X5D9J6_HUMAN Loading...

G protein-coupled receptor 89A isoform D

AlphaFold DB , UniProt , Accession X5D9J6, Species HUMAN (Homo sapiens, Human), Gene GPR89A, Length 249 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
1M56.9Low84Confident202 Ų20277.3 Ų77.3100%0.99541%0.41SS*.  0-47.30-64.5-68.4-174.900112.3I5M1-I5 WeakPolarHBondContact O-CD1 3.46Å; M1-I5 WeakPolarHBondContact O-CG1 3.37Å
2S76.4Confident84.7Confident48 Ų4876.9 Ų76.934%0.33641%0.413SS..Hα-helixtrans-64.4-42.8179.9127.90000114.2L4 I5 D6 N67S2-L4 PolarHBondContact O-N 2.85Å; S2-I5 PolarHBondContact O-N 3.41Å; S2-I5 VanDerWaalsContact O-N 3.16Å; S2-D6 WeakPolarHBondContact O-CB 3.43Å; S2-D6 PolarHBondContact O-N 3.16Å; S2-D6 PolarHBondContact OG-OD2 3.13Å; S2-N67 WeakPolarHBondContact OG-CB 2.96Å; S2-N67 PolarHBondContact OG-ND2 3.35Å
3F83.3Confident85.3Confident93 Ų9371.9 Ų71.941%0.40839%0.388SS..Hα-helixtrans-60.4-38-175.9-175.2-97.3000114.7S7 F73F3-S7 VanDerWaalsContact O-CB 3.28Å; F3-S7 WeakPolarHBondContact O-CB 3.45Å; F3-S7 PolarHBondContact O-N 3.1Å; F3-S7 PolarHBondContact O-OG 3.1Å; F3-F73 HydrophobicContact CE2-CD1 4.32Å; F3-F73 HydrophobicContact CZ-CD1 4.02Å; F3-F73 HydrophobicContact CZ-CE1 4.33Å
4L84.1Confident85.8Confident133 Ų13369.5 Ų69.570%0.69637%0.373SS*.Hα-helixtrans-72.1-38.2178-71.3174.5000111.8S2 S7 S8S2-L4 PolarHBondContact O-N 2.85Å; L4-S7 PolarHBondContact O-N 2.95Å; L4-S8 WeakPolarHBondContact O-CB 3.23Å; L4-S8 PolarHBondContact O-N 3.24Å
5I86.8Confident86.3Confident100 Ų10072.2 Ų72.251%0.51339%0.386SS..Hα-helixtrans-66.2-47.6175.7-63.9167.5000109.4M1 S2 S7 S8 I9M1-I5 WeakPolarHBondContact O-CD1 3.46Å; M1-I5 WeakPolarHBondContact O-CG1 3.37Å; S2-I5 PolarHBondContact O-N 3.41Å; S2-I5 VanDerWaalsContact O-N 3.16Å; I5-S7 VanDerWaalsContact C-N 3.3Å; I5-S7 PolarHBondContact O-N 3.37Å; I5-S8 WeakPolarHBondContact O-CB 3.31Å; I5-S8 PolarHBondContact O-N 2.73Å; I5-S8 VanDerWaalsContact O-N 3.11Å; I5-I9 HydrophobicContact CG2-CD1 3.97Å; I5-I9 VanDerWaalsContact O-CG1 3.31Å; I5-I9 WeakPolarHBondContact O-CG1 3.28Å; I5-I9 PolarHBondContact O-N 3.42Å
6D87.7Confident86.7Confident14 Ų1475.1 Ų75.18%0.07540%0.4CS..Hα-helixtrans-57.8-43.7176.5-62.9-18.7000110.9S2 I9 M10 L66 N67 S70S2-D6 WeakPolarHBondContact O-CB 3.43Å; S2-D6 PolarHBondContact O-N 3.16Å; S2-D6 PolarHBondContact OG-OD2 3.13Å; D6-I9 PolarHBondContact O-N 3.4Å; D6-M10 VanDerWaalsContact O-CG 3.25Å; D6-M10 WeakPolarHBondContact O-CG 3.43Å; D6-M10 PolarHBondContact O-N 2.95Å; D6-L66 HydrophobicContact CB-CD1 4.4Å; D6-L66 HydrophobicContact CB-CD2 4.09Å; D6-L66 HydrophobicContact CB-CG 3.82Å; D6-N67 WeakPolarHBondContact OD2-CB 2.92Å; D6-N67 PolarHBondContact OD2-N 3.33Å; D6-S70 WeakPolarHBondContact CB-OG 3.47Å
7S88.1Confident87.1Confident17 Ų1774 Ų7412%0.11939%0.391CS..Hα-helixtrans-67.8-37.3176.4-59.90000112.5F3 L4 I5 I9 M10 I11 H74F3-S7 VanDerWaalsContact O-CB 3.28Å; F3-S7 WeakPolarHBondContact O-CB 3.45Å; F3-S7 PolarHBondContact O-N 3.1Å; F3-S7 PolarHBondContact O-OG 3.1Å; L4-S7 PolarHBondContact O-N 2.95Å; I5-S7 VanDerWaalsContact C-N 3.3Å; I5-S7 PolarHBondContact O-N 3.37Å; S7-I9 VanDerWaalsContact C-N 3.35Å; S7-M10 PolarHBondContact O-N 3.42Å; S7-I11 WeakPolarHBondContact O-CB 3.48Å; S7-I11 WeakPolarHBondContact O-CD1 3.18Å; S7-I11 WeakPolarHBondContact O-CG1 3.45Å; S7-I11 PolarHBondContact O-N 3.15Å; S7-H74 PolarHBondContact OG-NE2 3.29Å
8S89.9Confident87.3Confident68 Ų6873.9 Ų73.948%0.47639%0.387SS..Hα-helixtrans-64-41174.8-172.80000111.6L4 I5 I11 T12L4-S8 WeakPolarHBondContact O-CB 3.23Å; L4-S8 PolarHBondContact O-N 3.24Å; I5-S8 WeakPolarHBondContact O-CB 3.31Å; I5-S8 PolarHBondContact O-N 2.73Å; I5-S8 VanDerWaalsContact O-N 3.11Å; S8-I11 PolarHBondContact O-N 3.39Å; S8-T12 WeakPolarHBondContact O-CB 3.33Å; S8-T12 PolarHBondContact O-N 3.13Å; S8-T12 PolarHBondContact O-OG1 3.31Å
9I89.9Confident87.3Confident71 Ų7171.9 Ų71.936%0.36439%0.387SS..Hα-helixtrans-61.6-49.9176.6-67.2164000109.6I5 D6 S7 I11 T12 S13 L66I5-I9 HydrophobicContact CG2-CD1 3.97Å; I5-I9 VanDerWaalsContact O-CG1 3.31Å; I5-I9 WeakPolarHBondContact O-CG1 3.28Å; I5-I9 PolarHBondContact O-N 3.42Å; D6-I9 PolarHBondContact O-N 3.4Å; S7-I9 VanDerWaalsContact C-N 3.35Å; I9-I11 PolarHBondContact O-N 2.97Å; I9-T12 PolarHBondContact O-N 3.14Å; I9-S13 PolarHBondContact O-N 3.13Å; I9-S13 PolarHBondContact O-OG 3.04Å; I9-L66 HydrophobicContact CD1-CD1 4.4Å
10M90.5Very high87.3Confident6 Ų674.4 Ų74.43%0.0339%0.394CS..Hα-helixtrans-60.7-41.8178.1-68.1-7299.600113.2D6 S7 T12 S13 Q14 L57 F60 L66D6-M10 VanDerWaalsContact O-CG 3.25Å; D6-M10 WeakPolarHBondContact O-CG 3.43Å; D6-M10 PolarHBondContact O-N 2.95Å; S7-M10 PolarHBondContact O-N 3.42Å; M10-T12 VanDerWaalsContact C-N 3.33Å; M10-S13 PolarHBondContact O-OG 2.98Å; M10-Q14 VanDerWaalsContact O-CB 3.28Å; M10-Q14 WeakPolarHBondContact O-CB 3.43Å; M10-Q14 PolarHBondContact O-N 3.46Å; M10-L57 HydrophobicContact CE-CD2 4.47Å; M10-L57 HydrophobicContact SD-CD2 3.54Å; M10-L57 VanDerWaalsContact SD-CD2 3.54Å; M10-L57 HydrophobicContact SD-CG 4.17Å; M10-F60 HydrophobicContact CE-CD2 3.45Å; M10-F60 VanDerWaalsContact CE-CD2 3.45Å; M10-F60 HydrophobicContact CE-CE2 3.25Å; M10-L66 HydrophobicContact CE-CD2 3.99Å; M10-L66 HydrophobicContact CG-CD2 4.18Å; M10-L66 HydrophobicContact SD-CD2 4.26Å
11I90.8Very high87.2Confident98 Ų9870.9 Ų70.950%0.50338%0.376SS..Hα-helixtrans-67.9-38.8177.9-69.7165.1000110.3S7 S8 I9 Q14 I15S7-I11 WeakPolarHBondContact O-CB 3.48Å; S7-I11 WeakPolarHBondContact O-CD1 3.18Å; S7-I11 WeakPolarHBondContact O-CG1 3.45Å; S7-I11 PolarHBondContact O-N 3.15Å; S8-I11 PolarHBondContact O-N 3.39Å; I9-I11 PolarHBondContact O-N 2.97Å; I11-Q14 PolarHBondContact O-N 3.08Å; I11-I15 HydrophobicContact CG2-CD1 3.83Å; I11-I15 HydrophobicContact CG2-CG1 4.46Å; I11-I15 VanDerWaalsContact O-CG1 3.28Å; I11-I15 WeakPolarHBondContact O-CG1 3.47Å; I11-I15 PolarHBondContact O-N 3.25Å
