.8176.3-54.60000113.7S96 L102S96-S98 PolarHBondContact O-N 3.03Å; S98-L102 WeakPolarHBondContact O-CB 3.48Å; S98-L102 PolarHBondContact O-N 2.78Å
99C71.8Confident64.4Low14 Ų1492.7 Ų92.710%0.09547%0.468CS..Hα-helixtrans-73.5-36.1179.2-60.60000112.2C68 L95 S96 L102 H103C68-C99 VanDerWaalsContact CA-SG 3.58Å; C68-C99 HydrophobicContact CB-CB 3.98Å; C68-C99 WeakPolarHBondContact CB-SG 3.31Å; C68-C99 WeakPolarHBondContact SG-CA 3.35Å; C68-C99 WeakPolarHBondContact SG-CB 3.21Å; C68-C99 CovalentContact SG-SG 2.03Å; C68-C99 PolarHBondContact SG-SG 2.79Å; L95-C99 HydrophobicContact CD1-CB 3.99Å; L95-C99 HydrophobicContact CG-CB 4.05Å; S96-C99 PolarHBondContact O-N 3.14Å; C99-L102 WeakPolarHBondContact O-CB 3.39Å; C99-L102 PolarHBondContact O-N 2.85Å; C99-H103 WeakPolarHBondContact O-CB 3.23Å; C99-H103 PolarHBondContact O-N 3.36Å
100S73.8Confident66.8Low64 Ų6485.3 Ų85.345%0.44844%0.441SS..Hα-helixtrans-64.7-42.1174.4-179.50000111.6S96 H103 T104S96-S100 PolarHBondContact O-N 3.13Å; S100-H103 PolarHBondContact O-N 3.4Å; S100-T104 PolarHBondContact O-N 3.15Å; S100-T104 PolarHBondContact O-OG1 2.83Å
101F76Confident69.2Low128 Ų12881 Ų8156%0.56141%0.411SS*.Hα-helixtrans-62.2-45.2173.8-176.9-97.7000111.9R97 H103 T104 Y105R97-F101 WeakPolarHBondContact O-CB 3.26Å; R97-F101 PolarHBondContact O-N 3.35Å; R97-F101 VanDerWaalsContact O-N 3.09Å; F101-H103 VanDerWaalsContact C-N 3.32Å; F101-H103 PolarHBondContact O-N 3.37Å; F101-T104 PolarHBondContact O-N 3.39Å; F101-Y105 WeakPolarHBondContact O-CB 3.41Å; F101-Y105 PolarHBondContact O-N 3.33Å
102L76.9Confident71.8Confident16 Ų1677.2 Ų77.28%0.08440%0.395CS..Hα-helixtrans-57.7-44.1176.9-160.781.8000112.2V59 Q62 S98 C99 Y105 Q106V59-L102 HydrophobicContact CG1-CD2 4.32Å; V59-L102 HydrophobicContact CG1-CG 4.41Å; Q62-L102 HydrophobicContact CB-CD1 3.77Å; Q62-L102 HydrophobicContact CG-CD1 4.2Å; S98-L102 WeakPolarHBondContact O-CB 3.48Å; S98-L102 PolarHBondContact O-N 2.78Å; C99-L102 WeakPolarHBondContact O-CB 3.39Å; C99-L102 PolarHBondContact O-N 2.85Å; L102-Y105 PolarHBondContact O-N 2.98Å; L102-Q106 WeakPolarHBondContact O-CB 3.18Å; L102-Q106 PolarHBondContact O-N 3.09Å
103H74.4Confident74.1Confident71 Ų7170.6 Ų70.633%0.32936%0.364SS..Hα-helixtrans-64.7-41.3178.4-177.5-93.1000111.9C99 S100 F101 Q106 I107C99-H103 WeakPolarHBondContact O-CB 3.23Å; C99-H103 PolarHBondContact O-N 3.36Å; S100-H103 PolarHBondContact O-N 3.4Å; F101-H103 VanDerWaalsContact C-N 3.32Å; F101-H103 PolarHBondContact O-N 3.37Å; H103-Q106 PolarHBondContact O-N 2.96Å; H103-I107 WeakPolarHBondContact CE1-CD1 3.24Å; H103-I107 WeakPolarHBondContact O-CG1 3.26Å; H103-I107 PolarHBondContact O-N 2.97Å; H103-I107 VanDerWaalsContact O-N 3.08Å
104T78.8Confident76.4Confident84 Ų8462.5 Ų62.552%0.51533%0.326SS..Hα-helixtrans-66.3-43176.1-53.50000111.4S100 F101 Q106 I107 G108S100-T104 PolarHBondContact O-N 3.15Å; S100-T104 PolarHBondContact O-OG1 2.83Å; F101-T104 PolarHBondContact O-N 3.39Å; T104-Q106 VanDerWaalsContact C-N 3.34Å; T104-Q106 PolarHBondContact O-N 2.98Å; T104-I107 PolarHBondContact O-N 2.98Å; T104-G108 PolarHBondContact O-N 2.76Å
105Y82.8Confident78.7Confident80 Ų8058.2 Ų58.231%0.31431%0.309SS..Hα-helixtrans-58.2-46.2174.5173-96.1000111.2P58 V59 F101 L102 I107 G108 V109P58-Y105 HydrophobicContact CG-CE1 3.86Å; P58-Y105 WeakPolarHBondContact CG-OH 3.18Å; V59-Y105 HydrophobicContact CG2-CD1 3.93Å; V59-Y105 HydrophobicContact CG2-CE1 3.83Å; F101-Y105 WeakPolarHBondContact O-CB 3.41Å; F101-Y105 PolarHBondContact O-N 3.33Å; L102-Y105 PolarHBondContact O-N 2.98Å; Y105-I107 PolarHBondContact O-N 3.37Å; Y105-G108 PolarHBondContact O-N 2.87Å; Y105-V109 HydrophobicContact CD1-CG2 3.95Å; Y105-V109 HydrophobicContact CD2-CG2 4.14Å; Y105-V109 HydrophobicContact CE1-CG2 3.56Å; Y105-V109 HydrophobicContact CE2-CG2 3.77Å; Y105-V109 HydrophobicContact CG-CG2 4.22Å; Y105-V109 VanDerWaalsContact CZ-CG2 3.45Å; Y105-V109 WeakPolarHBondContact O-CG2 3.33Å; Y105-V109 PolarHBondContact O-N 2.92Å
106Q79.4Confident80.4Confident35 Ų3558.9 Ų58.916%0.16431%0.312CS..Hα-helixtrans-61.5-45.5179-174.9-176.1-12.800112.5L80 L102 H103 T104 G108 V109 F110L80-Q106 PolarHBondContact O-NE2 2.78Å; L102-Q106 WeakPolarHBondContact O-CB 3.18Å; L102-Q106 PolarHBondContact O-N 3.09Å; H103-Q106 PolarHBondContact O-N 2.96Å; T104-Q106 VanDerWaalsContact C-N 3.34Å; T104-Q106 PolarHBondContact O-N 2.98Å; Q106-G108 VanDerWaalsContact C-N 3.31Å; Q106-G108 PolarHBondContact O-N 3.31Å; Q106-V109 PolarHBondContact O-N 3.48Å; Q106-F110 WeakPolarHBondContact O-CB 3.16Å; Q106-F110 PolarHBondContact O-N 3.25Å
107I82.2Confident81.7Confident23 Ų2355.8 Ų55.812%0.11829%0.291CS..Hα-helixtrans-60.6-43.9174.7-70.1171.2000110.3H103 T104 Y105 F110 L111 A175 R178 V179H103-I107 WeakPolarHBondContact CE1-CD1 3.24Å; H103-I107 WeakPolarHBondContact O-CG1 3.26Å; H103-I107 PolarHBondContact O-N 2.97Å; H103-I107 VanDerWaalsContact O-N 3.08Å; T104-I107 PolarHBondContact O-N 2.98Å; Y105-I107 PolarHBondContact O-N 3.37Å; I107-F110 PolarHBondContact O-N 3.28Å; I107-L111 HydrophobicContact CG2-CD1 3.68Å; I107-L111 HydrophobicContact CG2-CG 4.3Å; I107-L111 WeakPolarHBondContact O-CB 3.45Å; I107-L111 WeakPolarHBondContact O-CG 3.35Å; I107-L111 PolarHBondContact O-N 2.79Å; I107-A175 HydrophobicContact CG2-CB 4.25Å; I107-R178 HydrophobicContact CD1-CB 4.45Å; I107-V179 HydrophobicContact CG2-CG2 3.76Å
108G85Confident82.7Confident36 Ų3647.3 Ų47.337%0.37126%0.262SS..Hα-helixtrans-60.2-46.6177.500000112.9T104 Y105 Q106 F110 L111 S112T104-G108 PolarHBondContact O-N 2.76Å; Y105-G108 PolarHBondContact O-N 2.87Å; Q106-G108 VanDerWaalsContact C-N 3.31Å; Q106-G108 PolarHBondContact O-N 3.31Å; G108-F110 VanDerWaalsContact C-N 3.32Å; G108-F110 PolarHBondContact O-N 3.32Å; G108-L111 PolarHBondContact O-N 2.88Å; G108-S112 VanDerWaalsContact O-CB 3.25Å; G108-S112 WeakPolarHBondContact O-CB 3.45Å; G108-S112 PolarHBondContact O-N 3.41Å; G108-S112 PolarHBondContact O-OG 3.48Å
109V87.6Confident83.7Confident13 Ų1349.7 Ų49.78%0.07927%0.27CS..Hα-helixtrans-63.5-39.1177-179.80000110.6M1 L55 Y105 Q106 S112 S113M1-V109 VanDerWaalsContact CE-C 3.43Å; M1-V109 HydrophobicContact CE-CB 3.96Å; M1-V109 HydrophobicContact CE-CG1 3.5Å; M1-V109 HydrophobicContact SD-CG1 4.11Å; L55-V109 HydrophobicContact CB-CG1 3.9Å; L55-V109 HydrophobicContact CD1-CG1 3.98Å; L55-V109 HydrophobicContact CD2-CG1 4.21Å; L55-V109 HydrophobicContact CG-CG1 4.25Å; Y105-V109 HydrophobicContact CD1-CG2 3.95Å; Y105-V109 HydrophobicContact CD2-CG2 4.14Å; Y105-V109 HydrophobicContact CE1-CG2 3.56Å; Y105-V109 HydrophobicContact CE2-CG2 3.77Å; Y105-V109 HydrophobicContact CG-CG2 4.22Å; Y105-V109 VanDerWaalsContact CZ-CG2 3.45Å; Y105-V109 WeakPolarHBondContact O-CG2 3.33Å; Y105-V109 PolarHBondContact O-N 2.92Å; Q106-V109 PolarHBondContact O-N 3.48Å; V109-S112 WeakPolarHBondContact CA-OG 3.49Å; V109-S112 PolarHBondContact O-OG 2.84Å; V109-S112 VanDerWaalsContact O-OG 3.11Å; V109-S113 VanDerWaalsContact O-CB 3.24Å; V109-S113 WeakPolarHBondContact O-CB 3.34Å; V109-S113 PolarHBondContact O-N 3.11Å; V109-S113 PolarHBondContact O-OG 3.47Å
110F86.8Confident84.6Confident11 Ų1150.1 Ų50.15%0.04828%0.277CS..Hα-helixtrans-63.8-52176179.2-97.4000112.4M1 F4 M81 Q106 I107 G108 S113 F114 W168 A171 V172 A175M1-F110 HydrophobicContact CE-CB 3.72Å; M1-F110 HydrophobicContact CE-CD2 4.31Å; F4-F110 HydrophobicContact CE2-CD2 4.07Å; F4-F110 AromaticContact CE2-CE2 3.84Å; F4-F110 HydrophobicContact CE2-CE2 3.84Å; F4-F110 HydrophobicContact CE2-CZ 4.5Å; F4-F110 HydrophobicContact CZ-CD2 4.18Å; F4-F110 AromaticContact CZ-CE2 3.49Å; F4-F110 HydrophobicContact CZ-CE2 3.49Å; F4-F110 VanDerWaalsContact CZ-CE2 3.49Å; F4-F110 HydrophobicContact CZ-CZ 4.01Å; M81-F110 HydrophobicContact CE-CD1 3.95Å; M81-F110 HydrophobicContact CE-CD2 4.1Å; M81-F110 HydrophobicContact CE-CE1 3.7Å; M81-F110 HydrophobicContact CE-CE2 3.84Å; M81-F110 HydrophobicContact CE-CG 4.15Å; M81-F110 HydrophobicContact CE-CZ 3.65Å; M81-F110 HydrophobicContact SD-CD2 4.12Å; M81-F110 HydrophobicContact SD-CE2 3.92Å; M81-F110 HydrophobicContact SD-CZ 4.3Å; Q106-F110 WeakPolarHBondContact O-CB 3.16Å; Q106-F110 PolarHBondContact O-N 3.25Å; I107-F110 PolarHBondContact O-N 3.28Å; G108-F110 VanDerWaalsContact C-N 3.32Å; G108-F110 PolarHBondContact O-N 3.32Å; F110-S113 PolarHBondContact O-N 3.34Å; F110-S113 PolarHBondContact O-OG 3.39Å; F110-F114 WeakPolarHBondContact O-CB 3.3Å; F110-F114 PolarHBondContact O-N 2.87Å; F110-W168 AromaticContact CE2-CE3 3.92Å; F110-W168 HydrophobicContact CE2-CE3 3.92Å; F110-W168 AromaticContact CE2-CZ3 3.89Å; F110-W168 HydrophobicContact CE2-CZ3 3.89Å; F110-W168 AromaticContact CZ-CE3 3.86Å; F110-W168 HydrophobicContact CZ-CE3 3.86Å; F110-W168 HydrophobicContact CZ-CZ3 4.25Å; F110-A171 HydrophobicContact CE1-CB 4.37Å; F110-A171 HydrophobicContact CZ-CB 4Å; F110-V172 HydrophobicContact CE1-CG2 3.79Å; F110-V172 HydrophobicContact CZ-CG2 4.29Å; F110-A175 HydrophobicContact CD1-CB 4.36Å
111L87.9Confident85.3Confident35 Ų3547.1 Ų47.118%0.18326%0.256CS..Hα-helixtrans-64.1-46.9-179.7-72.8170.2000111.7I107 G108 F114 L115 V172 A175I107-L111 HydrophobicContact CG2-CD1 3.68Å; I107-L111 HydrophobicContact CG2-CG 4.3Å; I107-L111 WeakPolarHBondContact O-CB 3.45Å; I107-L111 WeakPolarHBondContact O-CG 3.35Å; I107-L111 PolarHBondContact O-N 2.79Å; G108-L111 PolarHBondContact O-N 2.88Å; L111-F114 PolarHBondContact O-N 2.9Å; L111-L115 WeakPolarHBondContact O-CB 3.35Å; L111-L115 VanDerWaalsContact O-CG 3.3Å; L111-L115 WeakPolarHBondContact O-CG 3.48Å; L111-L115 PolarHBondContact O-N 2.74Å; L111-V172 HydrophobicContact CD2-CG1 3.88Å; L111-A175 HydrophobicContact CD1-CB 4.43Å; L111-A175 HydrophobicContact CD2-CB 4.01Å; L111-A175 HydrophobicContact CG-CB 4.23Å
112S88.2Confident85.8Confident55 Ų5544.1 Ų44.139%0.38525%0.248SC..Hα-helixtrans-61.1-46.2178.456.40000112G108 V109 F114 L115 L116G108-S112 VanDerWaalsContact O-CB 3.25Å; G108-S112 WeakPolarHBondContact O-CB 3.45Å; G108-S112 PolarHBondContact O-N 3.41Å; G108-S112 PolarHBondContact O-OG 3.48Å; V109-S112 WeakPolarHBondContact CA-OG 3.49Å; V109-S112 PolarHBondContact O-OG 2.84Å; V109-S112 VanDerWaalsContact O-OG 3.11Å; S112-F114 PolarHBondContact O-N 2.87Å; S112-L115 PolarHBondContact O-N 3.41Å; S112-L116 WeakPolarHBondContact O-CB 3.43Å; S112-L116 VanDerWaalsContact O-CG 3.24Å; S112-L116 WeakPolarHBondContact O-CG 3.31Å; S112-L116 PolarHBondContact O-N 2.99Å