12T92.6Very high88.4Confident73 Ų7364.1 Ų64.145%0.44834%0.339SS..Hα-helixtrans-64-46.6177.8-56.20000110.7S8 I9 M10 I15 L16S8-T12 WeakPolarHBondContact O-CB 3.33Å; S8-T12 PolarHBondContact O-N 3.13Å; S8-T12 PolarHBondContact O-OG1 3.31Å; I9-T12 PolarHBondContact O-N 3.14Å; M10-T12 VanDerWaalsContact C-N 3.33Å; T12-I15 PolarHBondContact O-N 3.01Å; T12-L16 HydrophobicContact CG2-CD1 4.34Å; T12-L16 WeakPolarHBondContact O-CG 3.4Å; T12-L16 PolarHBondContact O-N 3Å
13S92.1Very high88.8Confident12 Ų1265.5 Ų65.58%0.08434%0.342CS..Hα-helixtrans-64.4-40.5176.667.40000112I9 M10 I15 L16 F17 E56I9-S13 PolarHBondContact O-N 3.13Å; I9-S13 PolarHBondContact O-OG 3.04Å; M10-S13 PolarHBondContact O-OG 2.98Å; S13-I15 PolarHBondContact O-N 3.49Å; S13-L16 PolarHBondContact O-N 2.89Å; S13-F17 VanDerWaalsContact O-CD2 3.25Å; S13-F17 WeakPolarHBondContact O-CD2 3.27Å; S13-F17 WeakPolarHBondContact O-CG 3.39Å; S13-F17 PolarHBondContact O-N 3.22Å; S13-E56 WeakPolarHBondContact CB-OE1 3.35Å; S13-E56 WeakPolarHBondContact CB-OE2 3.47Å; S13-E56 PolarHBondContact OG-OE1 2.71Å; S13-E56 PolarHBondContact OG-OE2 2.91Å
14Q92.7Very high88.7Confident38 Ų3865.6 Ų65.618%0.17834%0.343CS..Hα-helixtrans-57.9-45.2174.4-174.875.130.700112.4M10 I11 F17 F18 T53M10-Q14 VanDerWaalsContact O-CB 3.28Å; M10-Q14 WeakPolarHBondContact O-CB 3.43Å; M10-Q14 PolarHBondContact O-N 3.46Å; I11-Q14 PolarHBondContact O-N 3.08Å; Q14-F17 PolarHBondContact O-N 3.48Å; Q14-F18 WeakPolarHBondContact O-CB 3.23Å; Q14-F18 PolarHBondContact O-N 2.88Å; Q14-T53 VanDerWaalsContact OE1-CB 3.32Å; Q14-T53 PolarHBondContact OE1-OG1 3.45Å
15I93.3Very high88.3Confident110 Ų11059.9 Ų59.956%0.56431%0.312SS*.Hα-helixtrans-65.4-41.3178.3-68.7165.6000110.4I11 T12 S13 F18 G19I11-I15 HydrophobicContact CG2-CD1 3.83Å; I11-I15 HydrophobicContact CG2-CG1 4.46Å; I11-I15 VanDerWaalsContact O-CG1 3.28Å; I11-I15 WeakPolarHBondContact O-CG1 3.47Å; I11-I15 PolarHBondContact O-N 3.25Å; T12-I15 PolarHBondContact O-N 3.01Å; S13-I15 PolarHBondContact O-N 3.49Å; I15-F18 PolarHBondContact O-N 3.42Å; I15-G19 PolarHBondContact O-N 2.82Å
16L92.9Very high87.5Confident118 Ų11858.7 Ų58.762%0.61831%0.305SS*.Hα-helixtrans-62.6-46.3176.5-71.7173000111.7T12 S13 F18 G19 F20T12-L16 HydrophobicContact CG2-CD1 4.34Å; T12-L16 WeakPolarHBondContact O-CG 3.4Å; T12-L16 PolarHBondContact O-N 3Å; S13-L16 PolarHBondContact O-N 2.89Å; L16-F18 VanDerWaalsContact C-N 3.35Å; L16-F18 PolarHBondContact O-N 3.23Å; L16-G19 PolarHBondContact O-N 3.3Å; L16-F20 WeakPolarHBondContact O-CB 3.17Å; L16-F20 PolarHBondContact O-N 2.97Å
17F92.1Very high86.9Confident57 Ų5766.3 Ų66.325%0.2533%0.333CS..Hα-helixtrans-65.8-36.9176.9-64.7-38.3000112.5S13 Q14 F20 G21 A49 C52 E56S13-F17 VanDerWaalsContact O-CD2 3.25Å; S13-F17 WeakPolarHBondContact O-CD2 3.27Å; S13-F17 WeakPolarHBondContact O-CG 3.39Å; S13-F17 PolarHBondContact O-N 3.22Å; Q14-F17 PolarHBondContact O-N 3.48Å; F17-F20 PolarHBondContact O-N 3.36Å; F17-G21 PolarHBondContact O-N 2.95Å; F17-A49 HydrophobicContact CB-CB 4.15Å; F17-C52 HydrophobicContact CB-CB 4.05Å; F17-C52 HydrophobicContact CD1-CB 3.98Å; F17-C52 HydrophobicContact CD2-CB 3.51Å; F17-C52 HydrophobicContact CE1-CB 4.3Å; F17-C52 HydrophobicContact CE2-CB 3.85Å; F17-C52 HydrophobicContact CG-CB 3.59Å; F17-C52 HydrophobicContact CZ-CB 4.24Å; F17-E56 HydrophobicContact CE2-CB 4.28Å; F17-E56 VanDerWaalsContact CE2-OE2 3.32Å; F17-E56 WeakPolarHBondContact CE2-OE2 3.37Å
18F90.8Very high86Confident72 Ų7272.4 Ų72.432%0.31636%0.36SS..Hα-helixtrans-63.9-46173.7-178.9-99.4000111.6Q14 I15 L16 F20 G21 W22 V46 A49Q14-F18 WeakPolarHBondContact O-CB 3.23Å; Q14-F18 PolarHBondContact O-N 2.88Å; I15-F18 PolarHBondContact O-N 3.42Å; L16-F18 VanDerWaalsContact C-N 3.35Å; L16-F18 PolarHBondContact O-N 3.23Å; F18-F20 PolarHBondContact O-N 3.09Å; F18-G21 PolarHBondContact O-N 3.35Å; F18-W22 HydrophobicContact CZ-CE3 4.23Å; F18-W22 VanDerWaalsContact O-CB 3.3Å; F18-W22 WeakPolarHBondContact O-CB 3.41Å; F18-W22 PolarHBondContact O-N 3.49Å; F18-V46 HydrophobicContact CD2-CG2 4.18Å; F18-V46 HydrophobicContact CE2-CG2 3.71Å; F18-A49 HydrophobicContact CB-CB 4.01Å
19G88.5Confident84.9Confident37 Ų3773.6 Ų73.638%0.38136%0.36SS..Hα-helixtrans-60.8-43.1175.400000112.4I15 L16 W22 L23I15-G19 PolarHBondContact O-N 2.82Å; L16-G19 PolarHBondContact O-N 3.3Å; G19-W22 PolarHBondContact O-N 3.49Å; G19-L23 WeakPolarHBondContact O-CB 3.35Å; G19-L23 PolarHBondContact O-N 3.04Å
20F87.8Confident83.5Confident120 Ų12073.5 Ų73.553%0.52636%0.357SS..Hα-helixtrans-64.1-46.8175.4-176.6-96.8000112L16 F17 F18 W22 L23 F24 F48L16-F20 WeakPolarHBondContact O-CB 3.17Å; L16-F20 PolarHBondContact O-N 2.97Å; F17-F20 PolarHBondContact O-N 3.36Å; F18-F20 PolarHBondContact O-N 3.09Å; F20-W22 VanDerWaalsContact C-N 3.31Å; F20-W22 PolarHBondContact O-N 3.39Å; F20-L23 PolarHBondContact O-N 3.08Å; F20-F24 WeakPolarHBondContact O-CB 3.5Å; F20-F24 PolarHBondContact O-N 3.31Å; F20-F48 AromaticContact CD1-CE1 3.86Å; F20-F48 HydrophobicContact CD1-CE1 3.86Å; F20-F48 HydrophobicContact CD1-CZ 4.03Å; F20-F48 HydrophobicContact CE1-CZ 4.22Å
21G83.4Confident82Confident1 Ų181.5 Ų81.51%0.0139%0.392CS..Hα-helixtrans-61.7-38.7176.900000112.5F17 F18 F25F17-G21 PolarHBondContact O-N 2.95Å; F18-G21 PolarHBondContact O-N 3.35Å; G21-F25 VanDerWaalsContact O-CB 3.32Å; G21-F25 WeakPolarHBondContact O-CB 3.39Å; G21-F25 PolarHBondContact O-N 2.92Å