113S89Confident86.4Confident2 Ų247.2 Ų47.21%0.01427%0.267CS..Hα-helixtrans-62.8-42.6177.260.30000111.9V109 F110 L116 T117V109-S113 VanDerWaalsContact O-CB 3.24Å; V109-S113 WeakPolarHBondContact O-CB 3.34Å; V109-S113 PolarHBondContact O-N 3.11Å; V109-S113 PolarHBondContact O-OG 3.47Å; F110-S113 PolarHBondContact O-N 3.34Å; F110-S113 PolarHBondContact O-OG 3.39Å; S113-L116 PolarHBondContact O-N 3.49Å; S113-T117 VanDerWaalsContact O-CG2 3.3Å; S113-T117 WeakPolarHBondContact O-CG2 3.43Å; S113-T117 PolarHBondContact O-N 2.86Å; S113-T117 PolarHBondContact O-OG1 3.37Å; S113-T117 VanDerWaalsContact O-OG1 3.09Å
114F88.6Confident87Confident11 Ų1144.3 Ų44.35%0.04825%0.254CS..Hα-helixtrans-58.7-51174.3177.1-94.2000111.7F4 F110 L111 S112 L116 T117 L118 F164 W168 V172F4-F114 HydrophobicContact CE2-CB 4.08Å; F4-F114 HydrophobicContact CZ-CD2 4.41Å; F110-F114 WeakPolarHBondContact O-CB 3.3Å; F110-F114 PolarHBondContact O-N 2.87Å; L111-F114 PolarHBondContact O-N 2.9Å; S112-F114 PolarHBondContact O-N 2.87Å; F114-L116 PolarHBondContact O-N 3.32Å; F114-T117 PolarHBondContact O-N 2.84Å; F114-T117 PolarHBondContact O-OG1 3.43Å; F114-L118 HydrophobicContact CE1-CD2 4.18Å; F114-L118 WeakPolarHBondContact O-CB 3.49Å; F114-L118 PolarHBondContact O-N 2.9Å; F114-F164 AromaticContact CD2-CE1 3.48Å; F114-F164 HydrophobicContact CD2-CE1 3.48Å; F114-F164 VanDerWaalsContact CD2-CE1 3.48Å; F114-F164 AromaticContact CD2-CZ 3.56Å; F114-F164 HydrophobicContact CD2-CZ 3.56Å; F114-F164 AromaticContact CE2-CD1 3.94Å; F114-F164 HydrophobicContact CE2-CD1 3.94Å; F114-F164 AromaticContact CE2-CE1 3.23Å; F114-F164 HydrophobicContact CE2-CE1 3.23Å; F114-F164 AromaticContact CE2-CZ 3.76Å; F114-F164 HydrophobicContact CE2-CZ 3.76Å; F114-F164 HydrophobicContact CG-CE1 4.46Å; F114-F164 HydrophobicContact CZ-CE1 4.07Å; F114-W168 HydrophobicContact CD2-CB 4.13Å; F114-W168 HydrophobicContact CE2-CB 3.79Å; F114-V172 HydrophobicContact CB-CG2 4.31Å; F114-V172 HydrophobicContact CD1-CG1 4.28Å; F114-V172 HydrophobicContact CD1-CG2 3.64Å; F114-V172 HydrophobicContact CD2-CG2 3.77Å; F114-V172 HydrophobicContact CE1-CB 4.49Å; F114-V172 HydrophobicContact CE1-CG1 4.22Å; F114-V172 HydrophobicContact CE1-CG2 3.81Å; F114-V172 HydrophobicContact CE2-CG2 3.93Å; F114-V172 HydrophobicContact CG-CG2 3.63Å; F114-V172 HydrophobicContact CZ-CG2 3.95Å
115L90.1Very high87.2Confident93 Ų9341.9 Ų41.949%0.48724%0.239SC..Hα-helixtrans-61.2-45.1179.7-71.9173.5000112.3L111 S112 T117 L118 L119L111-L115 WeakPolarHBondContact O-CB 3.35Å; L111-L115 VanDerWaalsContact O-CG 3.3Å; L111-L115 WeakPolarHBondContact O-CG 3.48Å; L111-L115 PolarHBondContact O-N 2.74Å; S112-L115 PolarHBondContact O-N 3.41Å; L115-T117 VanDerWaalsContact C-N 3.29Å; L115-T117 PolarHBondContact O-N 2.89Å; L115-L118 PolarHBondContact O-N 3.19Å; L115-L119 WeakPolarHBondContact O-CB 3.35Å; L115-L119 VanDerWaalsContact O-CG 3.31Å; L115-L119 WeakPolarHBondContact O-CG 3.47Å; L115-L119 PolarHBondContact O-N 2.92Å
116L90.4Very high87.3Confident113 Ų11342.3 Ų42.359%0.59225%0.25SC*.Hα-helixtrans-58.7-42.4176-74.4171.9000111.3S112 S113 F114 G120S112-L116 WeakPolarHBondContact O-CB 3.43Å; S112-L116 VanDerWaalsContact O-CG 3.24Å; S112-L116 WeakPolarHBondContact O-CG 3.31Å; S112-L116 PolarHBondContact O-N 2.99Å; S113-L116 PolarHBondContact O-N 3.49Å; F114-L116 PolarHBondContact O-N 3.32Å; L116-G120 PolarHBondContact O-N 3.13Å
117T89.8Confident87.6Confident1 Ų146.4 Ų46.41%0.00627%0.267CS..Hα-helixtrans-69-39.7177.2570000113.2F4 L8 S113 F114 L115 G120 I121 F164F4-T117 HydrophobicContact CB-CG2 3.57Å; L8-T117 HydrophobicContact CB-CG2 4.36Å; L8-T117 HydrophobicContact CD2-CG2 4.45Å; S113-T117 VanDerWaalsContact O-CG2 3.3Å; S113-T117 WeakPolarHBondContact O-CG2 3.43Å; S113-T117 PolarHBondContact O-N 2.86Å; S113-T117 PolarHBondContact O-OG1 3.37Å; S113-T117 VanDerWaalsContact O-OG1 3.09Å; F114-T117 PolarHBondContact O-N 2.84Å; F114-T117 PolarHBondContact O-OG1 3.43Å; L115-T117 VanDerWaalsContact C-N 3.29Å; L115-T117 PolarHBondContact O-N 2.89Å; T117-G120 PolarHBondContact O-N 3.39Å; T117-I121 VanDerWaalsContact O-CB 3.31Å; T117-I121 WeakPolarHBondContact O-CB 3.3Å; T117-I121 WeakPolarHBondContact O-CD1 3.45Å; T117-I121 WeakPolarHBondContact O-CG1 3.16Å; T117-I121 PolarHBondContact O-N 3.34Å; T117-F164 VanDerWaalsContact OG1-CZ 3.31Å; T117-F164 WeakPolarHBondContact OG1-CZ 3.36Å
118L88.6Confident87.5Confident51 Ų5145.7 Ų45.727%0.26727%0.265SS..Hα-helixtrans-65-44.3177.2-173.267.4000111.4F114 L115 I121 T122 V165F114-L118 HydrophobicContact CE1-CD2 4.18Å; F114-L118 WeakPolarHBondContact O-CB 3.49Å; F114-L118 PolarHBondContact O-N 2.9Å; L115-L118 PolarHBondContact O-N 3.19Å; L118-I121 PolarHBondContact O-N 2.87Å; L118-T122 WeakPolarHBondContact O-CB 3.4Å; L118-T122 WeakPolarHBondContact O-CG2 3.37Å; L118-T122 PolarHBondContact O-N 3.47Å; L118-T122 PolarHBondContact O-OG1 3Å; L118-V165 HydrophobicContact CD1-CG2 3.66Å
119L90.6Very high87.2Confident107 Ų10748.5 Ų48.556%0.5626%0.264SS*.Hα-helixtrans-62.6-46.7174.9-74.2168.5000111.4L115 I121 T122 V123L115-L119 WeakPolarHBondContact O-CB 3.35Å; L115-L119 VanDerWaalsContact O-CG 3.31Å; L115-L119 WeakPolarHBondContact O-CG 3.47Å; L115-L119 PolarHBondContact O-N 2.92Å; L119-I121 PolarHBondContact O-N 3.34Å; L119-T122 WeakPolarHBondContact CA-OG1 3.46Å; L119-T122 PolarHBondContact O-N 3.42Å; L119-T122 PolarHBondContact O-OG1 3.45Å; L119-V123 WeakPolarHBondContact O-CB 3.43Å; L119-V123 VanDerWaalsContact O-CG2 3.26Å; L119-V123 WeakPolarHBondContact O-CG2 3.4Å; L119-V123 PolarHBondContact O-N 2.87Å
120G89.6Confident87Confident23 Ų2351.4 Ų51.424%0.23728%0.284CS..Hα-helixtrans-60.2-45.7177.800000112.3L116 T117 L124L116-G120 PolarHBondContact O-N 3.13Å; T117-G120 PolarHBondContact O-N 3.39Å; G120-L124 WeakPolarHBondContact O-CB 3.21Å; G120-L124 WeakPolarHBondContact O-CD1 3.43Å; G120-L124 VanDerWaalsContact O-CG 3.23Å; G120-L124 WeakPolarHBondContact O-CG 3.37Å; G120-L124 PolarHBondContact O-N 2.82Å
121I88.1Confident86.6Confident1 Ų152.8 Ų52.81%0.00529%0.293CS..Hα-helixtrans-61.7-49.6177-73.1168.4000111.1T7 L8 V11 T117 L118 L119 V123 L124 V125 P161T7-I121 HydrophobicContact CG2-CD1 3.86Å; L8-I121 HydrophobicContact CD1-CG1 3.94Å; V11-I121 HydrophobicContact CB-CG1 4.49Å; V11-I121 HydrophobicContact CG2-CG1 4.29Å; T117-I121 VanDerWaalsContact O-CB 3.31Å; T117-I121 WeakPolarHBondContact O-CB 3.3Å; T117-I121 WeakPolarHBondContact O-CD1 3.45Å; T117-I121 WeakPolarHBondContact O-CG1 3.16Å; T117-I121 PolarHBondContact O-N 3.34Å; L118-I121 PolarHBondContact O-N 2.87Å; L119-I121 PolarHBondContact O-N 3.34Å; I121-V123 PolarHBondContact O-N 2.91Å; I121-L124 PolarHBondContact O-N 3.01Å; I121-V125 HydrophobicContact CG2-CG2 4.42Å; I121-V125 WeakPolarHBondContact O-CG2 3.36Å; I121-V125 PolarHBondContact O-N 3.16Å; I121-P161 HydrophobicContact CG2-CB 3.65Å; I121-P161 HydrophobicContact CG2-CG 3.26Å
122T86.4Confident85.9Confident65 Ų6555.9 Ų55.940%0.39930%0.303SS..Hα-helixtrans-62.1-43.7-17946.10000111.9L118 L119 L124 V125 V126L118-T122 WeakPolarHBondContact O-CB 3.4Å; L118-T122 WeakPolarHBondContact O-CG2 3.37Å; L118-T122 PolarHBondContact O-N 3.47Å; L118-T122 PolarHBondContact O-OG1 3Å; L119-T122 WeakPolarHBondContact CA-OG1 3.46Å; L119-T122 PolarHBondContact O-N 3.42Å; L119-T122 PolarHBondContact O-OG1 3.45Å; T122-L124 VanDerWaalsContact C-N 3.32Å; T122-L124 PolarHBondContact O-N 2.91Å; T122-V125 PolarHBondContact O-N 3.4Å; T122-V126 VanDerWaalsContact O-CG2 3.3Å; T122-V126 WeakPolarHBondContact O-CG2 3.27Å; T122-V126 PolarHBondContact O-N 3.03Å
123V89.5Confident85.3Confident82 Ų8262.4 Ų62.450%0.49732%0.32SS..Hα-helixtrans-58.4-43.9174.3170.10000111.2L119 I121 V126 K127L119-V123 WeakPolarHBondContact O-CB 3.43Å; L119-V123 VanDerWaalsContact O-CG2 3.26Å; L119-V123 WeakPolarHBondContact O-CG2 3.4Å; L119-V123 PolarHBondContact O-N 2.87Å; I121-V123 PolarHBondContact O-N 2.91Å; V123-V126 PolarHBondContact O-N 2.92Å; V123-K127 HydrophobicContact CG1-CG 4.35Å; V123-K127 WeakPolarHBondContact O-CB 3.43Å; V123-K127 VanDerWaalsContact O-CG 3.26Å; V123-K127 WeakPolarHBondContact O-CG 3.46Å; V123-K127 PolarHBondContact O-N 3.32Å
124L86.8Confident84.7Confident10 Ų1071.7 Ų71.75%0.05235%0.354CS..Hα-helixtrans-65.1-41.7178.4-71.7167000112.4L8 V11 W12 Y15 G120 I121 T122 K127 A128L8-L124 HydrophobicContact CD1-CD1 4.03Å; V11-L124 HydrophobicContact CB-CD1 4.46Å; V11-L124 HydrophobicContact CG1-CB 4.01Å; V11-L124 HydrophobicContact CG1-CD1 3.98Å; W12-L124 HydrophobicContact CB-CD1 4.07Å; W12-L124 HydrophobicContact CD2-CD2 4.4Å; W12-L124 HydrophobicContact CE3-CD1 4.04Å; W12-L124 HydrophobicContact CE3-CD2 3.42Å; W12-L124 VanDerWaalsContact CE3-CD2 3.42Å; W12-L124 HydrophobicContact CE3-CG 4.28Å; W12-L124 HydrophobicContact CZ3-CD2 3.75Å; Y15-L124 HydrophobicContact CD1-CD2 3.71Å; Y15-L124 HydrophobicContact CE1-CD2 4.24Å; Y15-L124 HydrophobicContact CG-CD2 4.06Å; G120-L124 WeakPolarHBondContact O-CB 3.21Å; G120-L124 WeakPolarHBondContact O-CD1 3.43Å; G120-L124 VanDerWaalsContact O-CG 3.23Å; G120-L124 WeakPolarHBondContact O-CG 3.37Å; G120-L124 PolarHBondContact O-N 2.82Å; I121-L124 PolarHBondContact O-N 3.01Å; T122-L124 VanDerWaalsContact C-N 3.32Å; T122-L124 PolarHBondContact O-N 2.91Å; L124-K127 PolarHBondContact O-N 2.89Å; L124-A128 WeakPolarHBondContact O-CB 3.35Å; L124-A128 PolarHBondContact O-N 3.38Å
125V83.8Confident83.9Confident33 Ų3371.3 Ų71.320%0.235%0.353CS..Hα-helixtrans-62.5-46.7175.6172.20000110.5I121 T122 K127 A128 R129 M157I121-V125 HydrophobicContact CG2-CG2 4.42Å; I121-V125 WeakPolarHBondContact O-CG2 3.36Å; I121-V125 PolarHBondContact O-N 3.16Å; T122-V125 PolarHBondContact O-N 3.4Å; V125-K127 PolarHBondContact O-N 3.49Å; V125-A128 WeakPolarHBondContact O-CB 3.17Å; V125-A128 PolarHBondContact O-N 2.86Å; V125-R129 HydrophobicContact CG1-CG 4.44Å; V125-R129 WeakPolarHBondContact O-CB 3.45Å; V125-R129 VanDerWaalsContact O-CG 3.26Å; V125-R129 WeakPolarHBondContact O-CG 3.46Å; V125-R129 PolarHBondContact O-N 3.25Å; V125-M157 HydrophobicContact CG2-CB 4.36Å; V125-M157 WeakPolarHBondContact CG2-O 3.43Å