22W83.6Confident80.4Confident61 Ų6183.8 Ų83.823%0.23141%0.405CS..Hα-helixtrans-64.6-45.4174-174.1-91.5000112.2F18 G19 F20 F25 M26 Y38 Q41 V42 S45F18-W22 HydrophobicContact CZ-CE3 4.23Å; F18-W22 VanDerWaalsContact O-CB 3.3Å; F18-W22 WeakPolarHBondContact O-CB 3.41Å; F18-W22 PolarHBondContact O-N 3.49Å; G19-W22 PolarHBondContact O-N 3.49Å; F20-W22 VanDerWaalsContact C-N 3.31Å; F20-W22 PolarHBondContact O-N 3.39Å; W22-F25 PolarHBondContact O-N 2.9Å; W22-M26 HydrophobicContact CZ2-CE 3.63Å; W22-M26 WeakPolarHBondContact O-CG 3.45Å; W22-M26 PolarHBondContact O-N 2.79Å; W22-Y38 AromaticContact CH2-CD2 3.8Å; W22-Y38 HydrophobicContact CH2-CD2 3.8Å; W22-Y38 AromaticContact CH2-CE2 3.29Å; W22-Y38 HydrophobicContact CH2-CE2 3.29Å; W22-Y38 AromaticContact CH2-CZ 3.93Å; W22-Y38 HydrophobicContact CZ2-CD2 4.5Å; W22-Y38 AromaticContact CZ2-CE2 3.91Å; W22-Y38 HydrophobicContact CZ2-CE2 3.91Å; W22-Y38 HydrophobicContact CZ3-CE2 4.25Å; W22-Q41 HydrophobicContact CD2-CG 4.5Å; W22-Q41 VanDerWaalsContact CE2-NE2 3.33Å; W22-Q41 HydrophobicContact CE3-CG 3.84Å; W22-Q41 HydrophobicContact CH2-CB 4.45Å; W22-Q41 HydrophobicContact CH2-CG 3.69Å; W22-Q41 HydrophobicContact CZ2-CG 4.41Å; W22-Q41 VanDerWaalsContact CZ2-NE2 3.31Å; W22-Q41 HydrophobicContact CZ3-CB 4.27Å; W22-Q41 HydrophobicContact CZ3-CG 3.41Å; W22-Q41 VanDerWaalsContact CZ3-CG 3.41Å; W22-V42 HydrophobicContact CH2-CG2 4.36Å; W22-V42 HydrophobicContact CZ3-CG2 3.81Å; W22-S45 WeakPolarHBondContact CA-OG 3.43Å; W22-S45 PolarHBondContact N-OG 3.28Å
23L84.3Confident78.8Confident76 Ų7687.7 Ų87.740%0.39841%0.413SS..Hα-helixtrans-64.9-44.6178.4-174.768.9000111.7G19 F20 F25 M26 R27G19-L23 WeakPolarHBondContact O-CB 3.35Å; G19-L23 PolarHBondContact O-N 3.04Å; F20-L23 PolarHBondContact O-N 3.08Å; L23-F25 VanDerWaalsContact C-N 3.33Å; L23-M26 PolarHBondContact O-N 2.89Å; L23-R27 HydrophobicContact CD1-CG 4.25Å; L23-R27 WeakPolarHBondContact O-CB 3.37Å; L23-R27 PolarHBondContact O-N 2.85Å
24F81.3Confident77Confident95 Ų9596.3 Ų96.342%0.41745%0.452SS..Hα-helixtrans-60-45.1176.8-179.7-100.4000111F20 R27 Q28F20-F24 WeakPolarHBondContact O-CB 3.5Å; F20-F24 PolarHBondContact O-N 3.31Å; F24-R27 PolarHBondContact O-N 3.35Å; F24-Q28 HydrophobicContact CD2-CB 4.23Å; F24-Q28 HydrophobicContact CE2-CB 4Å; F24-Q28 HydrophobicContact CE2-CG 4.08Å; F24-Q28 HydrophobicContact CZ-CB 4.28Å; F24-Q28 HydrophobicContact CZ-CG 4.28Å; F24-Q28 WeakPolarHBondContact O-CB 3.3Å; F24-Q28 PolarHBondContact O-N 3.43Å
25F74.6Confident75.2Confident13 Ų1399.8 Ų99.86%0.05747%0.47CS..Iπ-helixtrans-60.2-47.1175.5-173-83.5000112.1G21 W22 L23 R27 L29 F30 Q41 F44G21-F25 VanDerWaalsContact O-CB 3.32Å; G21-F25 WeakPolarHBondContact O-CB 3.39Å; G21-F25 PolarHBondContact O-N 2.92Å; W22-F25 PolarHBondContact O-N 2.9Å; L23-F25 VanDerWaalsContact C-N 3.33Å; F25-R27 PolarHBondContact O-N 2.98Å; F25-L29 HydrophobicContact CD2-CB 4.48Å; F25-L29 HydrophobicContact CD2-CD2 3.62Å; F25-L29 HydrophobicContact CE2-CD2 3.74Å; F25-L29 PolarHBondContact O-N 3.46Å; F25-F30 AromaticContact CD1-CD2 3.94Å; F25-F30 HydrophobicContact CD1-CD2 3.94Å; F25-F30 HydrophobicContact CD2-CD2 4.12Å; F25-F30 HydrophobicContact CD2-CE2 4.26Å; F25-F30 HydrophobicContact CE1-CB 4.45Å; F25-F30 AromaticContact CE1-CD2 3.32Å; F25-F30 HydrophobicContact CE1-CD2 3.32Å; F25-F30 AromaticContact CE1-CE2 3.81Å; F25-F30 HydrophobicContact CE1-CE2 3.81Å; F25-F30 HydrophobicContact CE1-CG 4.01Å; F25-F30 AromaticContact CE2-CD2 3.56Å; F25-F30 HydrophobicContact CE2-CD2 3.56Å; F25-F30 AromaticContact CE2-CE2 3.35Å; F25-F30 HydrophobicContact CE2-CE2 3.35Å; F25-F30 HydrophobicContact CG-CD2 4.33Å; F25-F30 AromaticContact CZ-CD2 3.14Å; F25-F30 HydrophobicContact CZ-CD2 3.14Å; F25-F30 AromaticContact CZ-CE2 3.09Å; F25-F30 HydrophobicContact CZ-CE2 3.09Å; F25-F30 HydrophobicContact CZ-CG 4.13Å; F25-F30 HydrophobicContact CZ-CZ 4.07Å; F25-Q41 HydrophobicContact CD1-CB 4.09Å; F25-Q41 HydrophobicContact CD1-CG 3.35Å; F25-Q41 VanDerWaalsContact CD1-NE2 3.33Å; F25-Q41 HydrophobicContact CD2-CG 4.48Å; F25-Q41 HydrophobicContact CE1-CB 3.5Å; F25-Q41 VanDerWaalsContact CE1-CD 3.42Å; F25-Q41 HydrophobicContact CE1-CG 3.3Å; F25-Q41 HydrophobicContact CE2-CB 4.4Å; F25-Q41 HydrophobicContact CE2-CG 4.43Å; F25-Q41 HydrophobicContact CG-CG 3.95Å; F25-Q41 HydrophobicContact CZ-CB 3.65Å; F25-Q41 HydrophobicContact CZ-CG 3.86Å; F25-F44 HydrophobicContact CB-CD1 4.2Å; F25-F44 HydrophobicContact CB-CE1 4.22Å; F25-F44 HydrophobicContact CD2-CB 4.31Å; F25-F44 AromaticContact CD2-CD1 3.4Å; F25-F44 HydrophobicContact CD2-CD1 3.4Å; F25-F44 AromaticContact CD2-CE1 3.87Å; F25-F44 HydrophobicContact CD2-CE1 3.87Å; F25-F44 AromaticContact CD2-CG 3.93Å; F25-F44 HydrophobicContact CD2-CG 3.93Å; F25-F44 HydrophobicContact CE2-CB 4.24Å; F25-F44 HydrophobicContact CE2-CD1 4.14Å; F25-F44 HydrophobicContact CE2-CG 4.22Å; F25-F44 HydrophobicContact CG-CD1 4.2Å
26M70.8Confident73.7Confident75 Ų75103.7 Ų103.737%0.36948%0.478SS..Iπ-helixtrans-66.3-35.9-179.6-77-60.3-163.100113.5W22 L23 Q41W22-M26 HydrophobicContact CZ2-CE 3.63Å; W22-M26 WeakPolarHBondContact O-CG 3.45Å; W22-M26 PolarHBondContact O-N 2.79Å; L23-M26 PolarHBondContact O-N 2.89Å; M26-Q41 PolarHBondContact SD-NE2 3.46Å
27R74.2Confident72.8Confident175 Ų175102.2 Ų102.266%0.6647%0.468SS*.Iπ-helixtrans-89.9-38.6-174.3-72.8-171.8172.7172.90.8113.9L23 F24 F25L23-R27 HydrophobicContact CD1-CG 4.25Å; L23-R27 WeakPolarHBondContact O-CB 3.37Å; L23-R27 PolarHBondContact O-N 2.85Å; F24-R27 PolarHBondContact O-N 3.35Å; F25-R27 PolarHBondContact O-N 2.98Å
28Q70Confident72.2Confident145 Ų145106.6 Ų106.668%0.67848%0.484SS*.Iπ-helixtrans-108.9-37.1-166-159.369.310.500113.5F24F24-Q28 HydrophobicContact CD2-CB 4.23Å; F24-Q28 HydrophobicContact CE2-CB 4Å; F24-Q28 HydrophobicContact CE2-CG 4.08Å; F24-Q28 HydrophobicContact CZ-CB 4.28Å; F24-Q28 HydrophobicContact CZ-CG 4.28Å; F24-Q28 WeakPolarHBondContact O-CB 3.3Å; F24-Q28 PolarHBondContact O-N 3.43Å
29L66.9Low71.8Confident93 Ų93106.3 Ų106.349%0.48749%0.488SS..Iπ-helixtrans-90.6-27.9-168.2-158.972.4000113.6F25F25-L29 HydrophobicContact CD2-CB 4.48Å; F25-L29 HydrophobicContact CD2-CD2 3.62Å; F25-L29 HydrophobicContact CE2-CD2 3.74Å; F25-L29 PolarHBondContact O-N 3.46Å
30F60.8Low71.6Confident69 Ų69107.9 Ų107.930%0.30349%0.49SS..  trans-129.626.9-167.5-86.5-80.8000114.7F25 D32 Y33F25-F30 AromaticContact CD1-CD2 3.94Å; F25-F30 HydrophobicContact CD1-CD2 3.94Å; F25-F30 HydrophobicContact CD2-CD2 4.12Å; F25-F30 HydrophobicContact CD2-CE2 4.26Å; F25-F30 HydrophobicContact CE1-CB 4.45Å; F25-F30 AromaticContact CE1-CD2 3.32Å; F25-F30 HydrophobicContact CE1-CD2 3.32Å; F25-F30 AromaticContact CE1-CE2 3.81Å; F25-F30 HydrophobicContact CE1-CE2 3.81Å; F25-F30 HydrophobicContact CE1-CG 4.01Å; F25-F30 AromaticContact CE2-CD2 3.56Å; F25-F30 HydrophobicContact CE2-CD2 3.56Å; F25-F30 AromaticContact CE2-CE2 3.35Å; F25-F30 HydrophobicContact CE2-CE2 3.35Å; F25-F30 HydrophobicContact CG-CD2 4.33Å; F25-F30 AromaticContact CZ-CD2 3.14Å; F25-F30 HydrophobicContact CZ-CD2 3.14Å; F25-F30 AromaticContact CZ-CE2 3.09Å; F25-F30 HydrophobicContact CZ-CE2 3.09Å; F25-F30 HydrophobicContact CZ-CG 4.13Å; F25-F30 HydrophobicContact CZ-CZ 4.07Å; F30-D32 PolarHBondContact O-N 2.85Å; F30-Y33 HydrophobicContact CD1-CD1 4.47Å; F30-Y33 AromaticContact CD1-CG 3.97Å; F30-Y33 HydrophobicContact CD1-CG 3.97Å; F30-Y33 VanDerWaalsContact CE1-CB 3.49Å; F30-Y33 AromaticContact CE1-CD1 3.86Å; F30-Y33 HydrophobicContact CE1-CD1 3.86Å; F30-Y33 HydrophobicContact CE1-CD2 4.35Å; F30-Y33 AromaticContact CE1-CG 3.68Å; F30-Y33 HydrophobicContact CE1-CG 3.68Å
31K59.3Low71.3Confident173 Ų173102.4 Ų102.475%0.75247%0.466SS*.THydrogen-bonded Turntrans-56.2-25.8178.9-164.9173.7177.7177.20112.9
32D56.1Low71.5Confident147 Ų147104.2 Ų104.279%0.78648%0.477SS*.THydrogen-bonded Turntrans-129.714.9-171.5-57.3-54.4000115.9F30F30-D32 PolarHBondContact O-N 2.85Å
33Y59.6Low71.7Confident155 Ų155103 Ų10361%0.60847%0.474SS*.  trans-104.2121.3179.3-127.6-101000112.1F30 I35F30-Y33 HydrophobicContact CD1-CD1 4.47Å; F30-Y33 AromaticContact CD1-CG 3.97Å; F30-Y33 HydrophobicContact CD1-CG 3.97Å; F30-Y33 VanDerWaalsContact CE1-CB 3.49Å; F30-Y33 AromaticContact CE1-CD1 3.86Å; F30-Y33 HydrophobicContact CE1-CD1 3.86Å; F30-Y33 HydrophobicContact CE1-CD2 4.35Å; F30-Y33 AromaticContact CE1-CG 3.68Å; F30-Y33 HydrophobicContact CE1-CG 3.68Å; Y33-I35 PolarHBondContact O-N 3.18Å
34E53.3Low71.8Confident192 Ų192102.7 Ų102.790%0.89747%0.47SS*.SBendtrans-80.2-8.5-171.2-64.3-179.5140.200114.5
35I56.3Low72.2Confident111 Ų11198.1 Ų98.157%0.56945%0.45SS*.  trans-109.189.3-175.9-52.6167.9000109.7Y33 Q37Y33-I35 PolarHBondContact O-N 3.18Å; I35-Q37 PolarHBondContact O-N 2.83Å; I35-Q37 VanDerWaalsContact O-N 3.11Å
36R61.5Low73Confident193 Ų19399.3 Ų99.373%0.72846%0.458SS*.  trans-85.674.4-174.3-150-174-52.5-100.5-2.2111.6Y38R36-Y38 PolarHBondContact O-N 3.46Å; R36-Y38 VanDerWaalsContact O-N 3.1Å
37Q73.8Confident74Confident87 Ų8797.5 Ų97.541%0.40745%0.451SS..  trans-74.998.9169.9-90.2164.9-75.300110.5I35 V39 V40 Q41I35-Q37 PolarHBondContact O-N 2.83Å; I35-Q37 VanDerWaalsContact O-N 3.11Å; Q37-V39 PolarHBondContact O-N 3.1Å; Q37-V39 VanDerWaalsContact O-N 3.1Å; Q37-V40 HydrophobicContact CB-CG2 4.2Å; Q37-V40 PolarHBondContact O-N 3.35Å; Q37-V40 VanDerWaalsContact O-N 3.15Å; Q37-Q41 PolarHBondContact O-N 2.9Å
38Y79.5Confident74.8Confident148 Ų14892.1 Ų92.158%0.5843%0.433SS*.Hα-helixtrans-50.9-35.4179.7-177.4-97000113.2W22 R36 V40 Q41 V42W22-Y38 AromaticContact CH2-CD2 3.8Å; W22-Y38 HydrophobicContact CH2-CD2 3.8Å; W22-Y38 AromaticContact CH2-CE2 3.29Å; W22-Y38 HydrophobicContact CH2-CE2 3.29Å; W22-Y38 AromaticContact CH2-CZ 3.93Å; W22-Y38 HydrophobicContact CZ2-CD2 4.5Å; W22-Y38 AromaticContact CZ2-CE2 3.91Å; W22-Y38 HydrophobicContact CZ2-CE2 3.91Å; W22-Y38 HydrophobicContact CZ3-CE2 4.25Å; R36-Y38 PolarHBondContact O-N 3.46Å; R36-Y38 VanDerWaalsContact O-N 3.1Å; Y38-V40 PolarHBondContact O-N 3.19Å; Y38-Q41 WeakPolarHBondContact O-CB 3.32Å; Y38-Q41 PolarHBondContact O-N 2.72Å; Y38-V42 HydrophobicContact CD1-CG2 3.83Å; Y38-V42 HydrophobicContact CE1-CG2 3.38Å; Y38-V42 HydrophobicContact CE2-CG2 4.39Å; Y38-V42 HydrophobicContact CG-CG2 4.48Å; Y38-V42 WeakPolarHBondContact O-CG2 3.46Å; Y38-V42 PolarHBondContact O-N 3.11Å
39V82.9Confident76Confident67 Ų6785.2 Ų85.241%0.40640%0.401SS..Hα-helixtrans-64-43.1-177.9-178.20000112.4Q37 Q41 V42 I43 Y93Q37-V39 PolarHBondContact O-N 3.1Å; Q37-V39 VanDerWaalsContact O-N 3.1Å; V39-Q41 VanDerWaalsContact C-N 3.3Å; V39-Q41 PolarHBondContact O-N 2.99Å; V39-V42 PolarHBondContact O-N 2.94Å; V39-I43 HydrophobicContact CG1-CD1 3.76Å; V39-I43 HydrophobicContact CG1-CG1 4.5Å; V39-I43 WeakPolarHBondContact O-CD1 3.48Å; V39-I43 VanDerWaalsContact O-CG1 3.23Å; V39-I43 WeakPolarHBondContact O-CG1 3.5Å; V39-I43 PolarHBondContact O-N 3.42Å; V39-Y93 HydrophobicContact CB-CE1 4.47Å; V39-Y93 HydrophobicContact CG1-CD1 4.41Å; V39-Y93 HydrophobicContact CG1-CE1 3.43Å; V39-Y93 VanDerWaalsContact CG1-CE1 3.43Å; V39-Y93 HydrophobicContact CG1-CE2 4.46Å; V39-Y93 VanDerWaalsContact CG1-CZ 3.47Å; V39-Y93 WeakPolarHBondContact CG1-OH 3.23Å
40V82.8Confident77.2Confident70 Ų7082.6 Ų82.642%0.42439%0.386SS..Hα-helixtrans-65.9-38.5179.2179.40000110.5Q37 Y38 I43 F44Q37-V40 HydrophobicContact CB-CG2 4.2Å; Q37-V40 PolarHBondContact O-N 3.35Å; Q37-V40 VanDerWaalsContact O-N 3.15Å; Y38-V40 PolarHBondContact O-N 3.19Å; V40-I43 PolarHBondContact O-N 2.99Å; V40-F44 WeakPolarHBondContact O-CB 3.46Å; V40-F44 PolarHBondContact O-N 2.9Å
41Q83.2Confident78.8Confident4 Ų482.4 Ų82.42%0.01939%0.393CS..Hα-helixtrans-62-48175.2179.4172.45.900111.8W22 F25 M26 Q37 Y38 V39 I43 F44 S45W22-Q41 HydrophobicContact CD2-CG 4.5Å; W22-Q41 VanDerWaalsContact CE2-NE2 3.33Å; W22-Q41 HydrophobicContact CE3-CG 3.84Å; W22-Q41 HydrophobicContact CH2-CB 4.45Å; W22-Q41 HydrophobicContact CH2-CG 3.69Å; W22-Q41 HydrophobicContact CZ2-CG 4.41Å; W22-Q41 VanDerWaalsContact CZ2-NE2 3.31Å; W22-Q41 HydrophobicContact CZ3-CB 4.27Å; W22-Q41 HydrophobicContact CZ3-CG 3.41Å; W22-Q41 VanDerWaalsContact CZ3-CG 3.41Å; F25-Q41 HydrophobicContact CD1-CB 4.09Å; F25-Q41 HydrophobicContact CD1-CG 3.35Å; F25-Q41 VanDerWaalsContact CD1-NE2 3.33Å; F25-Q41 HydrophobicContact CD2-CG 4.48Å; F25-Q41 HydrophobicContact CE1-CB 3.5Å; F25-Q41 VanDerWaalsContact CE1-CD 3.42Å; F25-Q41 HydrophobicContact CE1-CG 3.3Å; F25-Q41 HydrophobicContact CE2-CB 4.4Å; F25-Q41 HydrophobicContact CE2-CG 4.43Å; F25-Q41 HydrophobicContact CG-CG 3.95Å; F25-Q41 HydrophobicContact CZ-CB 3.65Å; F25-Q41 HydrophobicContact CZ-CG 3.86Å; M26-Q41 PolarHBondContact SD-NE2 3.46Å; Q37-Q41 PolarHBondContact O-N 2.9Å; Y38-Q41 WeakPolarHBondContact O-CB 3.32Å; Y38-Q41 PolarHBondContact O-N 2.72Å; V39-Q41 VanDerWaalsContact C-N 3.3Å; V39-Q41 PolarHBondContact O-N 2.99Å; Q41-I43 VanDerWaalsContact C-N 3.35Å; Q41-I43 PolarHBondContact O-N 3.23Å; Q41-F44 PolarHBondContact O-N 3.38Å; Q41-S45 PolarHBondContact O-N 2.89Å; Q41-S45 PolarHBondContact O-OG 3.2Å