126V85.4Confident83Confident88 Ų8869.4 Ų69.453%0.53335%0.346SS..Hα-helixtrans-61.5-45.7177.6171.90000110.8T122 V123 A128 R129 C130T122-V126 VanDerWaalsContact O-CG2 3.3Å; T122-V126 WeakPolarHBondContact O-CG2 3.27Å; T122-V126 PolarHBondContact O-N 3.03Å; V123-V126 PolarHBondContact O-N 2.92Å; V126-A128 PolarHBondContact O-N 3.33Å; V126-R129 PolarHBondContact O-N 3.11Å; V126-C130 WeakPolarHBondContact O-CB 3.47Å; V126-C130 PolarHBondContact O-N 3.39Å; V126-C130 PolarHBondContact O-SG 3.03Å; V126-C130 VanDerWaalsContact O-SG 3.33Å
127K84.8Confident82.2Confident121 Ų12169.7 Ų69.753%0.52635%0.352SS..Hα-helixtrans-61-43.5176.5-72.8-74.2-176.6176.50111.7Y15 V123 L124 V125 R129 C130 V131Y15-K127 HydrophobicContact CE2-CB 4.06Å; V123-K127 HydrophobicContact CG1-CG 4.35Å; V123-K127 WeakPolarHBondContact O-CB 3.43Å; V123-K127 VanDerWaalsContact O-CG 3.26Å; V123-K127 WeakPolarHBondContact O-CG 3.46Å; V123-K127 PolarHBondContact O-N 3.32Å; L124-K127 PolarHBondContact O-N 2.89Å; V125-K127 PolarHBondContact O-N 3.49Å; K127-R129 PolarHBondContact O-N 3.47Å; K127-C130 PolarHBondContact O-N 2.9Å; K127-V131 WeakPolarHBondContact O-CG2 3.37Å; K127-V131 PolarHBondContact O-N 2.89Å
128A79.7Confident81.3Confident9 Ų973.1 Ų73.17%0.07438%0.376CS..Hα-helixtrans-59.9-45.317600000111.7Y15 L124 V125 V126 V131 Y132 M157Y15-A128 HydrophobicContact CD2-CB 3.91Å; Y15-A128 HydrophobicContact CE2-CB 4.4Å; L124-A128 WeakPolarHBondContact O-CB 3.35Å; L124-A128 PolarHBondContact O-N 3.38Å; V125-A128 WeakPolarHBondContact O-CB 3.17Å; V125-A128 PolarHBondContact O-N 2.86Å; V126-A128 PolarHBondContact O-N 3.33Å; A128-V131 PolarHBondContact O-N 2.78Å; A128-Y132 WeakPolarHBondContact O-CB 3.48Å; A128-Y132 PolarHBondContact O-N 2.88Å; A128-M157 HydrophobicContact CB-CE 3.73Å; A128-M157 HydrophobicContact CB-SD 3.51Å; A128-M157 VanDerWaalsContact CB-SD 3.51Å
129R79.9Confident80.1Confident95 Ų9574.1 Ų74.136%0.35839%0.386SS..Hα-helixtrans-63-40.5176.1-71.7-70.1-161.5-176.2-2.6112.6V125 V126 K127 Y132 R133 D154V125-R129 HydrophobicContact CG1-CG 4.44Å; V125-R129 WeakPolarHBondContact O-CB 3.45Å; V125-R129 VanDerWaalsContact O-CG 3.26Å; V125-R129 WeakPolarHBondContact O-CG 3.46Å; V125-R129 PolarHBondContact O-N 3.25Å; V126-R129 PolarHBondContact O-N 3.11Å; K127-R129 PolarHBondContact O-N 3.47Å; R129-Y132 WeakPolarHBondContact O-CB 3.23Å; R129-Y132 PolarHBondContact O-N 2.96Å; R129-R133 PolarHBondContact O-N 3.4Å; R129-D154 IonicContact CZ-OD1 3.01Å; R129-D154 IonicContact CZ-OD2 3.09Å; R129-D154 IonicContact NE-OD1 2.73Å; R129-D154 PolarHBondContact NE-OD1 3.19Å; R129-D154 IonicContact NH1-OD1 2.71Å; R129-D154 PolarHBondContact NH1-OD1 3.29Å; R129-D154 IonicContact NH1-OD2 2.8Å; R129-D154 PolarHBondContact NH1-OD2 3.32Å; R129-D154 IonicContact NH2-OD1 2.83Å; R129-D154 PolarHBondContact NH2-OD1 3.31Å; R129-D154 IonicContact NH2-OD2 2.72Å; R129-D154 PolarHBondContact NH2-OD2 2.98Å
130C82.8Confident79.1Confident73 Ų7371.1 Ų71.149%0.49338%0.382SS..Hα-helixtrans-66.3-45.1177.3-73.60000111.8V126 K127 Y132 R133 R134V126-C130 WeakPolarHBondContact O-CB 3.47Å; V126-C130 PolarHBondContact O-N 3.39Å; V126-C130 PolarHBondContact O-SG 3.03Å; V126-C130 VanDerWaalsContact O-SG 3.33Å; K127-C130 PolarHBondContact O-N 2.9Å; C130-Y132 VanDerWaalsContact C-N 3.27Å; C130-Y132 PolarHBondContact O-N 3.42Å; C130-R133 PolarHBondContact O-N 3.1Å; C130-R134 WeakPolarHBondContact O-CB 3.17Å; C130-R134 PolarHBondContact O-N 2.97Å
131V78.5Confident77.8Confident40 Ų4078.2 Ų78.224%0.24240%0.403CS..Hα-helixtrans-59.2-43174.1172.50000110.1F22 K127 A128 R134 A135F22-V131 HydrophobicContact CD1-CG1 3.82Å; F22-V131 HydrophobicContact CE1-CG1 4.31Å; F22-V131 HydrophobicContact CG-CG1 4.37Å; K127-V131 WeakPolarHBondContact O-CG2 3.37Å; K127-V131 PolarHBondContact O-N 2.89Å; A128-V131 PolarHBondContact O-N 2.78Å; V131-R134 PolarHBondContact O-N 3.08Å; V131-A135 WeakPolarHBondContact O-CB 3.44Å; V131-A135 PolarHBondContact O-N 3.08Å
132Y72.9Confident76.8Confident101 Ų10179.5 Ų79.540%0.39641%0.409SS..Hα-helixtrans-61.4-49.3175.1166.8-98.7000113.2A128 R129 C130 R134 A135 V136A128-Y132 WeakPolarHBondContact O-CB 3.48Å; A128-Y132 PolarHBondContact O-N 2.88Å; R129-Y132 WeakPolarHBondContact O-CB 3.23Å; R129-Y132 PolarHBondContact O-N 2.96Å; C130-Y132 VanDerWaalsContact C-N 3.27Å; C130-Y132 PolarHBondContact O-N 3.42Å; Y132-R134 VanDerWaalsContact C-N 3.26Å; Y132-R134 PolarHBondContact O-N 3.27Å; Y132-A135 VanDerWaalsContact O-CB 3.26Å; Y132-A135 WeakPolarHBondContact O-CB 3.4Å; Y132-A135 PolarHBondContact O-N 2.92Å; Y132-V136 HydrophobicContact CD2-CG2 4.06Å; Y132-V136 HydrophobicContact CE1-CG2 4.11Å; Y132-V136 HydrophobicContact CE2-CG2 3.5Å; Y132-V136 WeakPolarHBondContact O-CG2 3.33Å; Y132-V136 PolarHBondContact O-N 3.26Å
133R76.8Confident75.9Confident192 Ų19277.7 Ų77.773%0.72540%0.404SS*.Hα-helixtrans-58.5-45.5178.6-81.9-168.3177.6-158.71110.3R129 C130 A135 V136 T137R129-R133 PolarHBondContact O-N 3.4Å; C130-R133 PolarHBondContact O-N 3.1Å; R133-A135 VanDerWaalsContact C-N 3.31Å; R133-A135 PolarHBondContact O-N 3.45Å; R133-V136 PolarHBondContact O-N 2.86Å; R133-T137 WeakPolarHBondContact O-CG2 3.49Å; R133-T137 PolarHBondContact O-N 3.1Å; R133-T137 PolarHBondContact O-OG1 3.23Å
134R76.8Confident75Confident196 Ų19679 Ų7974%0.7441%0.407SS*.Hα-helixtrans-59.1-43.6178.1-164.9171.5-174.71691111.6C130 V131 Y132 T137 S138C130-R134 WeakPolarHBondContact O-CB 3.17Å; C130-R134 PolarHBondContact O-N 2.97Å; V131-R134 PolarHBondContact O-N 3.08Å; Y132-R134 VanDerWaalsContact C-N 3.26Å; Y132-R134 PolarHBondContact O-N 3.27Å; R134-T137 WeakPolarHBondContact CA-OG1 3.32Å; R134-T137 PolarHBondContact O-N 3.38Å; R134-T137 PolarHBondContact O-OG1 2.69Å; R134-S138 WeakPolarHBondContact O-CB 3.45Å; R134-S138 PolarHBondContact O-N 3.45Å; R134-S138 PolarHBondContact O-OG 2.92Å
135A70.3Confident74.1Confident4 Ų485.3 Ų85.33%0.03344%0.437CS..Hα-helixtrans-57.3-50.8176.400000113.6F22 V131 Y132 R133 T137 S138 C139F22-A135 HydrophobicContact CD2-CB 3.8Å; F22-A135 HydrophobicContact CE1-CB 4.04Å; F22-A135 HydrophobicContact CE2-CB 3.03Å; F22-A135 HydrophobicContact CZ-CB 3.16Å; V131-A135 WeakPolarHBondContact O-CB 3.44Å; V131-A135 PolarHBondContact O-N 3.08Å; Y132-A135 VanDerWaalsContact O-CB 3.26Å; Y132-A135 WeakPolarHBondContact O-CB 3.4Å; Y132-A135 PolarHBondContact O-N 2.92Å; R133-A135 VanDerWaalsContact C-N 3.31Å; R133-A135 PolarHBondContact O-N 3.45Å; A135-T137 VanDerWaalsContact C-N 3.33Å; A135-S138 PolarHBondContact O-N 2.9Å; A135-S138 PolarHBondContact O-OG 2.8Å; A135-C139 WeakPolarHBondContact O-CB 3.2Å; A135-C139 PolarHBondContact O-N 3.27Å
136V70.8Confident73.2Confident53 Ų5387.4 Ų87.432%0.32145%0.445SS..Hα-helixtrans-65.1-41.4-179.2177.70000110.3Y132 R133 S138 G140 L142Y132-V136 HydrophobicContact CD2-CG2 4.06Å; Y132-V136 HydrophobicContact CE1-CG2 4.11Å; Y132-V136 HydrophobicContact CE2-CG2 3.5Å; Y132-V136 WeakPolarHBondContact O-CG2 3.33Å; Y132-V136 PolarHBondContact O-N 3.26Å; R133-V136 PolarHBondContact O-N 2.86Å; V136-S138 VanDerWaalsContact C-N 3.35Å; V136-S138 PolarHBondContact O-N 2.79Å; V136-G140 PolarHBondContact O-N 3.41Å; V136-L142 HydrophobicContact CB-CD1 4.39Å; V136-L142 HydrophobicContact CG2-CD1 3.8Å
137T75.4Confident72.5Confident118 Ų11889.4 Ų89.472%0.72444%0.442SS*.Hα-helixtrans-68.7-30.8178.951.90000113.2R133 R134 A135R133-T137 WeakPolarHBondContact O-CG2 3.49Å; R133-T137 PolarHBondContact O-N 3.1Å; R133-T137 PolarHBondContact O-OG1 3.23Å; R134-T137 WeakPolarHBondContact CA-OG1 3.32Å; R134-T137 PolarHBondContact O-N 3.38Å; R134-T137 PolarHBondContact O-OG1 2.69Å; A135-T137 VanDerWaalsContact C-N 3.33Å
138S70.8Confident71.7Confident73 Ų7385.8 Ų85.851%0.5144%0.435SS..Hα-helixtrans-90.5-31.1-176.6620000114.4R134 A135 V136R134-S138 WeakPolarHBondContact O-CB 3.45Å; R134-S138 PolarHBondContact O-N 3.45Å; R134-S138 PolarHBondContact O-OG 2.92Å; A135-S138 PolarHBondContact O-N 2.9Å; A135-S138 PolarHBondContact O-OG 2.8Å; V136-S138 VanDerWaalsContact C-N 3.35Å; V136-S138 PolarHBondContact O-N 2.79Å
139C62.5Low71.1Confident72 Ų7290.4 Ų90.449%0.48646%0.458SS..Hα-helixtrans-106.5-4.5-171.2-64.50000114.2A135 Y141A135-C139 WeakPolarHBondContact O-CB 3.2Å; A135-C139 PolarHBondContact O-N 3.27Å; C139-Y141 PolarHBondContact O-N 2.78Å
140G69.8Low70.6Confident45 Ų4588 Ų8846%0.46445%0.45SS..  trans68.6-129.7-178.600000112.8V136 L142V136-G140 PolarHBondContact O-N 3.41Å; G140-L142 PolarHBondContact O-N 3.38Å
141Y61.3Low70.1Confident172 Ų17294.1 Ų94.168%0.67546%0.463SS*.  trans-74.8111.2-170.4-173.8-97.2000112.9C139C139-Y141 PolarHBondContact O-N 2.78Å
142L67.4Low69.7Low28 Ų2893.8 Ų93.815%0.14746%0.461CS..  trans-78.6133166.3-72.797.6000111V136 G140 Q146 R147 F150V136-L142 HydrophobicContact CB-CD1 4.39Å; V136-L142 HydrophobicContact CG2-CD1 3.8Å; G140-L142 PolarHBondContact O-N 3.38Å; L142-Q146 HydrophobicContact CD2-CB 4.41Å; L142-R147 PolarHBondContact O-NH2 3.08Å; L142-F150 HydrophobicContact CD2-CD2 3.86Å; L142-F150 HydrophobicContact CD2-CE2 3.51Å
143G67.9Low69.5Low27 Ų2790.5 Ų90.528%0.27845%0.45SS..  trans-59.7156.2175.300000113.3E145 Q146 R147G143-E145 VanDerWaalsContact C-N 3.35Å; G143-E145 PolarHBondContact O-N 3.38Å; G143-Q146 PolarHBondContact O-N 3.43Å; G143-R147 PolarHBondContact O-N 2.98Å
144N71.4Confident69.4Low108 Ų10883.3 Ų83.358%0.57843%0.426SS*.Hα-helixtrans-59.2-40.2-173.4-72.4-23.3000113.4R147 A148N144-R147 PolarHBondContact O-N 3.41Å; N144-A148 WeakPolarHBondContact O-CB 3.35Å; N144-A148 PolarHBondContact O-N 3.46Å
145E66.2Low69.5Low143 Ų14377.6 Ų77.667%0.66841%0.409SS*.Hα-helixtrans-64.4-43.8177.1-73.6-62.5137.400112.3G143 A148 L149G143-E145 VanDerWaalsContact C-N 3.35Å; G143-E145 PolarHBondContact O-N 3.38Å; E145-A148 PolarHBondContact O-N 3.26Å; E145-L149 WeakPolarHBondContact O-CG 3.24Å; E145-L149 PolarHBondContact O-N 3.41Å
146Q65.6Low69.9Low78 Ų7879.6 Ų79.636%0.36442%0.416SS..Hα-helixtrans-63.4-45.3175.7-75167.9-38.700110.4C25 L142 G143 A148 L149 F150C25-Q146 PolarHBondContact SG-NE2 3.27Å; L142-Q146 HydrophobicContact CD2-CB 4.41Å; G143-Q146 PolarHBondContact O-N 3.43Å; Q146-A148 VanDerWaalsContact C-N 3.3Å; Q146-A148 PolarHBondContact O-N 3.33Å; Q146-L149 PolarHBondContact O-N 2.88Å; Q146-F150 HydrophobicContact CB-CD2 4.35Å; Q146-F150 HydrophobicContact CB-CE2 4.18Å; Q146-F150 WeakPolarHBondContact O-CD2 3.45Å; Q146-F150 WeakPolarHBondContact O-CG 3.37Å; Q146-F150 PolarHBondContact O-N 2.92Å