42V87Confident80.3Confident40 Ų4075.5 Ų75.524%0.24237%0.366CS..Hα-helixtrans-60-46.5176.7172.30000110.6W22 Y38 V39 F44 S45 V46W22-V42 HydrophobicContact CH2-CG2 4.36Å; W22-V42 HydrophobicContact CZ3-CG2 3.81Å; Y38-V42 HydrophobicContact CD1-CG2 3.83Å; Y38-V42 HydrophobicContact CE1-CG2 3.38Å; Y38-V42 HydrophobicContact CE2-CG2 4.39Å; Y38-V42 HydrophobicContact CG-CG2 4.48Å; Y38-V42 WeakPolarHBondContact O-CG2 3.46Å; Y38-V42 PolarHBondContact O-N 3.11Å; V39-V42 PolarHBondContact O-N 2.94Å; V42-F44 VanDerWaalsContact C-N 3.32Å; V42-F44 PolarHBondContact O-N 3.41Å; V42-S45 PolarHBondContact O-N 3.44Å; V42-V46 HydrophobicContact CG1-CG2 4Å; V42-V46 WeakPolarHBondContact O-CB 3.24Å; V42-V46 VanDerWaalsContact O-CG2 3.22Å; V42-V46 WeakPolarHBondContact O-CG2 3.49Å; V42-V46 PolarHBondContact O-N 3.37Å
43I87.8Confident82.1Confident34 Ų3468.9 Ų68.917%0.17433%0.331CS..Hα-helixtrans-59.4-44.2179.5-67.8160.1000111.1V39 V40 Q41 T47 I85 Y93V39-I43 HydrophobicContact CG1-CD1 3.76Å; V39-I43 HydrophobicContact CG1-CG1 4.5Å; V39-I43 WeakPolarHBondContact O-CD1 3.48Å; V39-I43 VanDerWaalsContact O-CG1 3.23Å; V39-I43 WeakPolarHBondContact O-CG1 3.5Å; V39-I43 PolarHBondContact O-N 3.42Å; V40-I43 PolarHBondContact O-N 2.99Å; Q41-I43 VanDerWaalsContact C-N 3.35Å; Q41-I43 PolarHBondContact O-N 3.23Å; I43-T47 WeakPolarHBondContact O-CB 3.47Å; I43-T47 PolarHBondContact O-N 3.37Å; I43-T47 PolarHBondContact O-OG1 2.93Å; I43-I85 HydrophobicContact CG2-CG2 4.36Å; I43-Y93 HydrophobicContact CD1-CD1 4.18Å; I43-Y93 HydrophobicContact CD1-CD2 3.33Å; I43-Y93 HydrophobicContact CD1-CE1 4.04Å; I43-Y93 HydrophobicContact CD1-CE2 3.17Å; I43-Y93 HydrophobicContact CD1-CG 3.86Å; I43-Y93 HydrophobicContact CG1-CE2 4.35Å
44F86.9Confident83.6Confident70 Ų7062.8 Ų62.831%0.30731%0.308SS..Hα-helixtrans-60.9-52.3176.1173.6-94.1000111.7F25 V40 Q41 V42 V46 T47 F48F25-F44 HydrophobicContact CB-CD1 4.2Å; F25-F44 HydrophobicContact CB-CE1 4.22Å; F25-F44 HydrophobicContact CD2-CB 4.31Å; F25-F44 AromaticContact CD2-CD1 3.4Å; F25-F44 HydrophobicContact CD2-CD1 3.4Å; F25-F44 AromaticContact CD2-CE1 3.87Å; F25-F44 HydrophobicContact CD2-CE1 3.87Å; F25-F44 AromaticContact CD2-CG 3.93Å; F25-F44 HydrophobicContact CD2-CG 3.93Å; F25-F44 HydrophobicContact CE2-CB 4.24Å; F25-F44 HydrophobicContact CE2-CD1 4.14Å; F25-F44 HydrophobicContact CE2-CG 4.22Å; F25-F44 HydrophobicContact CG-CD1 4.2Å; V40-F44 WeakPolarHBondContact O-CB 3.46Å; V40-F44 PolarHBondContact O-N 2.9Å; Q41-F44 PolarHBondContact O-N 3.38Å; V42-F44 VanDerWaalsContact C-N 3.32Å; V42-F44 PolarHBondContact O-N 3.41Å; F44-V46 VanDerWaalsContact C-N 3.33Å; F44-V46 PolarHBondContact O-N 2.88Å; F44-T47 PolarHBondContact O-N 2.93Å; F44-F48 WeakPolarHBondContact O-CB 3.3Å; F44-F48 PolarHBondContact O-N 2.94Å
45S90Very high85.4Confident0 Ų060.1 Ų60.10%029%0.294CS..Hα-helixtrans-63.4-37.5-178.2-60.70000112.5W22 Q41 V42 A49W22-S45 WeakPolarHBondContact CA-OG 3.43Å; W22-S45 PolarHBondContact N-OG 3.28Å; Q41-S45 PolarHBondContact O-N 2.89Å; Q41-S45 PolarHBondContact O-OG 3.2Å; V42-S45 PolarHBondContact O-N 3.44Å; S45-A49 VanDerWaalsContact O-CB 3.32Å; S45-A49 WeakPolarHBondContact O-CB 3.24Å; S45-A49 PolarHBondContact O-N 3.34Å
46V91.3Very high87.1Confident38 Ų3856.1 Ų56.123%0.2327%0.273CS..Hα-helixtrans-65.6-47.3174.4172.10000110.8F18 V42 F44 F48 A49 F50 I85F18-V46 HydrophobicContact CD2-CG2 4.18Å; F18-V46 HydrophobicContact CE2-CG2 3.71Å; V42-V46 HydrophobicContact CG1-CG2 4Å; V42-V46 WeakPolarHBondContact O-CB 3.24Å; V42-V46 VanDerWaalsContact O-CG2 3.22Å; V42-V46 WeakPolarHBondContact O-CG2 3.49Å; V42-V46 PolarHBondContact O-N 3.37Å; F44-V46 VanDerWaalsContact C-N 3.33Å; F44-V46 PolarHBondContact O-N 2.88Å; V46-F48 VanDerWaalsContact C-N 3.33Å; V46-F48 PolarHBondContact O-N 3.26Å; V46-A49 PolarHBondContact O-N 2.81Å; V46-F50 HydrophobicContact CG1-CD2 3.54Å; V46-F50 HydrophobicContact CG1-CE2 3.45Å; V46-F50 VanDerWaalsContact CG1-CE2 3.45Å; V46-F50 VanDerWaalsContact O-CD2 3.23Å; V46-F50 WeakPolarHBondContact O-CD2 3.39Å; V46-F50 PolarHBondContact O-N 3.25Å; V46-I85 HydrophobicContact CG1-CD1 3.73Å
47T91.9Very high88.6Confident36 Ų3647.4 Ų47.422%0.22124%0.241CC..Hα-helixtrans-61.1-44.3178.8-530000111.1I43 F44 S51 I85I43-T47 WeakPolarHBondContact O-CB 3.47Å; I43-T47 PolarHBondContact O-N 3.37Å; I43-T47 PolarHBondContact O-OG1 2.93Å; F44-T47 PolarHBondContact O-N 2.93Å; T47-S51 WeakPolarHBondContact O-CB 3.39Å; T47-S51 PolarHBondContact O-N 2.97Å; T47-I85 VanDerWaalsContact OG1-CG2 3.32Å; T47-I85 WeakPolarHBondContact OG1-CG2 3.37Å
48F90.9Very high89.4Confident62 Ų6248 Ų4827%0.27225%0.246SC..Hα-helixtrans-60.6-47.9176.3177.2-95.8000111.5F20 F44 V46 F50 S51 C52F20-F48 AromaticContact CD1-CE1 3.86Å; F20-F48 HydrophobicContact CD1-CE1 3.86Å; F20-F48 HydrophobicContact CD1-CZ 4.03Å; F20-F48 HydrophobicContact CE1-CZ 4.22Å; F44-F48 WeakPolarHBondContact O-CB 3.3Å; F44-F48 PolarHBondContact O-N 2.94Å; V46-F48 VanDerWaalsContact C-N 3.33Å; V46-F48 PolarHBondContact O-N 3.26Å; F48-F50 PolarHBondContact O-N 3.42Å; F48-S51 WeakPolarHBondContact O-CB 3.43Å; F48-S51 PolarHBondContact O-N 3.28Å; F48-C52 VanDerWaalsContact CZ-SG 3.53Å; F48-C52 PolarHBondContact O-N 3.38Å; F48-C52 PolarHBondContact O-SG 2.88Å
49A93.6Very high90Very high0 Ų044 Ų440%023%0.233CC..Hα-helixtrans-59.9-47.5179.600000112F17 F18 S45 V46 S51 C52 T53F17-A49 HydrophobicContact CB-CB 4.15Å; F18-A49 HydrophobicContact CB-CB 4.01Å; S45-A49 VanDerWaalsContact O-CB 3.32Å; S45-A49 WeakPolarHBondContact O-CB 3.24Å; S45-A49 PolarHBondContact O-N 3.34Å; V46-A49 PolarHBondContact O-N 2.81Å; A49-S51 VanDerWaalsContact C-N 3.31Å; A49-S51 PolarHBondContact O-N 3.48Å; A49-C52 PolarHBondContact O-N 3.3Å; A49-T53 PolarHBondContact O-N 2.96Å; A49-T53 PolarHBondContact O-OG1 2.89Å
50F93.3Very high90.4Very high39 Ų3942.5 Ų42.517%0.17122%0.221CC..Hα-helixtrans-64.5-33.3177.1-78.7-59.7000113.4V46 F48 T53 M54 N78 V81 I82 I85V46-F50 HydrophobicContact CG1-CD2 3.54Å; V46-F50 HydrophobicContact CG1-CE2 3.45Å; V46-F50 VanDerWaalsContact CG1-CE2 3.45Å; V46-F50 VanDerWaalsContact O-CD2 3.23Å; V46-F50 WeakPolarHBondContact O-CD2 3.39Å; V46-F50 PolarHBondContact O-N 3.25Å; F48-F50 PolarHBondContact O-N 3.42Å; F50-T53 PolarHBondContact O-N 3.24Å; F50-M54 PolarHBondContact O-N 2.95Å; F50-N78 WeakPolarHBondContact CB-OD1 3.34Å; F50-N78 WeakPolarHBondContact CD1-OD1 3.4Å; F50-N78 PolarHBondContact O-ND2 3.38Å; F50-N78 PolarHBondContact O-OD1 2.66Å; F50-V81 HydrophobicContact CD2-CG1 3.77Å; F50-V81 HydrophobicContact CE1-CB 4.42Å; F50-V81 HydrophobicContact CE1-CG1 4.15Å; F50-V81 HydrophobicContact CE2-CB 4.43Å; F50-V81 HydrophobicContact CE2-CG1 3.36Å; F50-V81 HydrophobicContact CG-CG1 4.33Å; F50-V81 HydrophobicContact CZ-CB 4.28Å; F50-V81 HydrophobicContact CZ-CG1 3.57Å; F50-I82 HydrophobicContact CB-CD1 4.42Å; F50-I85 HydrophobicContact CD2-CD1 4.11Å; F50-I85 HydrophobicContact CE2-CD1 4.4Å
51S93.1Very high90.7Very high65 Ų6543.7 Ų43.746%0.45522%0.222SC..Hα-helixtrans-66.1-41.2172.3-170.50000112.2T47 F48 A49 M54 F55T47-S51 WeakPolarHBondContact O-CB 3.39Å; T47-S51 PolarHBondContact O-N 2.97Å; F48-S51 WeakPolarHBondContact O-CB 3.43Å; F48-S51 PolarHBondContact O-N 3.28Å; A49-S51 VanDerWaalsContact C-N 3.31Å; A49-S51 PolarHBondContact O-N 3.48Å; S51-M54 WeakPolarHBondContact O-CB 3.43Å; S51-M54 PolarHBondContact O-N 3.44Å; S51-F55 PolarHBondContact O-N 2.89Å
52C92.5Very high91.1Very high28 Ų2850 Ų5019%0.18926%0.255CS..Hα-helixtrans-65.5-42.6175-70.50000111.6F17 F48 A49 M54 F55 E56F17-C52 HydrophobicContact CB-CB 4.05Å; F17-C52 HydrophobicContact CD1-CB 3.98Å; F17-C52 HydrophobicContact CD2-CB 3.51Å; F17-C52 HydrophobicContact CE1-CB 4.3Å; F17-C52 HydrophobicContact CE2-CB 3.85Å; F17-C52 HydrophobicContact CG-CB 3.59Å; F17-C52 HydrophobicContact CZ-CB 4.24Å; F48-C52 VanDerWaalsContact CZ-SG 3.53Å; F48-C52 PolarHBondContact O-N 3.38Å; F48-C52 PolarHBondContact O-SG 2.88Å; A49-C52 PolarHBondContact O-N 3.3Å; C52-M54 VanDerWaalsContact C-N 3.29Å; C52-M54 PolarHBondContact O-N 2.87Å; C52-F55 WeakPolarHBondContact O-CB 3.47Å; C52-F55 PolarHBondContact O-N 3.34Å; C52-F55 VanDerWaalsContact O-N 3.12Å; C52-E56 PolarHBondContact O-N 3.47Å
53T92.3Very high91.2Very high8 Ų853.6 Ų53.65%0.04927%0.272CS..Hα-helixtrans-63.9-33.2176.2-55.80000112.3Q14 A49 F50 E56 L57Q14-T53 VanDerWaalsContact OE1-CB 3.32Å; Q14-T53 PolarHBondContact OE1-OG1 3.45Å; A49-T53 PolarHBondContact O-N 2.96Å; A49-T53 PolarHBondContact O-OG1 2.89Å; F50-T53 PolarHBondContact O-N 3.24Å; T53-E56 PolarHBondContact O-N 3.39Å; T53-L57 WeakPolarHBondContact O-CB 3.49Å; T53-L57 VanDerWaalsContact O-CG 3.31Å; T53-L57 WeakPolarHBondContact O-CG 3.41Å; T53-L57 PolarHBondContact O-N 2.9Å
54M91.8Very high91Very high26 Ų2654.8 Ų54.813%0.12829%0.293CS..Hα-helixtrans-61.6-46.2171.2-92.7-46.5175.500112.1F50 S51 C52 L57 I58 N78 L79F50-M54 PolarHBondContact O-N 2.95Å; S51-M54 WeakPolarHBondContact O-CB 3.43Å; S51-M54 PolarHBondContact O-N 3.44Å; C52-M54 VanDerWaalsContact C-N 3.29Å; C52-M54 PolarHBondContact O-N 2.87Å; M54-L57 PolarHBondContact O-N 3.4Å; M54-I58 WeakPolarHBondContact O-CG1 3.41Å; M54-I58 PolarHBondContact O-N 2.88Å; M54-I58 VanDerWaalsContact O-N 3.17Å; M54-N78 WeakPolarHBondContact CA-ND2 3.43Å; M54-N78 HydrophobicContact CE-CB 3.49Å; M54-N78 VanDerWaalsContact CE-CB 3.49Å; M54-N78 VanDerWaalsContact CE-CG 3.47Å; M54-N78 WeakPolarHBondContact CE-ND2 3.22Å; M54-N78 WeakPolarHBondContact CG-ND2 3.34Å; M54-N78 PolarHBondContact N-ND2 2.95Å; M54-N78 VanDerWaalsContact N-ND2 3.17Å; M54-N78 HydrophobicContact SD-CB 4.2Å; M54-N78 PolarHBondContact SD-ND2 2.93Å; M54-L79 VanDerWaalsContact CE-CA 3.4Å; M54-L79 HydrophobicContact CE-CB 3.81Å; M54-L79 HydrophobicContact CE-CD2 3.53Å; M54-L79 HydrophobicContact CE-CG 3.33Å
55F91.9Very high90.6Very high136 Ų13654.9 Ų54.960%0.59630%0.299SS*.Hα-helixtrans-66-41179.4-179-110.5000111.8S51 C52 L57 I58 I59S51-F55 PolarHBondContact O-N 2.89Å; C52-F55 WeakPolarHBondContact O-CB 3.47Å; C52-F55 PolarHBondContact O-N 3.34Å; C52-F55 VanDerWaalsContact O-N 3.12Å; F55-L57 PolarHBondContact O-N 3.31Å; F55-I58 PolarHBondContact O-N 3.1Å; F55-I59 HydrophobicContact CD1-CD1 3.74Å; F55-I59 HydrophobicContact CE1-CD1 3.36Å; F55-I59 HydrophobicContact CE1-CG1 4.34Å; F55-I59 HydrophobicContact CE2-CD1 4.49Å; F55-I59 HydrophobicContact CG-CD1 4.48Å; F55-I59 HydrophobicContact CZ-CD1 3.78Å; F55-I59 HydrophobicContact CZ-CG1 4.36Å; F55-I59 WeakPolarHBondContact O-CG1 3.19Å; F55-I59 PolarHBondContact O-N 3.32Å
56E91.9Very high90.1Very high27 Ų2756.1 Ų56.113%0.12631%0.305CS..Hα-helixtrans-59.8-44173.9-175.4-177.9-158.800111.9S13 F17 C52 T53 I58 I59 F60S13-E56 WeakPolarHBondContact CB-OE1 3.35Å; S13-E56 WeakPolarHBondContact CB-OE2 3.47Å; S13-E56 PolarHBondContact OG-OE1 2.71Å; S13-E56 PolarHBondContact OG-OE2 2.91Å; F17-E56 HydrophobicContact CE2-CB 4.28Å; F17-E56 VanDerWaalsContact CE2-OE2 3.32Å; F17-E56 WeakPolarHBondContact CE2-OE2 3.37Å; C52-E56 PolarHBondContact O-N 3.47Å; T53-E56 PolarHBondContact O-N 3.39Å; E56-I58 VanDerWaalsContact C-N 3.3Å; E56-I58 PolarHBondContact O-N 2.98Å; E56-I59 WeakPolarHBondContact O-CB 3.33Å; E56-I59 PolarHBondContact O-N 3.49Å; E56-I59 VanDerWaalsContact O-N 3.11Å; E56-F60 HydrophobicContact CG-CD2 3.97Å; E56-F60 HydrophobicContact CG-CE1 4.26Å; E56-F60 HydrophobicContact CG-CE2 3.5Å; E56-F60 HydrophobicContact CG-CZ 3.66Å; E56-F60 WeakPolarHBondContact O-CG 3.21Å; E56-F60 PolarHBondContact O-N 2.89Å; E56-F60 VanDerWaalsContact OE1-CE2 3.3Å; E56-F60 WeakPolarHBondContact OE1-CE2 3.46Å; E56-F60 VanDerWaalsContact OE1-CZ 3.24Å; E56-F60 WeakPolarHBondContact OE1-CZ 3.36Å