147R70.4Confident70.2Confident129 Ų12977.3 Ų77.349%0.48740%0.402SS..Hα-helixtrans-59.4-39.7177.2-167.8-179.1-63.7173.44.4112.1L142 G143 N144 F150 R151L142-R147 PolarHBondContact O-NH2 3.08Å; G143-R147 PolarHBondContact O-N 2.98Å; N144-R147 PolarHBondContact O-N 3.41Å; R147-F150 PolarHBondContact O-N 3.43Å; R147-R151 WeakPolarHBondContact O-CB 3.48Å; R147-R151 PolarHBondContact O-N 2.92Å
148A68.9Low70.4Confident46 Ų4675.7 Ų75.738%0.3839%0.388SS..Hα-helixtrans-66.3-46.3176.500000112.2N144 E145 Q146 F150 R151 V152N144-A148 WeakPolarHBondContact O-CB 3.35Å; N144-A148 PolarHBondContact O-N 3.46Å; E145-A148 PolarHBondContact O-N 3.26Å; Q146-A148 VanDerWaalsContact C-N 3.3Å; Q146-A148 PolarHBondContact O-N 3.33Å; A148-F150 VanDerWaalsContact C-N 3.3Å; A148-F150 PolarHBondContact O-N 2.84Å; A148-R151 PolarHBondContact O-N 2.71Å; A148-V152 WeakPolarHBondContact O-CG2 3.25Å; A148-V152 PolarHBondContact O-N 3.11Å; A148-V152 VanDerWaalsContact O-N 3.13Å
149L67.5Low71Confident106 Ų10674.6 Ų74.656%0.55538%0.376SS*.Hα-helixtrans-58.6-42174.5-76.1167000111.8E145 Q146 V152 M153E145-L149 WeakPolarHBondContact O-CG 3.24Å; E145-L149 PolarHBondContact O-N 3.41Å; Q146-L149 PolarHBondContact O-N 2.88Å; L149-V152 PolarHBondContact O-N 2.87Å; L149-M153 WeakPolarHBondContact O-CB 3.39Å; L149-M153 PolarHBondContact O-N 3.45Å; L149-M153 VanDerWaalsContact O-N 3.11Å
150F67.7Low71.9Confident44 Ų4471.9 Ų71.919%0.19336%0.356CS..Hα-helixtrans-66.6-43.3177.2-77-59.6000112.9L142 Q146 R147 A148 V152 M153 D154L142-F150 HydrophobicContact CD2-CD2 3.86Å; L142-F150 HydrophobicContact CD2-CE2 3.51Å; Q146-F150 HydrophobicContact CB-CD2 4.35Å; Q146-F150 HydrophobicContact CB-CE2 4.18Å; Q146-F150 WeakPolarHBondContact O-CD2 3.45Å; Q146-F150 WeakPolarHBondContact O-CG 3.37Å; Q146-F150 PolarHBondContact O-N 2.92Å; R147-F150 PolarHBondContact O-N 3.43Å; A148-F150 VanDerWaalsContact C-N 3.3Å; A148-F150 PolarHBondContact O-N 2.84Å; F150-V152 VanDerWaalsContact C-N 3.27Å; F150-V152 PolarHBondContact O-N 3.29Å; F150-M153 HydrophobicContact CD1-CE 3.83Å; F150-M153 HydrophobicContact CD1-SD 4.19Å; F150-M153 HydrophobicContact CE1-CE 4.4Å; F150-M153 PolarHBondContact O-N 3.29Å; F150-D154 VanDerWaalsContact O-CB 3.31Å; F150-D154 WeakPolarHBondContact O-CB 3.24Å; F150-D154 PolarHBondContact O-N 3.49Å
151R72.4Confident72.5Confident202 Ų20270.7 Ų70.776%0.76234%0.34SS*.Hα-helixtrans-59.1-41177-177.3-177.8-94.5-173-6.6111.3R147 A148 L155R147-R151 WeakPolarHBondContact O-CB 3.48Å; R147-R151 PolarHBondContact O-N 2.92Å; A148-R151 PolarHBondContact O-N 2.71Å; R151-L155 WeakPolarHBondContact O-CB 3.31Å; R151-L155 PolarHBondContact O-N 3.45Å
152V71.1Confident73.7Confident33 Ų3367.4 Ų67.420%0.233%0.334CS..Hα-helixtrans-65.4-41.6177.5171.80000111.5A148 L149 F150 R156 T215 L217A148-V152 WeakPolarHBondContact O-CG2 3.25Å; A148-V152 PolarHBondContact O-N 3.11Å; A148-V152 VanDerWaalsContact O-N 3.13Å; L149-V152 PolarHBondContact O-N 2.87Å; F150-V152 VanDerWaalsContact C-N 3.27Å; F150-V152 PolarHBondContact O-N 3.29Å; V152-R156 VanDerWaalsContact O-CG 3.32Å; V152-R156 WeakPolarHBondContact O-CG 3.42Å; V152-R156 PolarHBondContact O-N 3.45Å; V152-T215 WeakPolarHBondContact CG1-O 3.49Å; V152-L217 HydrophobicContact CG2-CD1 3.93Å
153M68.7Low74.7Confident32 Ų3266.8 Ų66.816%0.15833%0.331CS..Hα-helixtrans-68.1-42.1179.4-178.9-163.387.500112.4T18 L149 F150 L155 R156 M157T18-M153 HydrophobicContact CG2-CE 3.38Å; T18-M153 HydrophobicContact CG2-SD 3.25Å; T18-M153 WeakPolarHBondContact CG2-SD 3.5Å; T18-M153 PolarHBondContact OG1-SD 2.98Å; L149-M153 WeakPolarHBondContact O-CB 3.39Å; L149-M153 PolarHBondContact O-N 3.45Å; L149-M153 VanDerWaalsContact O-N 3.11Å; F150-M153 HydrophobicContact CD1-CE 3.83Å; F150-M153 HydrophobicContact CD1-SD 4.19Å; F150-M153 HydrophobicContact CE1-CE 4.4Å; F150-M153 PolarHBondContact O-N 3.29Å; M153-L155 VanDerWaalsContact C-N 3.33Å; M153-R156 WeakPolarHBondContact O-CB 3.3Å; M153-R156 PolarHBondContact O-N 3Å; M153-M157 PolarHBondContact O-N 3.34Å
154D74.2Confident75.5Confident41 Ų4165.7 Ų65.722%0.21932%0.319CS..Hα-helixtrans-62.6-43176.1-171.145.1000111.8R129 F150 R156 M157 L158R129-D154 IonicContact CZ-OD1 3.01Å; R129-D154 IonicContact CZ-OD2 3.09Å; R129-D154 IonicContact NE-OD1 2.73Å; R129-D154 PolarHBondContact NE-OD1 3.19Å; R129-D154 IonicContact NH1-OD1 2.71Å; R129-D154 PolarHBondContact NH1-OD1 3.29Å; R129-D154 IonicContact NH1-OD2 2.8Å; R129-D154 PolarHBondContact NH1-OD2 3.32Å; R129-D154 IonicContact NH2-OD1 2.83Å; R129-D154 PolarHBondContact NH2-OD1 3.31Å; R129-D154 IonicContact NH2-OD2 2.72Å; R129-D154 PolarHBondContact NH2-OD2 2.98Å; F150-D154 VanDerWaalsContact O-CB 3.31Å; F150-D154 WeakPolarHBondContact O-CB 3.24Å; F150-D154 PolarHBondContact O-N 3.49Å; D154-R156 VanDerWaalsContact C-N 3.34Å; D154-R156 PolarHBondContact O-N 3.48Å; D154-M157 PolarHBondContact O-N 3.34Å; D154-L158 PolarHBondContact O-N 2.97Å; D154-L158 VanDerWaalsContact O-N 3.08Å
155L78.7Confident76.3Confident75 Ų7563.5 Ų63.539%0.39331%0.309SS..Hα-helixtrans-60.5-43.6173.9-170.270.1000111R151 M153 L158 L159R151-L155 WeakPolarHBondContact O-CB 3.31Å; R151-L155 PolarHBondContact O-N 3.45Å; M153-L155 VanDerWaalsContact C-N 3.33Å; L155-L158 PolarHBondContact O-N 2.99Å; L155-L159 HydrophobicContact CB-CD1 4.43Å; L155-L159 HydrophobicContact CD1-CD1 3.37Å; L155-L159 HydrophobicContact CD2-CD1 4.13Å; L155-L159 HydrophobicContact CG-CD1 3.32Å; L155-L159 WeakPolarHBondContact O-CB 3.24Å; L155-L159 VanDerWaalsContact O-CD1 3.27Å; L155-L159 WeakPolarHBondContact O-CD1 3.3Å; L155-L159 PolarHBondContact O-N 3.28Å
156R78.9Confident77.3Confident47 Ų4762.8 Ų62.818%0.17730%0.304CS..Hα-helixtrans-61.3-47173.5-71.9173-171.4-158.10.9111.8L14 V152 M153 D154 L158 L159 Y160 T215L14-R156 HydrophobicContact CD2-CB 4.09Å; V152-R156 VanDerWaalsContact O-CG 3.32Å; V152-R156 WeakPolarHBondContact O-CG 3.42Å; V152-R156 PolarHBondContact O-N 3.45Å; M153-R156 WeakPolarHBondContact O-CB 3.3Å; M153-R156 PolarHBondContact O-N 3Å; D154-R156 VanDerWaalsContact C-N 3.34Å; D154-R156 PolarHBondContact O-N 3.48Å; R156-L158 PolarHBondContact O-N 3.09Å; R156-L158 VanDerWaalsContact O-N 3.12Å; R156-L159 PolarHBondContact O-N 3.27Å; R156-Y160 HydrophobicContact CB-CD2 4.15Å; R156-Y160 HydrophobicContact CB-CE2 4.13Å; R156-Y160 HydrophobicContact CG-CE2 4.25Å; R156-Y160 WeakPolarHBondContact O-CD2 3.47Å; R156-Y160 PolarHBondContact O-N 3.46Å; R156-Y160 VanDerWaalsContact O-N 3.13Å; R156-T215 HydrophobicContact CG-CG2 3.67Å; R156-T215 PolarHBondContact NE-OG1 2.91Å; R156-T215 VanDerWaalsContact NH2-C 3.3Å; R156-T215 PolarHBondContact NH2-O 2.88Å
157M76.7Confident78.4Confident4 Ų459 Ų592%0.0229%0.287CS..Hα-helixtrans-60.2-20.9178.5-81-176.4165.900113.3L14 V125 A128 M153 D154 P161L14-M157 HydrophobicContact CD2-CE 4.26Å; L14-M157 HydrophobicContact CD2-CG 3.63Å; L14-M157 HydrophobicContact CG-CE 4.26Å; V125-M157 HydrophobicContact CG2-CB 4.36Å; V125-M157 WeakPolarHBondContact CG2-O 3.43Å; A128-M157 HydrophobicContact CB-CE 3.73Å; A128-M157 HydrophobicContact CB-SD 3.51Å; A128-M157 VanDerWaalsContact CB-SD 3.51Å; M153-M157 PolarHBondContact O-N 3.34Å; D154-M157 PolarHBondContact O-N 3.34Å; M157-P161 WeakPolarHBondContact O-CD 3.26Å; M157-P161 WeakPolarHBondContact O-CG 3.12Å
158L80.7Confident79.2Confident84 Ų8454.5 Ų54.544%0.4427%0.269SS..Hα-helixtrans-100.2-40.1178-164.4146.2000112.9D154 L155 R156 P161 L162D154-L158 PolarHBondContact O-N 2.97Å; D154-L158 VanDerWaalsContact O-N 3.08Å; L155-L158 PolarHBondContact O-N 2.99Å; R156-L158 PolarHBondContact O-N 3.09Å; R156-L158 VanDerWaalsContact O-N 3.12Å; L158-P161 WeakPolarHBondContact O-CD 3.38Å; L158-L162 HydrophobicContact CD2-CD1 3.4Å; L158-L162 HydrophobicContact CD2-CG 4.05Å; L158-L162 WeakPolarHBondContact O-CB 3.33Å; L158-L162 VanDerWaalsContact O-CG 3.3Å; L158-L162 WeakPolarHBondContact O-CG 3.16Å; L158-L162 PolarHBondContact O-N 2.85Å; L158-L162 VanDerWaalsContact O-N 3.14Å
159L83.8Confident80Confident50 Ų5053.4 Ų53.426%0.26226%0.263SS..Hα-helixtrans-67.8-42.4179.5-94.5112.3000113.1L155 R156 L162 V163 V211L155-L159 HydrophobicContact CB-CD1 4.43Å; L155-L159 HydrophobicContact CD1-CD1 3.37Å; L155-L159 HydrophobicContact CD2-CD1 4.13Å; L155-L159 HydrophobicContact CG-CD1 3.32Å; L155-L159 WeakPolarHBondContact O-CB 3.24Å; L155-L159 VanDerWaalsContact O-CD1 3.27Å; L155-L159 WeakPolarHBondContact O-CD1 3.3Å; L155-L159 PolarHBondContact O-N 3.28Å; R156-L159 PolarHBondContact O-N 3.27Å; L159-L162 PolarHBondContact O-N 3.44Å; L159-V163 WeakPolarHBondContact O-CG2 3.25Å; L159-V163 PolarHBondContact O-N 2.94Å; L159-V211 HydrophobicContact CB-CG1 3.85Å; L159-V211 HydrophobicContact CB-CG2 4.2Å; L159-V211 HydrophobicContact CD2-CG1 4.35Å; L159-V211 HydrophobicContact CD2-CG2 3.64Å
160Y80.6Confident80.8Confident15 Ų1549.4 Ų49.46%0.05924%0.243CC..Hα-helixtrans-61.9-44.9-179.5-78.5-71.8000112.6Y10 R156 V163 F164 V211 Y212Y10-Y160 HydrophobicContact CD1-CD2 4.32Å; Y10-Y160 HydrophobicContact CD1-CE2 4.49Å; Y10-Y160 HydrophobicContact CD1-CG 4.48Å; Y10-Y160 HydrophobicContact CE1-CD1 4.49Å; Y10-Y160 AromaticContact CE1-CD2 3.55Å; Y10-Y160 HydrophobicContact CE1-CD2 3.55Å; Y10-Y160 HydrophobicContact CE1-CE1 4.4Å; Y10-Y160 AromaticContact CE1-CE2 3.44Å; Y10-Y160 HydrophobicContact CE1-CE2 3.44Å; Y10-Y160 VanDerWaalsContact CE1-CE2 3.44Å; Y10-Y160 HydrophobicContact CE1-CG 4.11Å; Y10-Y160 AromaticContact CE1-CZ 3.9Å; Y10-Y160 AromaticContact CZ-CE2 3.74Å; Y10-Y160 AromaticContact CZ-CZ 3.96Å; Y10-Y160 WeakPolarHBondContact OH-CE2 3.29Å; R156-Y160 HydrophobicContact CB-CD2 4.15Å; R156-Y160 HydrophobicContact CB-CE2 4.13Å; R156-Y160 HydrophobicContact CG-CE2 4.25Å; R156-Y160 WeakPolarHBondContact O-CD2 3.47Å; R156-Y160 PolarHBondContact O-N 3.46Å; R156-Y160 VanDerWaalsContact O-N 3.13Å; Y160-V163 PolarHBondContact O-N 3.24Å; Y160-F164 WeakPolarHBondContact O-CB 3.33Å; Y160-F164 PolarHBondContact O-N 3.32Å; Y160-V211 HydrophobicContact CD1-CG1 4.4Å; Y160-V211 HydrophobicContact CD2-CG1 4.14Å; Y160-V211 HydrophobicContact CE1-CB 4.38Å; Y160-V211 HydrophobicContact CE1-CG1 4.06Å; Y160-V211 HydrophobicContact CE2-CG1 3.76Å; Y160-V211 HydrophobicContact CG-CG1 4.43Å; Y160-Y212 WeakPolarHBondContact OH-CA 3.43Å; Y160-Y212 WeakPolarHBondContact OH-CB 3.45Å; Y160-Y212 WeakPolarHBondContact OH-CD2 3.31Å