57L91.4Very high89.8Confident11 Ų1158 Ų586%0.05831%0.314CS..Hα-helixtrans-60.1-39.1176.1-78171.6000112.3M10 T53 M54 F55 F60 E61 H74 W75M10-L57 HydrophobicContact CE-CD2 4.47Å; M10-L57 HydrophobicContact SD-CD2 3.54Å; M10-L57 VanDerWaalsContact SD-CD2 3.54Å; M10-L57 HydrophobicContact SD-CG 4.17Å; T53-L57 WeakPolarHBondContact O-CB 3.49Å; T53-L57 VanDerWaalsContact O-CG 3.31Å; T53-L57 WeakPolarHBondContact O-CG 3.41Å; T53-L57 PolarHBondContact O-N 2.9Å; M54-L57 PolarHBondContact O-N 3.4Å; F55-L57 PolarHBondContact O-N 3.31Å; L57-F60 PolarHBondContact O-N 3.29Å; L57-E61 PolarHBondContact O-N 2.89Å; L57-H74 HydrophobicContact CD1-CB 4.23Å; L57-H74 HydrophobicContact CD2-CB 4.22Å; L57-W75 HydrophobicContact CD1-CB 4.39Å
58I92.4Very high89.4Confident100 Ų10060 Ų6051%0.51333%0.329SS..Hα-helixtrans-64.3-42.4174.7-66.5167.1000110.5M54 F55 E56 F60 E61 I62M54-I58 WeakPolarHBondContact O-CG1 3.41Å; M54-I58 PolarHBondContact O-N 2.88Å; M54-I58 VanDerWaalsContact O-N 3.17Å; F55-I58 PolarHBondContact O-N 3.1Å; E56-I58 VanDerWaalsContact C-N 3.3Å; E56-I58 PolarHBondContact O-N 2.98Å; I58-F60 PolarHBondContact O-N 3.04Å; I58-E61 WeakPolarHBondContact O-CB 3.35Å; I58-E61 PolarHBondContact O-N 3.46Å; I58-I62 HydrophobicContact CG2-CD1 4.07Å; I58-I62 WeakPolarHBondContact O-CG1 3.37Å; I58-I62 PolarHBondContact O-N 2.96Å
59I91.9Very high89.2Confident62 Ų6261.4 Ų61.432%0.31835%0.347SS..Hα-helixtrans-62-44.1176-68.9166.9000110.8F55 E56 E61 I62 L63F55-I59 HydrophobicContact CD1-CD1 3.74Å; F55-I59 HydrophobicContact CE1-CD1 3.36Å; F55-I59 HydrophobicContact CE1-CG1 4.34Å; F55-I59 HydrophobicContact CE2-CD1 4.49Å; F55-I59 HydrophobicContact CG-CD1 4.48Å; F55-I59 HydrophobicContact CZ-CD1 3.78Å; F55-I59 HydrophobicContact CZ-CG1 4.36Å; F55-I59 WeakPolarHBondContact O-CG1 3.19Å; F55-I59 PolarHBondContact O-N 3.32Å; E56-I59 WeakPolarHBondContact O-CB 3.33Å; E56-I59 PolarHBondContact O-N 3.49Å; E56-I59 VanDerWaalsContact O-N 3.11Å; I59-E61 VanDerWaalsContact C-N 3.32Å; I59-E61 PolarHBondContact O-N 3.44Å; I59-I62 PolarHBondContact O-N 3.49Å; I59-L63 HydrophobicContact CG2-CD1 3.65Å; I59-L63 HydrophobicContact CG2-CG 4.17Å; I59-L63 WeakPolarHBondContact O-CB 3.23Å; I59-L63 WeakPolarHBondContact O-CG 3.44Å; I59-L63 PolarHBondContact O-N 3.15Å
60F89.8Confident89Confident36 Ų3661.4 Ų61.416%0.15835%0.347CS..Hα-helixtrans-67.6-31.5178.6-68.6-16.3000113.2M10 E56 L57 I58 G64 V65 R71M10-F60 HydrophobicContact CE-CD2 3.45Å; M10-F60 VanDerWaalsContact CE-CD2 3.45Å; M10-F60 HydrophobicContact CE-CE2 3.25Å; E56-F60 HydrophobicContact CG-CD2 3.97Å; E56-F60 HydrophobicContact CG-CE1 4.26Å; E56-F60 HydrophobicContact CG-CE2 3.5Å; E56-F60 HydrophobicContact CG-CZ 3.66Å; E56-F60 WeakPolarHBondContact O-CG 3.21Å; E56-F60 PolarHBondContact O-N 2.89Å; E56-F60 VanDerWaalsContact OE1-CE2 3.3Å; E56-F60 WeakPolarHBondContact OE1-CE2 3.46Å; E56-F60 VanDerWaalsContact OE1-CZ 3.24Å; E56-F60 WeakPolarHBondContact OE1-CZ 3.36Å; L57-F60 PolarHBondContact O-N 3.29Å; I58-F60 PolarHBondContact O-N 3.04Å; F60-G64 PolarHBondContact O-N 2.91Å; F60-G64 VanDerWaalsContact O-N 3.11Å; F60-V65 PolarHBondContact O-N 3.3Å; F60-V65 VanDerWaalsContact O-N 3.09Å; F60-V65 VanDerWaalsContact O-O 3.09Å; F60-R71 PolarHBondContact O-NH1 2.9Å
61E89.6Confident88.7Confident95 Ų9560.4 Ų60.444%0.44434%0.342SS..Hα-helixtrans-61.6-48.2169.2-168.667.6-146.500111L57 I58 I59 G64 R71L57-E61 PolarHBondContact O-N 2.89Å; I58-E61 WeakPolarHBondContact O-CB 3.35Å; I58-E61 PolarHBondContact O-N 3.46Å; I59-E61 VanDerWaalsContact C-N 3.32Å; I59-E61 PolarHBondContact O-N 3.44Å; E61-G64 PolarHBondContact O-N 2.92Å; E61-R71 IonicContact OE1-CZ 3.7Å; E61-R71 IonicContact OE1-NH2 2.85Å; E61-R71 PolarHBondContact OE1-NH2 3.44Å; E61-R71 IonicContact OE2-CZ 3.03Å; E61-R71 IonicContact OE2-NE 2.73Å; E61-R71 PolarHBondContact OE2-NE 3.13Å; E61-R71 IonicContact OE2-NH2 2.95Å; E61-R71 PolarHBondContact OE2-NH2 3.36Å
62I91.5Very high88.5Confident136 Ų13664.4 Ų64.470%0.69735%0.348SS*.Hα-helixtrans-64.7-41.7179.9-64.2165.4000111.6I58 I59 G64I58-I62 HydrophobicContact CG2-CD1 4.07Å; I58-I62 WeakPolarHBondContact O-CG1 3.37Å; I58-I62 PolarHBondContact O-N 2.96Å; I59-I62 PolarHBondContact O-N 3.49Å; I62-G64 PolarHBondContact O-N 3.17Å
63L88.9Confident88.3Confident117 Ų11767.9 Ų67.961%0.61336%0.361SS*.Hα-helixtrans-77-8.4-179.4-66.6177.1000113.4I59 V65I59-L63 HydrophobicContact CG2-CD1 3.65Å; I59-L63 HydrophobicContact CG2-CG 4.17Å; I59-L63 WeakPolarHBondContact O-CB 3.23Å; I59-L63 WeakPolarHBondContact O-CG 3.44Å; I59-L63 PolarHBondContact O-N 3.15Å; L63-V65 HydrophobicContact CB-CG2 3.91Å; L63-V65 PolarHBondContact O-N 3.21Å
64G83.3Confident88.3Confident58 Ų5868.7 Ų68.760%0.59836%0.364SS*.THydrogen-bonded Turntrans66.319.9-176.200000113.7F60 E61 I62F60-G64 PolarHBondContact O-N 2.91Å; F60-G64 VanDerWaalsContact O-N 3.11Å; E61-G64 PolarHBondContact O-N 2.92Å; I62-G64 PolarHBondContact O-N 3.17Å
65V79.2Confident88.3Confident72 Ų7273.6 Ų73.644%0.43638%0.381SS..  trans-89.2150.9176.8-178.90000108.1F60 L63 R71F60-V65 PolarHBondContact O-N 3.3Å; F60-V65 VanDerWaalsContact O-N 3.09Å; F60-V65 VanDerWaalsContact O-O 3.09Å; L63-V65 HydrophobicContact CB-CG2 3.91Å; L63-V65 PolarHBondContact O-N 3.21Å; V65-R71 PolarHBondContact O-NH1 3.37Å
66L79Confident88.2Confident27 Ų2772.6 Ų72.614%0.14138%0.376CS..SBendtrans71.5150.2-172.5-105.267.2000115.3D6 I9 M10 R71D6-L66 HydrophobicContact CB-CD1 4.4Å; D6-L66 HydrophobicContact CB-CD2 4.09Å; D6-L66 HydrophobicContact CB-CG 3.82Å; I9-L66 HydrophobicContact CD1-CD1 4.4Å; M10-L66 HydrophobicContact CE-CD2 3.99Å; M10-L66 HydrophobicContact CG-CD2 4.18Å; M10-L66 HydrophobicContact SD-CD2 4.26Å; L66-R71 HydrophobicContact CB-CG 3.68Å; L66-R71 HydrophobicContact CD2-CG 4.18Å; L66-R71 PolarHBondContact O-NH1 3.07Å
67N85.1Confident88.1Confident77 Ų7775.5 Ų75.541%0.41239%0.391SS..  trans-72.4132.6178.2-171.5-10.3000111.8S2 D6 S69 S70 R71S2-N67 WeakPolarHBondContact OG-CB 2.96Å; S2-N67 PolarHBondContact OG-ND2 3.35Å; D6-N67 WeakPolarHBondContact OD2-CB 2.92Å; D6-N67 PolarHBondContact OD2-N 3.33Å; N67-S69 VanDerWaalsContact C-N 3.28Å; N67-S69 PolarHBondContact O-N 3.3Å; N67-S70 WeakPolarHBondContact O-CA 3.43Å; N67-S70 WeakPolarHBondContact O-CB 3.39Å; N67-S70 PolarHBondContact O-N 3.37Å; N67-R71 PolarHBondContact O-N 2.92Å