161P83.2Confident81.5Confident20 Ų2047.3 Ų47.313%0.1323%0.234CC..Hα-helixtrans-65.2-36.5173.1-26.738.8000113.8I121 M157 L158 F164 V165I121-P161 HydrophobicContact CG2-CB 3.65Å; I121-P161 HydrophobicContact CG2-CG 3.26Å; M157-P161 WeakPolarHBondContact O-CD 3.26Å; M157-P161 WeakPolarHBondContact O-CG 3.12Å; L158-P161 WeakPolarHBondContact O-CD 3.38Å; P161-F164 WeakPolarHBondContact O-CB 3.19Å; P161-F164 PolarHBondContact O-N 3.2Å; P161-V165 WeakPolarHBondContact O-CG2 3.29Å; P161-V165 PolarHBondContact O-N 2.97Å
162L85.9Confident82.2Confident104 Ų10439 Ų3955%0.54521%0.206SC..Hα-helixtrans-63.9-46.7175.6-78.4-178.4000111.8L158 L159 F164 V165 F166L158-L162 HydrophobicContact CD2-CD1 3.4Å; L158-L162 HydrophobicContact CD2-CG 4.05Å; L158-L162 WeakPolarHBondContact O-CB 3.33Å; L158-L162 VanDerWaalsContact O-CG 3.3Å; L158-L162 WeakPolarHBondContact O-CG 3.16Å; L158-L162 PolarHBondContact O-N 2.85Å; L158-L162 VanDerWaalsContact O-N 3.14Å; L159-L162 PolarHBondContact O-N 3.44Å; L162-F164 VanDerWaalsContact C-N 3.25Å; L162-F164 PolarHBondContact O-N 3.35Å; L162-V165 PolarHBondContact O-N 3.45Å; L162-F166 VanDerWaalsContact O-CB 3.27Å; L162-F166 WeakPolarHBondContact O-CB 3.29Å; L162-F166 PolarHBondContact O-N 3Å
163V87.6Confident82.8Confident14 Ų1439.2 Ų39.29%0.08521%0.211CC..Hα-helixtrans-59.1-42174.5170.90000110L159 Y160 F166 C167 L207 V211L159-V163 WeakPolarHBondContact O-CG2 3.25Å; L159-V163 PolarHBondContact O-N 2.94Å; Y160-V163 PolarHBondContact O-N 3.24Å; V163-F166 PolarHBondContact O-N 2.87Å; V163-C167 VanDerWaalsContact O-CB 3.23Å; V163-C167 WeakPolarHBondContact O-CB 3.3Å; V163-C167 PolarHBondContact O-N 2.9Å; V163-C167 PolarHBondContact O-SG 2.96Å; V163-L207 HydrophobicContact CG1-CB 3.63Å; V163-L207 HydrophobicContact CG1-CD1 4.24Å; V163-L207 HydrophobicContact CG2-CB 4.21Å; V163-V211 HydrophobicContact CG2-CG2 3.94Å
164F86.4Confident83.4Confident4 Ų438.1 Ų38.12%0.01821%0.206CC..Hα-helixtrans-59-50.4176.6-179.8-98.7000112.7F4 T7 F114 T117 Y160 P161 L162 C167 W168F4-F164 HydrophobicContact CB-CE2 4.28Å; F4-F164 HydrophobicContact CB-CZ 4.4Å; F4-F164 AromaticContact CD1-CE2 3.41Å; F4-F164 HydrophobicContact CD1-CE2 3.41Å; F4-F164 VanDerWaalsContact CD1-CE2 3.41Å; F4-F164 AromaticContact CD1-CZ 3.81Å; F4-F164 HydrophobicContact CD1-CZ 3.81Å; F4-F164 AromaticContact CE1-CE2 3.82Å; F4-F164 HydrophobicContact CE1-CE2 3.82Å; F4-F164 HydrophobicContact CE1-CZ 4.07Å; F4-F164 HydrophobicContact CG-CE2 4.05Å; F4-F164 HydrophobicContact CG-CZ 4.11Å; T7-F164 HydrophobicContact CG2-CD2 4.37Å; F114-F164 AromaticContact CD2-CE1 3.48Å; F114-F164 HydrophobicContact CD2-CE1 3.48Å; F114-F164 VanDerWaalsContact CD2-CE1 3.48Å; F114-F164 AromaticContact CD2-CZ 3.56Å; F114-F164 HydrophobicContact CD2-CZ 3.56Å; F114-F164 AromaticContact CE2-CD1 3.94Å; F114-F164 HydrophobicContact CE2-CD1 3.94Å; F114-F164 AromaticContact CE2-CE1 3.23Å; F114-F164 HydrophobicContact CE2-CE1 3.23Å; F114-F164 AromaticContact CE2-CZ 3.76Å; F114-F164 HydrophobicContact CE2-CZ 3.76Å; F114-F164 HydrophobicContact CG-CE1 4.46Å; F114-F164 HydrophobicContact CZ-CE1 4.07Å; T117-F164 VanDerWaalsContact OG1-CZ 3.31Å; T117-F164 WeakPolarHBondContact OG1-CZ 3.36Å; Y160-F164 WeakPolarHBondContact O-CB 3.33Å; Y160-F164 PolarHBondContact O-N 3.32Å; P161-F164 WeakPolarHBondContact O-CB 3.19Å; P161-F164 PolarHBondContact O-N 3.2Å; L162-F164 VanDerWaalsContact C-N 3.25Å; L162-F164 PolarHBondContact O-N 3.35Å; F164-C167 PolarHBondContact O-N 3.12Å; F164-W168 AromaticContact CD2-CD1 3.8Å; F164-W168 AromaticContact CE2-CD1 3.88Å; F164-W168 WeakPolarHBondContact O-CB 3.34Å; F164-W168 PolarHBondContact O-N 2.84Å; F164-W168 VanDerWaalsContact O-N 3.08Å
165V87Confident83.7Confident63 Ų6336.4 Ų36.438%0.38220%0.197SC..Hα-helixtrans-65.9-39.6178.9173.10000111.4L118 P161 L162 G169L118-V165 HydrophobicContact CD1-CG2 3.66Å; P161-V165 WeakPolarHBondContact O-CG2 3.29Å; P161-V165 PolarHBondContact O-N 2.97Å; L162-V165 PolarHBondContact O-N 3.45Å; V165-G169 WeakPolarHBondContact O-CA 3.2Å; V165-G169 PolarHBondContact O-N 3.28Å
166F88.3Confident83.8Confident127 Ų12739 Ų3956%0.55721%0.205SC*.Hα-helixtrans-64-46177.1179.2-99.9000111.9L162 V163 P170 T200 L207L162-F166 VanDerWaalsContact O-CB 3.27Å; L162-F166 WeakPolarHBondContact O-CB 3.29Å; L162-F166 PolarHBondContact O-N 3Å; V163-F166 PolarHBondContact O-N 2.87Å; F166-P170 WeakPolarHBondContact O-CD 3.36Å; F166-T200 HydrophobicContact CE1-CG2 4.1Å; F166-T200 HydrophobicContact CZ-CG2 4.25Å; F166-L207 HydrophobicContact CD1-CD1 3.97Å; F166-L207 HydrophobicContact CE1-CD1 4.15Å
167C87.8Confident83.7Confident0 Ų039.8 Ų39.80%021%0.213CC..Hα-helixtrans-69-38.2-176.6-68.80000113.1V163 F164 T200 Q204V163-C167 VanDerWaalsContact O-CB 3.23Å; V163-C167 WeakPolarHBondContact O-CB 3.3Å; V163-C167 PolarHBondContact O-N 2.9Å; V163-C167 PolarHBondContact O-SG 2.96Å; F164-C167 PolarHBondContact O-N 3.12Å; C167-T200 WeakPolarHBondContact CB-O 3.47Å; C167-T200 CarbonylContact O-C 3.58Å; C167-T200 WeakPolarHBondContact O-CB 3.11Å; C167-T200 PolarHBondContact O-OG1 2.88Å; C167-T200 PolarHBondContact SG-O 2.91Å; C167-Q204 HydrophobicContact CB-CB 3.95Å; C167-Q204 HydrophobicContact CB-CG 3.86Å
168W86.3Confident83.6Confident33 Ų3341.9 Ų41.913%0.12522%0.221CC..Hα-helixtrans-106.1-12.3-172.7-66.1100.9000114.2F4 F110 F114 F164 A171 V172 Q204F4-W168 AromaticContact CE1-CD1 3.9Å; F4-W168 AromaticContact CE1-CD2 3.42Å; F4-W168 HydrophobicContact CE1-CD2 3.42Å; F4-W168 VanDerWaalsContact CE1-CD2 3.42Å; F4-W168 AromaticContact CE1-CE2 3.39Å; F4-W168 AromaticContact CE1-CE3 3.83Å; F4-W168 HydrophobicContact CE1-CE3 3.83Å; F4-W168 AromaticContact CE1-CG 3.77Å; F4-W168 HydrophobicContact CE1-CG 3.77Å; F4-W168 HydrophobicContact CE1-CH2 4.14Å; F4-W168 AromaticContact CE1-CZ2 3.77Å; F4-W168 HydrophobicContact CE1-CZ2 3.77Å; F4-W168 HydrophobicContact CE1-CZ3 4.17Å; F4-W168 AromaticContact CE1-NE1 3.7Å; F4-W168 AromaticContact CZ-CD2 3.83Å; F4-W168 HydrophobicContact CZ-CD2 3.83Å; F4-W168 AromaticContact CZ-CE3 3.8Å; F4-W168 HydrophobicContact CZ-CE3 3.8Å; F4-W168 HydrophobicContact CZ-CG 4.26Å; F4-W168 HydrophobicContact CZ-CH2 4.48Å; F4-W168 HydrophobicContact CZ-CZ3 4.13Å; F110-W168 AromaticContact CE2-CE3 3.92Å; F110-W168 HydrophobicContact CE2-CE3 3.92Å; F110-W168 AromaticContact CE2-CZ3 3.89Å; F110-W168 HydrophobicContact CE2-CZ3 3.89Å; F110-W168 AromaticContact CZ-CE3 3.86Å; F110-W168 HydrophobicContact CZ-CE3 3.86Å; F110-W168 HydrophobicContact CZ-CZ3 4.25Å; F114-W168 HydrophobicContact CD2-CB 4.13Å; F114-W168 HydrophobicContact CE2-CB 3.79Å; F164-W168 AromaticContact CD2-CD1 3.8Å; F164-W168 AromaticContact CE2-CD1 3.88Å; F164-W168 WeakPolarHBondContact O-CB 3.34Å; F164-W168 PolarHBondContact O-N 2.84Å; F164-W168 VanDerWaalsContact O-N 3.08Å; W168-A171 HydrophobicContact CE3-CB 4.4Å; W168-A171 WeakPolarHBondContact O-CB 3.34Å; W168-A171 PolarHBondContact O-N 3.02Å; W168-V172 WeakPolarHBondContact O-CG2 3.44Å; W168-V172 PolarHBondContact O-N 2.75Å; W168-Q204 VanDerWaalsContact CE2-OE1 3.24Å
169G85.8Confident83.3Confident23 Ų2342.4 Ų42.424%0.23723%0.227CC..Hα-helixtrans-55.1-47.717900000113.6V165 A171 V172 A173V165-G169 WeakPolarHBondContact O-CA 3.2Å; V165-G169 PolarHBondContact O-N 3.28Å; G169-A171 VanDerWaalsContact C-N 3.33Å; G169-A171 PolarHBondContact O-N 3.11Å; G169-V172 PolarHBondContact O-N 3.24Å; G169-A173 WeakPolarHBondContact O-CB 3.44Å; G169-A173 PolarHBondContact O-N 2.97Å
170P84.7Confident83Confident22 Ų2242.7 Ų42.714%0.14324%0.236CC..Hα-helixtrans-59.7-41176.3-26.636.3000113.1F166 A173 L174 L193 E197 T200F166-P170 WeakPolarHBondContact O-CD 3.36Å; P170-A173 PolarHBondContact O-N 3.45Å; P170-L174 WeakPolarHBondContact O-CB 3.31Å; P170-L174 PolarHBondContact O-N 3.42Å; P170-L193 HydrophobicContact CB-CD2 4.45Å; P170-E197 HydrophobicContact CB-CB 4.25Å; P170-T200 HydrophobicContact CG-CG2 4.14Å
171A84Confident82.4Confident1 Ų148.2 Ų48.21%0.00826%0.261CS..Hα-helixtrans-65.4-40.2177.400000112.1M81 F110 W168 G169 L174 A175 E197M81-A171 HydrophobicContact CE-CB 4.02Å; F110-A171 HydrophobicContact CE1-CB 4.37Å; F110-A171 HydrophobicContact CZ-CB 4Å; W168-A171 HydrophobicContact CE3-CB 4.4Å; W168-A171 WeakPolarHBondContact O-CB 3.34Å; W168-A171 PolarHBondContact O-N 3.02Å; G169-A171 VanDerWaalsContact C-N 3.33Å; G169-A171 PolarHBondContact O-N 3.11Å; A171-L174 PolarHBondContact O-N 3.11Å; A171-A175 VanDerWaalsContact O-CB 3.29Å; A171-A175 WeakPolarHBondContact O-CB 3.19Å; A171-A175 PolarHBondContact O-N 3.04Å; A171-E197 HydrophobicContact CB-CG 3.92Å
172V85.7Confident81.5Confident27 Ų2751.4 Ų51.416%0.16428%0.282CS..Hα-helixtrans-67.8-42.6175.9171.60000111.1F110 L111 F114 W168 G169 L174 A175 F176F110-V172 HydrophobicContact CE1-CG2 3.79Å; F110-V172 HydrophobicContact CZ-CG2 4.29Å; L111-V172 HydrophobicContact CD2-CG1 3.88Å; F114-V172 HydrophobicContact CB-CG2 4.31Å; F114-V172 HydrophobicContact CD1-CG1 4.28Å; F114-V172 HydrophobicContact CD1-CG2 3.64Å; F114-V172 HydrophobicContact CD2-CG2 3.77Å; F114-V172 HydrophobicContact CE1-CB 4.49Å; F114-V172 HydrophobicContact CE1-CG1 4.22Å; F114-V172 HydrophobicContact CE1-CG2 3.81Å; F114-V172 HydrophobicContact CE2-CG2 3.93Å; F114-V172 HydrophobicContact CG-CG2 3.63Å; F114-V172 HydrophobicContact CZ-CG2 3.95Å; W168-V172 WeakPolarHBondContact O-CG2 3.44Å; W168-V172 PolarHBondContact O-N 2.75Å; G169-V172 PolarHBondContact O-N 3.24Å; V172-L174 VanDerWaalsContact C-N 3.33Å; V172-L174 PolarHBondContact O-N 3.21Å; V172-A175 PolarHBondContact O-N 2.94Å; V172-F176 WeakPolarHBondContact O-CB 3.21Å; V172-F176 PolarHBondContact O-N 2.65Å
173A84Confident80.1Confident38 Ų3851 Ų5131%0.31429%0.287SS..Hα-helixtrans-61.4-43.3175.300000111.1G169 P170 F176 L177 L193G169-A173 WeakPolarHBondContact O-CB 3.44Å; G169-A173 PolarHBondContact O-N 2.97Å; P170-A173 PolarHBondContact O-N 3.45Å; A173-F176 PolarHBondContact O-N 3.49Å; A173-L177 WeakPolarHBondContact O-CB 3.41Å; A173-L177 VanDerWaalsContact O-CG 3.3Å; A173-L177 WeakPolarHBondContact O-CG 3.42Å; A173-L177 PolarHBondContact O-N 3.43Å; A173-L193 HydrophobicContact CB-CD2 4.22Å
174L80.8Confident78.4Confident9 Ų954 Ų545%0.04731%0.306CS..Hα-helixtrans-64.1-45.4175.6-172.270.7000111.7P170 A171 V172 F176 L177 R178 L193 Y194 E197P170-L174 WeakPolarHBondContact O-CB 3.31Å; P170-L174 PolarHBondContact O-N 3.42Å; A171-L174 PolarHBondContact O-N 3.11Å; V172-L174 VanDerWaalsContact C-N 3.33Å; V172-L174 PolarHBondContact O-N 3.21Å; L174-F176 VanDerWaalsContact C-N 3.31Å; L174-F176 PolarHBondContact O-N 3.46Å; L174-L177 PolarHBondContact O-N 3.4Å; L174-R178 VanDerWaalsContact O-CG 3.25Å; L174-R178 WeakPolarHBondContact O-CG 3.49Å; L174-R178 PolarHBondContact O-N 3.28Å; L174-L193 HydrophobicContact CD1-CB 4.32Å; L174-Y194 HydrophobicContact CD1-CD2 4.12Å; L174-Y194 HydrophobicContact CD1-CE2 3.95Å; L174-Y194 HydrophobicContact CD2-CD1 3.68Å; L174-Y194 HydrophobicContact CD2-CD2 4.27Å; L174-Y194 HydrophobicContact CD2-CE1 3.54Å; L174-Y194 HydrophobicContact CD2-CE2 4.13Å; L174-Y194 HydrophobicContact CD2-CG 4.07Å; L174-E197 WeakPolarHBondContact CD2-OE2 3.44Å
175A80.5Confident76.9Confident4 Ų456 Ų563%0.03333%0.327CS..Hα-helixtrans-59.6-41.7175.800000112I107 F110 L111 A171 V172 R178 V179I107-A175 HydrophobicContact CG2-CB 4.25Å; F110-A175 HydrophobicContact CD1-CB 4.36Å; L111-A175 HydrophobicContact CD1-CB 4.43Å; L111-A175 HydrophobicContact CD2-CB 4.01Å; L111-A175 HydrophobicContact CG-CB 4.23Å; A171-A175 VanDerWaalsContact O-CB 3.29Å; A171-A175 WeakPolarHBondContact O-CB 3.19Å; A171-A175 PolarHBondContact O-N 3.04Å; V172-A175 PolarHBondContact O-N 2.94Å; A175-R178 PolarHBondContact O-N 3.43Å; A175-V179 WeakPolarHBondContact O-CG2 3.41Å; A175-V179 PolarHBondContact O-N 3.29Å
176F80.9Confident75.4Confident129 Ų12959.1 Ų59.157%0.56634%0.337SS*.Hα-helixtrans-66.2-45.1176.1-178-98.3000112V172 A173 L174 R178 V179 A180V172-F176 WeakPolarHBondContact O-CB 3.21Å; V172-F176 PolarHBondContact O-N 2.65Å; A173-F176 PolarHBondContact O-N 3.49Å; L174-F176 VanDerWaalsContact C-N 3.31Å; L174-F176 PolarHBondContact O-N 3.46Å; F176-R178 VanDerWaalsContact C-N 3.27Å; F176-R178 PolarHBondContact O-N 3.4Å; F176-V179 PolarHBondContact O-N 2.91Å; F176-V179 VanDerWaalsContact O-N 3.11Å; F176-A180 HydrophobicContact CD1-CB 4.35Å; F176-A180 HydrophobicContact CE1-CB 3.99Å; F176-A180 HydrophobicContact CZ-CB 4.21Å; F176-A180 WeakPolarHBondContact O-CB 3.25Å; F176-A180 PolarHBondContact O-N 3.32Å
177L77.6Confident74.4Confident65 Ų6554.6 Ų54.634%0.3433%0.327SS..Hα-helixtrans-59.9-38.1176.8-75.6172.7000112.1A173 L174 V179 A180 K181 L193A173-L177 WeakPolarHBondContact O-CB 3.41Å; A173-L177 VanDerWaalsContact O-CG 3.3Å; A173-L177 WeakPolarHBondContact O-CG 3.42Å; A173-L177 PolarHBondContact O-N 3.43Å; L174-L177 PolarHBondContact O-N 3.4Å; L177-V179 VanDerWaalsContact C-N 3.3Å; L177-V179 PolarHBondContact O-N 2.98Å; L177-A180 PolarHBondContact O-N 3.23Å; L177-K181 CarbonylContact O-C 3.55Å; L177-K181 VanDerWaalsContact O-C 3.28Å; L177-K181 PolarHBondContact O-N 3.02Å; L177-L193 HydrophobicContact CD1-CD1 3.38Å
178R73.7Confident73.6Confident47 Ų4760.3 Ų60.318%0.17736%0.362CS..Hα-helixtrans-62.2-35.7175.5-71.2167-173.3-106.915.4113.1T83 I107 L174 A175 F176 Y194T83-R178 PolarHBondContact OG1-NH1 3.44Å; T83-R178 PolarHBondContact OG1-NH2 3.11Å; I107-R178 HydrophobicContact CD1-CB 4.45Å; L174-R178 VanDerWaalsContact O-CG 3.25Å; L174-R178 WeakPolarHBondContact O-CG 3.49Å; L174-R178 PolarHBondContact O-N 3.28Å; A175-R178 PolarHBondContact O-N 3.43Å; F176-R178 VanDerWaalsContact C-N 3.27Å; F176-R178 PolarHBondContact O-N 3.4Å; R178-Y194 VanDerWaalsContact NH2-CZ 3.3Å; R178-Y194 PolarHBondContact NH2-OH 3.41Å
179V74.5Confident73Confident96 Ų9661.9 Ų61.958%0.58238%0.381SS*.Hα-helixtrans-81-42.4178.5176.60000111.1I107 A175 F176 L177I107-V179 HydrophobicContact CG2-CG2 3.76Å; A175-V179 WeakPolarHBondContact O-CG2 3.41Å; A175-V179 PolarHBondContact O-N 3.29Å; F176-V179 PolarHBondContact O-N 2.91Å; F176-V179 VanDerWaalsContact O-N 3.11Å; L177-V179 VanDerWaalsContact C-N 3.3Å; L177-V179 PolarHBondContact O-N 2.98Å
180A76.9Confident72.4Confident55 Ų5561 Ų6146%0.45537%0.373SS..Hα-helixtrans-79.8-39.1-173.200000113.5F176 L177F176-A180 HydrophobicContact CD1-CB 4.35Å; F176-A180 HydrophobicContact CE1-CB 3.99Å; F176-A180 HydrophobicContact CZ-CB 4.21Å; F176-A180 WeakPolarHBondContact O-CB 3.25Å; F176-A180 PolarHBondContact O-N 3.32Å; L177-A180 PolarHBondContact O-N 3.23Å
181K69.6Low72Confident131 Ų13163.9 Ų63.957%0.5739%0.389SS*.  trans-146.784.3-177.6-71.9-167.7175.7170.40111.8L177 S183 T184L177-K181 CarbonylContact O-C 3.55Å; L177-K181 VanDerWaalsContact O-C 3.28Å; L177-K181 PolarHBondContact O-N 3.02Å; K181-S183 PolarHBondContact O-N 3.19Å; K181-S183 VanDerWaalsContact O-N 3.11Å; K181-T184 WeakPolarHBondContact CB-OG1 3.47Å; K181-T184 PolarHBondContact O-N 3.18Å; K181-T184 VanDerWaalsContact O-N 3.16Å
182P63.7Low71.8Confident88 Ų8866.9 Ų66.957%0.57141%0.41SS*.G310 helixtrans-61.6-22.7-178.223.1-32.9000113.9
183S57.4Low71.5Confident95 Ų9567.5 Ų67.566%0.66441%0.412SS*.G310 helixtrans-79.5-20.3179.246.90000114.6K181 G185 H186K181-S183 PolarHBondContact O-N 3.19Å; K181-S183 VanDerWaalsContact O-N 3.11Å; S183-G185 VanDerWaalsContact C-N 3.32Å; S183-G185 PolarHBondContact O-N 2.86Å; S183-H186 PolarHBondContact O-ND1 2.94Å
184T51.7Low71.2Confident77 Ų7768.6 Ų68.647%0.47241%0.408SS..G310 helixtrans-84.8-2.7-175.2-450000113.4K181 H186 G187K181-T184 WeakPolarHBondContact CB-OG1 3.47Å; K181-T184 PolarHBondContact O-N 3.18Å; K181-T184 VanDerWaalsContact O-N 3.16Å; T184-H186 PolarHBondContact O-N 2.91Å; T184-H186 VanDerWaalsContact O-N 3.1Å; T184-G187 PolarHBondContact O-N 3.48Å
185G54.3Low71.2Confident45 Ų4572.5 Ų72.546%0.46443%0.428SS..G310 helixtrans-64.7-10.2178.600000115.7S183S183-G185 VanDerWaalsContact C-N 3.32Å; S183-G185 PolarHBondContact O-N 2.86Å
186H54.8Low71.2Confident129 Ų12974.6 Ų74.660%0.59744%0.443SS*.G310 helixtrans-94.6-1.9-176.5-56.292.1000114.1S183 T184S183-H186 PolarHBondContact O-ND1 2.94Å; T184-H186 PolarHBondContact O-N 2.91Å; T184-H186 VanDerWaalsContact O-N 3.1Å
187G67.5Low71.4Confident33 Ų3369.6 Ų69.634%0.3442%0.421SS..SBendtrans-87.7163.7-179.400000113.7T184 A189 G190 V191T184-G187 PolarHBondContact O-N 3.48Å; G187-A189 PolarHBondContact O-N 3.4Å; G187-A189 VanDerWaalsContact O-N 3.08Å; G187-G190 PolarHBondContact O-N 2.96Å; G187-V191 PolarHBondContact O-N 3.48Å
188V72.1Confident71.5Confident120 Ų12069.3 Ų69.373%0.72743%0.429SS*.Hα-helixtrans-48.1-38.8174.6178.40000111.9G190 V191 C192V188-G190 VanDerWaalsContact C-N 3.34Å; V188-G190 PolarHBondContact O-N 2.87Å; V188-V191 PolarHBondContact O-N 2.84Å; V188-C192 PolarHBondContact O-N 3.46Å; V188-C192 PolarHBondContact O-SG 3.37Å
189A72.3Confident71.9Confident65 Ų6574.5 Ų74.554%0.53745%0.453SS..Hα-helixtrans-60.6-38.1177.600000113.6G187 L193G187-A189 PolarHBondContact O-N 3.4Å; G187-A189 VanDerWaalsContact O-N 3.08Å; A189-L193 WeakPolarHBondContact O-CB 3.21Å; A189-L193 VanDerWaalsContact O-CG 3.27Å; A189-L193 WeakPolarHBondContact O-CG 3.43Å; A189-L193 PolarHBondContact O-N 3.46Å
190G73.5Confident72.4Confident5 Ų570.6 Ų70.65%0.05243%0.429CS..Hα-helixtrans-65.1-46.417600000111.3G187 V188 L193 Y194G187-G190 PolarHBondContact O-N 2.96Å; V188-G190 VanDerWaalsContact C-N 3.34Å; V188-G190 PolarHBondContact O-N 2.87Å; G190-L193 PolarHBondContact O-N 3.5Å; G190-Y194 WeakPolarHBondContact O-CD2 3.5Å; G190-Y194 PolarHBondContact O-N 2.95Å
191V76.6Confident72.6Confident82 Ų8270 Ų7050%0.49742%0.422SS..Hα-helixtrans-61.4-46.1177.4179.90000111.3G187 V188 L193 Y194 I195G187-V191 PolarHBondContact O-N 3.48Å; V188-V191 PolarHBondContact O-N 2.84Å; V191-L193 VanDerWaalsContact C-N 3.31Å; V191-L193 PolarHBondContact O-N 3.04Å; V191-Y194 PolarHBondContact O-N 3.32Å; V191-I195 HydrophobicContact CG1-CD1 3.92Å; V191-I195 WeakPolarHBondContact O-CG1 3.43Å; V191-I195 PolarHBondContact O-N 3.36Å
192C79.7Confident73.2Confident65 Ų6567.6 Ų67.644%0.43943%0.426SS..Hα-helixtrans-59.7-40.3176.1-69.20000112.3V188 S196V188-C192 PolarHBondContact O-N 3.46Å; V188-C192 PolarHBondContact O-SG 3.37Å; C192-S196 WeakPolarHBondContact O-CB 3.31Å; C192-S196 PolarHBondContact O-N 2.69Å; C192-S196 PolarHBondContact O-OG 3.19Å
193L79.9Confident74.3Confident39 Ų3964.8 Ų64.820%0.20441%0.408CS..Hα-helixtrans-68.3-38.4177-75.9171.8000112.4P170 A173 L174 L177 A189 G190 V191 S196 E197P170-L193 HydrophobicContact CB-CD2 4.45Å; A173-L193 HydrophobicContact CB-CD2 4.22Å; L174-L193 HydrophobicContact CD1-CB 4.32Å; L177-L193 HydrophobicContact CD1-CD1 3.38Å; A189-L193 WeakPolarHBondContact O-CB 3.21Å; A189-L193 VanDerWaalsContact O-CG 3.27Å; A189-L193 WeakPolarHBondContact O-CG 3.43Å; A189-L193 PolarHBondContact O-N 3.46Å; G190-L193 PolarHBondContact O-N 3.5Å; V191-L193 VanDerWaalsContact C-N 3.31Å; V191-L193 PolarHBondContact O-N 3.04Å; L193-S196 PolarHBondContact O-N 3.36Å; L193-E197 VanDerWaalsContact O-CB 3.26Å; L193-E197 WeakPolarHBondContact O-CB 3.31Å; L193-E197 PolarHBondContact O-N 3.43Å
194Y77.1Confident75.5Confident61 Ų6161 Ų6124%0.23938%0.381CS..Hα-helixtrans-64.4-46174.4-89.1-72.2000112.7T83 L174 R178 G190 V191 S196 E197 A198T83-Y194 PolarHBondContact OG1-OH 3.08Å; L174-Y194 HydrophobicContact CD1-CD2 4.12Å; L174-Y194 HydrophobicContact CD1-CE2 3.95Å; L174-Y194 HydrophobicContact CD2-CD1 3.68Å; L174-Y194 HydrophobicContact CD2-CD2 4.27Å; L174-Y194 HydrophobicContact CD2-CE1 3.54Å; L174-Y194 HydrophobicContact CD2-CE2 4.13Å; L174-Y194 HydrophobicContact CD2-CG 4.07Å; R178-Y194 VanDerWaalsContact NH2-CZ 3.3Å; R178-Y194 PolarHBondContact NH2-OH 3.41Å; G190-Y194 WeakPolarHBondContact O-CD2 3.5Å; G190-Y194 PolarHBondContact O-N 2.95Å; V191-Y194 PolarHBondContact O-N 3.32Å; Y194-S196 VanDerWaalsContact C-N 3.32Å; Y194-E197 PolarHBondContact O-N 2.99Å; Y194-A198 PolarHBondContact O-N 3.43Å
195I80.9Confident77.1Confident91 Ų9159.5 Ų59.547%0.46738%0.38SS..Hα-helixtrans-61.9-47.3176.5-66.2169.6000108.9V191 E197 A198 F199V191-I195 HydrophobicContact CG1-CD1 3.92Å; V191-I195 WeakPolarHBondContact O-CG1 3.43Å; V191-I195 PolarHBondContact O-N 3.36Å; I195-E197 PolarHBondContact O-N 3.13Å; I195-A198 PolarHBondContact O-N 2.97Å; I195-F199 HydrophobicContact CG2-CD2 3.82Å; I195-F199 HydrophobicContact CG2-CE2 3.87Å; I195-F199 WeakPolarHBondContact O-CD2 3.5Å; I195-F199 PolarHBondContact O-N 2.76Å; I195-F199 VanDerWaalsContact O-N 3.11Å
196S81Confident78.6Confident49 Ų4964 Ų6434%0.34339%0.387SS..Hα-helixtrans-59.2-47.2178.9-62.20000111.1C192 L193 Y194 A198 F199 T200C192-S196 WeakPolarHBondContact O-CB 3.31Å; C192-S196 PolarHBondContact O-N 2.69Å; C192-S196 PolarHBondContact O-OG 3.19Å; L193-S196 PolarHBondContact O-N 3.36Å; Y194-S196 VanDerWaalsContact C-N 3.32Å; S196-A198 VanDerWaalsContact C-N 3.34Å; S196-A198 PolarHBondContact O-N 3.27Å; S196-F199 PolarHBondContact O-N 2.9Å; S196-T200 WeakPolarHBondContact O-CB 3.47Å; S196-T200 WeakPolarHBondContact O-CG2 3.5Å; S196-T200 PolarHBondContact O-N 3.4Å; S196-T200 PolarHBondContact O-OG1 3.04Å
197E84.4Confident80.1Confident23 Ų2359.8 Ų59.811%0.10737%0.368CS..Hα-helixtrans-55.2-46.3175.1171.4180-166.600112.3P170 A171 L174 L193 Y194 I195 F199 T200 S201P170-E197 HydrophobicContact CB-CB 4.25Å; A171-E197 HydrophobicContact CB-CG 3.92Å; L174-E197 WeakPolarHBondContact CD2-OE2 3.44Å; L193-E197 VanDerWaalsContact O-CB 3.26Å; L193-E197 WeakPolarHBondContact O-CB 3.31Å; L193-E197 PolarHBondContact O-N 3.43Å; Y194-E197 PolarHBondContact O-N 2.99Å; I195-E197 PolarHBondContact O-N 3.13Å; E197-F199 PolarHBondContact O-N 3.04Å; E197-T200 PolarHBondContact O-N 2.72Å; E197-S201 WeakPolarHBondContact O-CB 3.43Å; E197-S201 PolarHBondContact O-N 3.01Å; E197-S201 PolarHBondContact O-OG 3.04Å
198A80.8Confident80.9Confident60 Ų6060 Ų6050%0.49636%0.362SS..Hα-helixtrans-61.1-44.8-179.500000111.7Y194 I195 S196 S201 A202Y194-A198 PolarHBondContact O-N 3.43Å; I195-A198 PolarHBondContact O-N 2.97Å; S196-A198 VanDerWaalsContact C-N 3.34Å; S196-A198 PolarHBondContact O-N 3.27Å; A198-S201 PolarHBondContact O-OG 2.81Å; A198-A202 WeakPolarHBondContact O-CB 3.42Å; A198-A202 PolarHBondContact O-N 3.29Å
199F82.2Confident81.4Confident155 Ų15558.6 Ų58.668%0.6836%0.356SS*.Hα-helixtrans-70.3-48177.4-83.1-78.7000112.4I195 S196 E197 S203I195-F199 HydrophobicContact CG2-CD2 3.82Å; I195-F199 HydrophobicContact CG2-CE2 3.87Å; I195-F199 WeakPolarHBondContact O-CD2 3.5Å; I195-F199 PolarHBondContact O-N 2.76Å; I195-F199 VanDerWaalsContact O-N 3.11Å; S196-F199 PolarHBondContact O-N 2.9Å; E197-F199 PolarHBondContact O-N 3.04Å; F199-S203 VanDerWaalsContact O-CB 3.29Å; F199-S203 WeakPolarHBondContact O-CB 3.44Å; F199-S203 PolarHBondContact O-N 3.42Å; F199-S203 PolarHBondContact O-OG 3.22Å
200T83.9Confident82Confident15 Ų1559.8 Ų59.89%0.09235%0.353CS..Hα-helixtrans-70.6-39.3-172.763.90000111.5F166 C167 P170 S196 E197 S203 Q204F166-T200 HydrophobicContact CE1-CG2 4.1Å; F166-T200 HydrophobicContact CZ-CG2 4.25Å; C167-T200 WeakPolarHBondContact CB-O 3.47Å; C167-T200 CarbonylContact O-C 3.58Å; C167-T200 WeakPolarHBondContact O-CB 3.11Å; C167-T200 PolarHBondContact O-OG1 2.88Å; C167-T200 PolarHBondContact SG-O 2.91Å; P170-T200 HydrophobicContact CG-CG2 4.14Å; S196-T200 WeakPolarHBondContact O-CB 3.47Å; S196-T200 WeakPolarHBondContact O-CG2 3.5Å; S196-T200 PolarHBondContact O-N 3.4Å; S196-T200 PolarHBondContact O-OG1 3.04Å; E197-T200 PolarHBondContact O-N 2.72Å; T200-S203 WeakPolarHBondContact CA-OG 3.41Å; T200-S203 PolarHBondContact O-N 3Å; T200-S203 PolarHBondContact O-OG 3.4Å; T200-Q204 PolarHBondContact O-N 3.19Å
201S80.3Confident82.4Confident42 Ų4259.8 Ų59.829%0.29435%0.352SS..Hα-helixtrans-66.1-44.1176.463.80000112.3E197 A198 S203 Q204E197-S201 WeakPolarHBondContact O-CB 3.43Å; E197-S201 PolarHBondContact O-N 3.01Å; E197-S201 PolarHBondContact O-OG 3.04Å; A198-S201 PolarHBondContact O-OG 2.81Å; S201-S203 VanDerWaalsContact C-N 3.31Å; S201-S203 PolarHBondContact O-N 3.39Å; S201-Q204 VanDerWaalsContact O-CB 3.29Å; S201-Q204 WeakPolarHBondContact O-CB 3.24Å; S201-Q204 PolarHBondContact O-N 2.75Å
202A83.4Confident82.4Confident80 Ų8060.5 Ų60.566%0.66135%0.346SS*.Hα-helixtrans-65-35.6176.700000112.2A198 Q204A198-A202 WeakPolarHBondContact O-CB 3.42Å; A198-A202 PolarHBondContact O-N 3.29Å; A202-Q204 PolarHBondContact O-N 3.14Å
203S85.6Confident82.2Confident29 Ų2958.5 Ų58.520%0.20334%0.337CS..Hα-helixtrans-70.4-11.9179.676.50000114.2F199 T200 S201 G205 F206 L207F199-S203 VanDerWaalsContact O-CB 3.29Å; F199-S203 WeakPolarHBondContact O-CB 3.44Å; F199-S203 PolarHBondContact O-N 3.42Å; F199-S203 PolarHBondContact O-OG 3.22Å; T200-S203 WeakPolarHBondContact CA-OG 3.41Å; T200-S203 PolarHBondContact O-N 3Å; T200-S203 PolarHBondContact O-OG 3.4Å; S201-S203 VanDerWaalsContact C-N 3.31Å; S201-S203 PolarHBondContact O-N 3.39Å; S203-G205 VanDerWaalsContact C-N 3.33Å; S203-G205 PolarHBondContact O-N 3.09Å; S203-F206 WeakPolarHBondContact O-CB 3.49Å; S203-F206 PolarHBondContact O-N 3.06Å; S203-F206 VanDerWaalsContact O-N 3.11Å; S203-L207 PolarHBondContact O-N 3.4Å
204Q84.1Confident81.9Confident17 Ų1764.1 Ų64.18%0.07936%0.355CS..Hα-helixtrans-59.5-41.1-173.4-164.9-144.8-48.700113S3 C167 W168 T200 S201 A202 N208S3-Q204 PolarHBondContact OG-NE2 2.86Å; C167-Q204 HydrophobicContact CB-CB 3.95Å; C167-Q204 HydrophobicContact CB-CG 3.86Å; W168-Q204 VanDerWaalsContact CE2-OE1 3.24Å; T200-Q204 PolarHBondContact O-N 3.19Å; S201-Q204 VanDerWaalsContact O-CB 3.29Å; S201-Q204 WeakPolarHBondContact O-CB 3.24Å; S201-Q204 PolarHBondContact O-N 2.75Å; A202-Q204 PolarHBondContact O-N 3.14Å; Q204-N208 PolarHBondContact NE2-ND2 2.94Å; Q204-N208 VanDerWaalsContact O-CB 3.3Å; Q204-N208 WeakPolarHBondContact O-CB 3.41Å; Q204-N208 VanDerWaalsContact O-CG 3.25Å; Q204-N208 PolarHBondContact O-N 3.5Å; Q204-N208 VanDerWaalsContact O-N 3.08Å; Q204-N208 PolarHBondContact O-ND2 2.99Å; Q204-N208 VanDerWaalsContact O-ND2 3.11Å
205G84.3Confident81.4Confident44 Ų4461.5 Ų61.545%0.45435%0.346SS..Hα-helixtrans-64.2-45.4175.900000111.9S203 N208 C209S203-G205 VanDerWaalsContact C-N 3.33Å; S203-G205 PolarHBondContact O-N 3.09Å; G205-N208 PolarHBondContact O-N 2.99Å; G205-C209 PolarHBondContact O-N 3.13Å; G205-C209 PolarHBondContact O-SG 3.3Å; G205-C209 VanDerWaalsContact O-SG 3.32Å
206F86.8Confident80.8Confident139 Ų13963 Ų6361%0.6135%0.346SS*.Hα-helixtrans-61.4-50.1178.9175.1-99.9000112.3S203 N208 C209 L210S203-F206 WeakPolarHBondContact O-CB 3.49Å; S203-F206 PolarHBondContact O-N 3.06Å; S203-F206 VanDerWaalsContact O-N 3.11Å; F206-N208 VanDerWaalsContact C-N 3.33Å; F206-N208 PolarHBondContact O-N 3.33Å; F206-C209 WeakPolarHBondContact O-CB 3.43Å; F206-C209 PolarHBondContact O-N 3.32Å; F206-L210 HydrophobicContact CE1-CD1 4.17Å; F206-L210 HydrophobicContact CZ-CD1 4.3Å; F206-L210 PolarHBondContact O-N 2.88Å
207L85.1Confident79.6Confident41 Ų4164.4 Ų64.422%0.21535%0.349CS..Hα-helixtrans-63.7-39.6179.6-69.6174.9000111.6V163 F166 S203 C209 L210 V211V163-L207 HydrophobicContact CG1-CB 3.63Å; V163-L207 HydrophobicContact CG1-CD1 4.24Å; V163-L207 HydrophobicContact CG2-CB 4.21Å; F166-L207 HydrophobicContact CD1-CD1 3.97Å; F166-L207 HydrophobicContact CE1-CD1 4.15Å; S203-L207 PolarHBondContact O-N 3.4Å; L207-C209 VanDerWaalsContact C-N 3.35Å; L207-C209 PolarHBondContact O-N 3.39Å; L207-L210 PolarHBondContact O-N 3.37Å; L207-V211 VanDerWaalsContact O-CG2 3.31Å; L207-V211 WeakPolarHBondContact O-CG2 3.42Å; L207-V211 PolarHBondContact O-N 3.39Å
208N84.1Confident78Confident37 Ų3770.9 Ų70.920%0.19838%0.379CS..Hα-helixtrans-62.6-40.3174.8-79.9-30.8000112.5Q204 G205 F206 Y212Q204-N208 PolarHBondContact NE2-ND2 2.94Å; Q204-N208 VanDerWaalsContact O-CB 3.3Å; Q204-N208 WeakPolarHBondContact O-CB 3.41Å; Q204-N208 VanDerWaalsContact O-CG 3.25Å; Q204-N208 PolarHBondContact O-N 3.5Å; Q204-N208 VanDerWaalsContact O-N 3.08Å; Q204-N208 PolarHBondContact O-ND2 2.99Å; Q204-N208 VanDerWaalsContact O-ND2 3.11Å; G205-N208 PolarHBondContact O-N 2.99Å; F206-N208 VanDerWaalsContact C-N 3.33Å; F206-N208 PolarHBondContact O-N 3.33Å; N208-Y212 WeakPolarHBondContact O-CB 3.48Å; N208-Y212 PolarHBondContact O-N 3.35Å
209C83.6Confident76.7Confident91 Ų9172.9 Ų72.962%0.61538%0.381SS*.Hα-helixtrans-64.1-42.6174-72.30000111.9G205 F206 L207 Y212 G213G205-C209 PolarHBondContact O-N 3.13Å; G205-C209 PolarHBondContact O-SG 3.3Å; G205-C209 VanDerWaalsContact O-SG 3.32Å; F206-C209 WeakPolarHBondContact O-CB 3.43Å; F206-C209 PolarHBondContact O-N 3.32Å; L207-C209 VanDerWaalsContact C-N 3.35Å; L207-C209 PolarHBondContact O-N 3.39Å; C209-Y212 PolarHBondContact O-N 3.36Å; C209-G213 PolarHBondContact O-N 3.01Å
210L84.6Confident75.4Confident91 Ų9172.8 Ų72.848%0.47638%0.376SS..Hα-helixtrans-61.6-48.3177.5-171.9153.8000111.2F206 L207 Y212 G213 W214F206-L210 HydrophobicContact CE1-CD1 4.17Å; F206-L210 HydrophobicContact CZ-CD1 4.3Å; F206-L210 PolarHBondContact O-N 2.88Å; L207-L210 PolarHBondContact O-N 3.37Å; L210-Y212 VanDerWaalsContact C-N 3.31Å; L210-Y212 PolarHBondContact O-N 3.46Å; L210-G213 PolarHBondContact O-N 2.93Å; L210-W214 VanDerWaalsContact O-CB 3.23Å; L210-W214 WeakPolarHBondContact O-CB 3.32Å; L210-W214 PolarHBondContact O-N 3.2Å
211V82.4Confident73.8Confident4 Ų480 Ų802%0.02440%0.401CS..Hα-helixtrans-60.5-41.8176.2174.20000111.2L159 Y160 V163 L207 T215L159-V211 HydrophobicContact CB-CG1 3.85Å; L159-V211 HydrophobicContact CB-CG2 4.2Å; L159-V211 HydrophobicContact CD2-CG1 4.35Å; L159-V211 HydrophobicContact CD2-CG2 3.64Å; Y160-V211 HydrophobicContact CD1-CG1 4.4Å; Y160-V211 HydrophobicContact CD2-CG1 4.14Å; Y160-V211 HydrophobicContact CE1-CB 4.38Å; Y160-V211 HydrophobicContact CE1-CG1 4.06Å; Y160-V211 HydrophobicContact CE2-CG1 3.76Å; Y160-V211 HydrophobicContact CG-CG1 4.43Å; V163-V211 HydrophobicContact CG2-CG2 3.94Å; L207-V211 VanDerWaalsContact O-CG2 3.31Å; L207-V211 WeakPolarHBondContact O-CG2 3.42Å; L207-V211 PolarHBondContact O-N 3.39Å; V211-T215 WeakPolarHBondContact O-CB 3.15Å; V211-T215 VanDerWaalsContact O-CG2 3.26Å; V211-T215 WeakPolarHBondContact O-CG2 3.35Å; V211-T215 PolarHBondContact O-N 3.07Å; V211-T215 VanDerWaalsContact O-N 3.15Å; V211-T215 PolarHBondContact O-OG1 3.22Å
212Y76.5Confident72.5Confident97 Ų9779.9 Ų79.938%0.3840%0.403SS..Hα-helixtrans-65.9-44.1178.7-170.7-105.8000112.4Y160 N208 C209 L210 T215 R216Y160-Y212 WeakPolarHBondContact OH-CA 3.43Å; Y160-Y212 WeakPolarHBondContact OH-CB 3.45Å; Y160-Y212 WeakPolarHBondContact OH-CD2 3.31Å; N208-Y212 WeakPolarHBondContact O-CB 3.48Å; N208-Y212 PolarHBondContact O-N 3.35Å; C209-Y212 PolarHBondContact O-N 3.36Å; L210-Y212 VanDerWaalsContact C-N 3.31Å; L210-Y212 PolarHBondContact O-N 3.46Å; Y212-T215 PolarHBondContact O-OG1 3.44Å; Y212-R216 PolarHBondContact O-N 2.97Å; Y212-R216 PolarHBondContact OH-NE 3.11Å; Y212-R216 PolarHBondContact OH-NH2 2.86Å
213G75Confident71.2Confident23 Ų2377.6 Ų77.624%0.23739%0.388CS..Hα-helixtrans-65.6-46.2177.500000112.4C209 L210 T215 R216C209-G213 PolarHBondContact O-N 3.01Å; L210-G213 PolarHBondContact O-N 2.93Å; G213-T215 VanDerWaalsContact C-N 3.3Å; G213-T215 PolarHBondContact O-N 2.97Å; G213-R216 PolarHBondContact O-N 2.71Å
214W72.9Confident69.7Low157 Ų15781.2 Ų81.260%0.59540%0.404SS*.Hα-helixtrans-61.6-37.9-179.4-173.7-103.9000112.8L210L210-W214 VanDerWaalsContact O-CB 3.23Å; L210-W214 WeakPolarHBondContact O-CB 3.32Å; L210-W214 PolarHBondContact O-N 3.2Å
215T67.9Low68Low6 Ų682.9 Ų82.94%0.03742%0.418CS..Hα-helixtrans-86.4-8-175.460.50000113.8V152 R156 V211 Y212 G213 L217V152-T215 WeakPolarHBondContact CG1-O 3.49Å; R156-T215 HydrophobicContact CG-CG2 3.67Å; R156-T215 PolarHBondContact NE-OG1 2.91Å; R156-T215 VanDerWaalsContact NH2-C 3.3Å; R156-T215 PolarHBondContact NH2-O 2.88Å; V211-T215 WeakPolarHBondContact O-CB 3.15Å; V211-T215 VanDerWaalsContact O-CG2 3.26Å; V211-T215 WeakPolarHBondContact O-CG2 3.35Å; V211-T215 PolarHBondContact O-N 3.07Å; V211-T215 VanDerWaalsContact O-N 3.15Å; V211-T215 PolarHBondContact O-OG1 3.22Å; Y212-T215 PolarHBondContact O-OG1 3.44Å; G213-T215 VanDerWaalsContact C-N 3.3Å; G213-T215 PolarHBondContact O-N 2.97Å; T215-L217 PolarHBondContact O-N 2.89Å
216R67Low66.5Low124 Ų12487.8 Ų87.847%0.46843%0.426SS..  trans-81.6104.7168.2-85.1-170.7173.8-123.40109.3Y212 G213 H218 L219 R220Y212-R216 PolarHBondContact O-N 2.97Å; Y212-R216 PolarHBondContact OH-NE 3.11Å; Y212-R216 PolarHBondContact OH-NH2 2.86Å; G213-R216 PolarHBondContact O-N 2.71Å; R216-H218 PolarHBondContact O-N 3.02Å; R216-L219 HydrophobicContact CB-CD1 4.27Å; R216-L219 PolarHBondContact O-N 2.98Å; R216-R220 PolarHBondContact O-N 3.46Å
217L56.8Low64.8Low77 Ų7789.3 Ų89.340%0.40343%0.433SS..Hα-helixtrans-46.1-33175.3-110.7118.3000114.1V152 T215 R221V152-L217 HydrophobicContact CG2-CD1 3.93Å; T215-L217 PolarHBondContact O-N 2.89Å; L217-R221 PolarHBondContact O-N 3.28Å
218H51.8Low63.2Low159 Ų15990.7 Ų90.774%0.73645%0.446SS*.Hα-helixtrans-69.8-33-179.1-152.2-73.4000113.3R216 A222R216-H218 PolarHBondContact O-N 3.02Å; H218-A222 WeakPolarHBondContact O-CB 3.43Å; H218-A222 PolarHBondContact O-N 2.98Å
219L52.9Low61.4Low103 Ų10397.6 Ų97.654%0.53947%0.469SS..Hα-helixtrans-78.5-35.6176.1-85.5158.9000111.5R216 A222 G223R216-L219 HydrophobicContact CB-CD1 4.27Å; R216-L219 PolarHBondContact O-N 2.98Å; L219-A222 PolarHBondContact O-N 3.47Å; L219-G223 PolarHBondContact O-N 2.91Å
220R54.3Low59.7Low153 Ų15399.3 Ų99.358%0.57747%0.472SS*.Hα-helixtrans-65.1-43172.8-171.5176.7174.8-166.3-1.1111.7R216 L224R216-R220 PolarHBondContact O-N 3.46Å; R220-L224 HydrophobicContact CG-CD1 4.01Å; R220-L224 WeakPolarHBondContact O-CB 3.5Å; R220-L224 WeakPolarHBondContact O-CD1 3.34Å; R220-L224 WeakPolarHBondContact O-CG 3.14Å; R220-L224 PolarHBondContact O-N 2.87Å
221R51.5Low58.1Low165 Ų165100.6 Ų100.662%0.62348%0.484SS*.Hα-helixtrans-66.5-40.1172.5-81.3-175.5-169.1139.31.6112.1L217 S225L217-R221 PolarHBondContact O-N 3.28Å; R221-S225 WeakPolarHBondContact O-CB 3.07Å; R221-S225 PolarHBondContact O-N 3.26Å; R221-S225 PolarHBondContact O-OG 3.07Å; R221-S225 VanDerWaalsContact O-OG 3.09Å
222A52.3Low56.5Low41 Ų41106.2 Ų106.234%0.33951%0.514SS..Hα-helixtrans-63-45.4176.200000111.7H218 L219 S225 F226H218-A222 WeakPolarHBondContact O-CB 3.43Å; H218-A222 PolarHBondContact O-N 2.98Å; L219-A222 PolarHBondContact O-N 3.47Å; A222-S225 WeakPolarHBondContact CA-OG 3.1Å; A222-S225 CarbonylContact O-C 3.28Å; A222-S225 PolarHBondContact O-N 3.32Å; A222-S225 PolarHBondContact O-OG 2.95Å; A222-F226 VanDerWaalsContact O-CB 3.26Å; A222-F226 WeakPolarHBondContact O-CB 3.25Å; A222-F226 PolarHBondContact O-N 2.03Å
223G56.3Low55.2Low32 Ų32107.1 Ų107.133%0.3353%0.53SS..Hα-helixtrans-64.8-43.6176.400000113.2L219 F226 F227L219-G223 PolarHBondContact O-N 2.91Å; G223-F226 PolarHBondContact O-N 3.14Å; G223-F227 WeakPolarHBondContact O-CD2 2.99Å; G223-F227 PolarHBondContact O-N 3.12Å
224L53.3Low54Low105 Ų105112.5 Ų112.555%0.5555%0.549SS..Hα-helixtrans-63.7-39.8172.5-81.5157.7000112R220 F226 S228R220-L224 HydrophobicContact CG-CD1 4.01Å; R220-L224 WeakPolarHBondContact O-CB 3.5Å; R220-L224 WeakPolarHBondContact O-CD1 3.34Å; R220-L224 WeakPolarHBondContact O-CG 3.14Å; R220-L224 PolarHBondContact O-N 2.87Å; L224-F226 VanDerWaalsContact C-N 3.32Å; L224-S228 WeakPolarHBondContact O-CB 3.32Å; L224-S228 PolarHBondContact O-N 3.36Å; L224-S228 PolarHBondContact O-OG 3.45Å
225S49.7Very low52.9Low52 Ų52109 Ų10936%0.36455%0.545SS..Hα-helixtrans-70.8-27.6175.872.10000113.1R221 A222 R229R221-S225 WeakPolarHBondContact O-CB 3.07Å; R221-S225 PolarHBondContact O-N 3.26Å; R221-S225 PolarHBondContact O-OG 3.07Å; R221-S225 VanDerWaalsContact O-OG 3.09Å; A222-S225 WeakPolarHBondContact CA-OG 3.1Å; A222-S225 CarbonylContact O-C 3.28Å; A222-S225 PolarHBondContact O-N 3.32Å; A222-S225 PolarHBondContact O-OG 2.95Å; S225-R229 WeakPolarHBondContact O-CB 3.47Å; S225-R229 VanDerWaalsContact O-CG 3.24Å; S225-R229 WeakPolarHBondContact O-CG 3.3Å; S225-R229 PolarHBondContact O-N 3.18Å
226F51.9Low52.3Low146 Ų146114.1 Ų114.164%0.6458%0.578SS**Hα-helixtrans-74-45.2176.3-163.5-92.2000109.9A222 G223 L224 S228 R229A222-F226 VanDerWaalsContact O-CB 3.26Å; A222-F226 WeakPolarHBondContact O-CB 3.25Å; A222-F226 PolarHBondContact O-N 2.03Å; G223-F226 PolarHBondContact O-N 3.14Å; L224-F226 VanDerWaalsContact C-N 3.32Å; F226-S228 PolarHBondContact O-N 3.06Å; F226-R229 PolarHBondContact O-N 2.92Å
227F50.8Low51.4Low172 Ų172114.9 Ų114.975%0.75459%0.591SS**Hα-helixtrans-67-29.9172.2-89.6-81.1000113.8G223G223-F227 WeakPolarHBondContact O-CD2 2.99Å; G223-F227 PolarHBondContact O-N 3.12Å
228S51.6Low51Low69 Ų69115.9 Ų115.948%0.48360%0.596SS.*Hα-helixtrans-81.9-24.6172.9-81.70000113.9L224 F226 D230 V231 D232L224-S228 WeakPolarHBondContact O-CB 3.32Å; L224-S228 PolarHBondContact O-N 3.36Å; L224-S228 PolarHBondContact O-OG 3.45Å; F226-S228 PolarHBondContact O-N 3.06Å; S228-D230 PolarHBondContact O-N 3.09Å; S228-V231 PolarHBondContact O-N 2.8Å; S228-V231 VanDerWaalsContact O-N 3.08Å; S228-D232 PolarHBondContact O-N 3.47Å
229R46.1Very low50.7Low182 Ų182117.3 Ų117.369%0.68760%0.595SS**Hα-helixtrans-67.3-24.6180-98.9176.9171.1170.1-2.8113.3S225 F226 V231S225-R229 WeakPolarHBondContact O-CB 3.47Å; S225-R229 VanDerWaalsContact O-CG 3.24Å; S225-R229 WeakPolarHBondContact O-CG 3.3Å; S225-R229 PolarHBondContact O-N 3.18Å; F226-R229 PolarHBondContact O-N 2.92Å; R229-V231 VanDerWaalsContact C-N 3.26Å; R229-V231 PolarHBondContact O-N 2.92Å
230D49.2Very low50.6Low127 Ų127116 Ų11668%0.67959%0.594SS**THydrogen-bonded Turntrans-76.6-12173.6-78.3-31.8000113.3S228S228-D230 PolarHBondContact O-N 3.09Å
231V50.8Low50.6Low118 Ų118115 Ų11572%0.71560%0.596SS**THydrogen-bonded Turntrans-95.3-25.4175.9178.10000112.3S228 R229S228-V231 PolarHBondContact O-N 2.8Å; S228-V231 VanDerWaalsContact O-N 3.08Å; R229-V231 VanDerWaalsContact C-N 3.26Å; R229-V231 PolarHBondContact O-N 2.92Å
232D49Very low50.5Low123 Ų123112.4 Ų112.466%0.65859%0.591SS**  trans-109.628.1-174.1-81.7-38.1000114.4S228 Q234S228-D232 PolarHBondContact O-N 3.47Å; D232-Q234 PolarHBondContact O-N 2.89Å; D232-Q234 VanDerWaalsContact O-N 3.08Å
233T49.2Very low50.3Low116 Ų116115 Ų11571%0.71260%0.603SS**  trans-76.528.2166.639.90000113.3
234Q48.2Very low49.9Very low136 Ų136123.5 Ų123.564%0.63663%0.625SS**SBendtrans-87.5111.8158.6-87.7-174.9-9.600109.1D232D232-Q234 PolarHBondContact O-N 2.89Å; D232-Q234 VanDerWaalsContact O-N 3.08Å
235T51Low49.6Very low83 Ų83122.4 Ų122.451%0.50963%0.626SS.*  trans-54.7138173.646.20000110.3L237 L238T235-L237 PolarHBondContact O-N 3.02Å; T235-L238 PolarHBondContact O-N 3.41Å
236P54.3Low49.6Very low114 Ų114128.6 Ų128.674%0.7464%0.643SS**Hα-helixtrans-60.9-10.6-175.920.6-31.2000114.3
237L49.3Very low49.4Very low139 Ų139129 Ų12973%0.72865%0.651SS**Hα-helixtrans-75.7-25.4174.8-69.3171.8000113.7T235 S240T235-L237 PolarHBondContact O-N 3.02Å; L237-S240 PolarHBondContact O-OG 3.11Å
238L47.1Very low48.9Very low99 Ų99129.3 Ų129.352%0.51867%0.667SS.*Hα-helixtrans-81.7-29.7177.2-78.8163.9000112.5T235 S240 Q241 Q242T235-L238 PolarHBondContact O-N 3.41Å; L238-S240 PolarHBondContact O-N 3.03Å; L238-Q241 PolarHBondContact O-N 2.99Å; L238-Q242 PolarHBondContact O-N 3.32Å
239R46.5Very low48.8Very low188 Ų188132.3 Ų132.371%0.70968%0.676SS**Hα-helixtrans-70.6-30.1179.8-159.7178.3-161.6162.87.7113.1T243R239-T243 PolarHBondContact O-OG1 3.39Å; R239-T243 VanDerWaalsContact O-OG1 3.12Å
240S50.5Low48.9Very low75 Ų75129.7 Ų129.752%0.52468%0.676SS.*Hα-helixtrans-80-22178.167.80000113.3L237 L238L237-S240 PolarHBondContact O-OG 3.11Å; L238-S240 PolarHBondContact O-N 3.03Å
241Q53.6Low48.9Very low134 Ų134129.8 Ų129.863%0.62668%0.675SS**Hα-helixtrans-79.5-38.6175.2-73.5-155-34.600112.3L238 T243 R244 S245L238-Q241 PolarHBondContact O-N 2.99Å; Q241-T243 PolarHBondContact O-N 3.32Å; Q241-R244 PolarHBondContact O-N 2.98Å; Q241-R244 VanDerWaalsContact O-N 3.17Å; Q241-S245 PolarHBondContact O-N 3.31Å; Q241-S245 PolarHBondContact O-OG 3.13Å
242Q50.1Low48.8Very low110 Ų110130.5 Ų130.551%0.51467%0.673SS.*Hα-helixtrans-64.1-40-178.5-135.2-179.8-4.500112.4L238 R244 S245 Y246L238-Q242 PolarHBondContact O-N 3.32Å; Q242-R244 PolarHBondContact O-N 3.24Å; Q242-S245 PolarHBondContact O-N 3.25Å; Q242-Y246 HydrophobicContact CG-CE2 4.05Å; Q242-Y246 WeakPolarHBondContact O-CD2 3.42Å
243T48.8Very low48.8Very low95 Ų95131 Ų13158%0.58367%0.674SS**Hα-helixtrans-67.8-24.4178.1-39.20000113R239 Q241R239-T243 PolarHBondContact O-OG1 3.39Å; R239-T243 VanDerWaalsContact O-OG1 3.12Å; Q241-T243 PolarHBondContact O-N 3.32Å
244R47.6Very low48.8Very low210 Ų210132 Ų13279%0.79267%0.672SS**Hα-helixtrans-83.6-24.3179.8-156173.4-174.4169.90.7112.5Q241 Q242Q241-R244 PolarHBondContact O-N 2.98Å; Q241-R244 VanDerWaalsContact O-N 3.17Å; Q242-R244 PolarHBondContact O-N 3.24Å
245S46.8Very low48.8Very low83 Ų83131.7 Ų131.758%0.5867%0.674SS**Hα-helixtrans-81.9-11.5179.4-58.10000114.7Q241 Q242Q241-S245 PolarHBondContact O-N 3.31Å; Q241-S245 PolarHBondContact O-OG 3.13Å; Q242-S245 PolarHBondContact O-N 3.25Å
246Y49Very low48.7Very low182 Ų182135.5 Ų135.571%0.71469%0.687SS**THydrogen-bonded Turntrans-96.56.6176-68.5-69.6000113.8Q242Q242-Y246 HydrophobicContact CG-CE2 4.05Å; Q242-Y246 WeakPolarHBondContact O-CD2 3.42Å
247L49.1Very low48.2Very low153 Ų153137.3 Ų137.380%0.80168%0.682SS**  trans-116.719.5-178.3-100155.7000113.3
248T40Very low48.1Very low179 Ų179137.1 Ų137.1100%1.09868%0.678SS**  trans-136.3016843.50000108.5

Retrieved 248 of 248 residues in 386.8 ms (Link to these results)

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