68S84.9Confident88.2Confident77 Ų7775.2 Ų75.254%0.53839%0.389SS..Hα-helixtrans-54.4-39.1-174.7-48.10000113.8R71 Y72S68-R71 PolarHBondContact O-N 3.47Å; S68-Y72 PolarHBondContact O-N 3.43Å; S68-Y72 VanDerWaalsContact O-N 3.07Å
69S86.2Confident88.1Confident92 Ų9272.4 Ų72.464%0.64338%0.375SS*.Hα-helixtrans-68.1-35.2177.7-55.30000112.8N67 F73N67-S69 VanDerWaalsContact C-N 3.28Å; N67-S69 PolarHBondContact O-N 3.3Å; S69-F73 PolarHBondContact O-N 3.4Å
70S88Confident88Confident1 Ų171.5 Ų71.51%0.00737%0.374CS..Hα-helixtrans-69.8-45176.8-168.40000110.7D6 N67 Y72 F73 H74D6-S70 WeakPolarHBondContact CB-OG 3.47Å; N67-S70 WeakPolarHBondContact O-CA 3.43Å; N67-S70 WeakPolarHBondContact O-CB 3.39Å; N67-S70 PolarHBondContact O-N 3.37Å; S70-Y72 PolarHBondContact O-N 2.88Å; S70-F73 PolarHBondContact O-N 3.35Å; S70-H74 PolarHBondContact O-CD2 3.32Å; S70-H74 PolarHBondContact O-N 3.18Å; S70-H74 PolarHBondContact OG-CD2 3.47Å
71R87.8Confident88.1Confident17 Ų1771.8 Ų71.86%0.06438%0.378CS..Hα-helixtrans-58.8-46.8177.2-63.1-168.5-54-144.26.3111.9F60 E61 V65 L66 N67 S68 F73 H74 W75F60-R71 PolarHBondContact O-NH1 2.9Å; E61-R71 IonicContact OE1-CZ 3.7Å; E61-R71 IonicContact OE1-NH2 2.85Å; E61-R71 PolarHBondContact OE1-NH2 3.44Å; E61-R71 IonicContact OE2-CZ 3.03Å; E61-R71 IonicContact OE2-NE 2.73Å; E61-R71 PolarHBondContact OE2-NE 3.13Å; E61-R71 IonicContact OE2-NH2 2.95Å; E61-R71 PolarHBondContact OE2-NH2 3.36Å; V65-R71 PolarHBondContact O-NH1 3.37Å; L66-R71 HydrophobicContact CB-CG 3.68Å; L66-R71 HydrophobicContact CD2-CG 4.18Å; L66-R71 PolarHBondContact O-NH1 3.07Å; N67-R71 PolarHBondContact O-N 2.92Å; S68-R71 PolarHBondContact O-N 3.47Å; R71-F73 VanDerWaalsContact C-N 3.31Å; R71-F73 PolarHBondContact O-N 3.36Å; R71-H74 PolarHBondContact O-N 2.95Å; R71-W75 WeakPolarHBondContact O-CB 3.49Å; R71-W75 PolarHBondContact O-N 3.44Å
72Y88.3Confident88.2Confident149 Ų14968.8 Ų68.858%0.58437%0.365SS*.Hα-helixtrans-60.9-40.5179.2-176.9-100.9000112.3S68 S70 K76S68-Y72 PolarHBondContact O-N 3.43Å; S68-Y72 VanDerWaalsContact O-N 3.07Å; S70-Y72 PolarHBondContact O-N 2.88Å; Y72-K76 WeakPolarHBondContact O-CB 3.41Å; Y72-K76 PolarHBondContact O-N 3.46Å
73F90.2Very high88.1Confident102 Ų10263.1 Ų63.145%0.44734%0.336SS..Hα-helixtrans-64.2-50.6176.1177.5-101.3000112.2F3 S69 S70 R71 W75 K76 M77F3-F73 HydrophobicContact CE2-CD1 4.32Å; F3-F73 HydrophobicContact CZ-CD1 4.02Å; F3-F73 HydrophobicContact CZ-CE1 4.33Å; S69-F73 PolarHBondContact O-N 3.4Å; S70-F73 PolarHBondContact O-N 3.35Å; R71-F73 VanDerWaalsContact C-N 3.31Å; R71-F73 PolarHBondContact O-N 3.36Å; F73-W75 VanDerWaalsContact C-N 3.32Å; F73-W75 PolarHBondContact O-N 2.82Å; F73-K76 PolarHBondContact O-N 3.31Å; F73-M77 HydrophobicContact CE1-CE 3.63Å; F73-M77 HydrophobicContact CZ-CE 3.98Å; F73-M77 WeakPolarHBondContact O-CB 3.43Å; F73-M77 PolarHBondContact O-N 3.4Å
74H91.3Very high88.2Confident24 Ų2461.6 Ų61.611%0.11133%0.328CS..Hα-helixtrans-63.5-37.8178.5-74.1-61000112.1S7 L57 S70 R71 M77 N78S7-H74 PolarHBondContact OG-NE2 3.29Å; L57-H74 HydrophobicContact CD1-CB 4.23Å; L57-H74 HydrophobicContact CD2-CB 4.22Å; S70-H74 PolarHBondContact O-CD2 3.32Å; S70-H74 PolarHBondContact O-N 3.18Å; S70-H74 PolarHBondContact OG-CD2 3.47Å; R71-H74 PolarHBondContact O-N 2.95Å; H74-M77 PolarHBondContact O-N 2.84Å; H74-N78 WeakPolarHBondContact O-CB 3.49Å; H74-N78 PolarHBondContact O-N 2.9Å
75W90.9Very high88.6Confident130 Ų13059.8 Ų59.849%0.49231%0.305SS..Hα-helixtrans-61.1-51.6173.9-178.79.8000111.2L57 R71 F73 M77 N78 L79L57-W75 HydrophobicContact CD1-CB 4.39Å; R71-W75 WeakPolarHBondContact O-CB 3.49Å; R71-W75 PolarHBondContact O-N 3.44Å; F73-W75 VanDerWaalsContact C-N 3.32Å; F73-W75 PolarHBondContact O-N 2.82Å; W75-M77 PolarHBondContact O-N 3.23Å; W75-N78 PolarHBondContact O-N 3.49Å; W75-L79 VanDerWaalsContact NE1-CD1 3.25Å; W75-L79 WeakPolarHBondContact O-CB 3.47Å; W75-L79 PolarHBondContact O-N 3.4Å
76K90Very high89.1Confident114 Ų11460.6 Ų60.650%0.49631%0.306SS..Hα-helixtrans-62.8-41.6179.3-173175179.6176.10112.2Y72 F73 C80Y72-K76 WeakPolarHBondContact O-CB 3.41Å; Y72-K76 PolarHBondContact O-N 3.46Å; F73-K76 PolarHBondContact O-N 3.31Å; K76-C80 WeakPolarHBondContact O-CB 3.49Å; K76-C80 PolarHBondContact O-N 3.49Å
77M90.8Very high89.6Confident89 Ų8959.4 Ų59.444%0.43830%0.3SS..Hα-helixtrans-62.6-51.1176.6-172.9-146.8-75.200111F73 H74 W75 L79 C80 V81F73-M77 HydrophobicContact CE1-CE 3.63Å; F73-M77 HydrophobicContact CZ-CE 3.98Å; F73-M77 WeakPolarHBondContact O-CB 3.43Å; F73-M77 PolarHBondContact O-N 3.4Å; H74-M77 PolarHBondContact O-N 2.84Å; W75-M77 PolarHBondContact O-N 3.23Å; M77-L79 VanDerWaalsContact C-N 3.3Å; M77-L79 PolarHBondContact O-N 2.85Å; M77-C80 WeakPolarHBondContact O-CB 3.31Å; M77-C80 PolarHBondContact O-N 3.33Å; M77-C80 VanDerWaalsContact O-N 3.14Å; M77-V81 WeakPolarHBondContact O-CG2 3.28Å; M77-V81 PolarHBondContact O-N 3.46Å
78N92.6Very high89.8Confident4 Ų459.3 Ų59.32%0.02130%0.296CS..Hα-helixtrans-61.7-40.4-179.2-17217.3000111.1F50 M54 H74 W75 C80 V81 I82F50-N78 WeakPolarHBondContact CB-OD1 3.34Å; F50-N78 WeakPolarHBondContact CD1-OD1 3.4Å; F50-N78 PolarHBondContact O-ND2 3.38Å; F50-N78 PolarHBondContact O-OD1 2.66Å; M54-N78 WeakPolarHBondContact CA-ND2 3.43Å; M54-N78 HydrophobicContact CE-CB 3.49Å; M54-N78 VanDerWaalsContact CE-CB 3.49Å; M54-N78 VanDerWaalsContact CE-CG 3.47Å; M54-N78 WeakPolarHBondContact CE-ND2 3.22Å; M54-N78 WeakPolarHBondContact CG-ND2 3.34Å; M54-N78 PolarHBondContact N-ND2 2.95Å; M54-N78 VanDerWaalsContact N-ND2 3.17Å; M54-N78 HydrophobicContact SD-CB 4.2Å; M54-N78 PolarHBondContact SD-ND2 2.93Å; H74-N78 WeakPolarHBondContact O-CB 3.49Å; H74-N78 PolarHBondContact O-N 2.9Å; W75-N78 PolarHBondContact O-N 3.49Å; N78-C80 VanDerWaalsContact C-N 3.33Å; N78-C80 PolarHBondContact O-N 2.86Å; N78-V81 PolarHBondContact O-N 3.18Å; N78-I82 WeakPolarHBondContact O-CB 3.49Å; N78-I82 WeakPolarHBondContact O-CG2 3.41Å; N78-I82 PolarHBondContact O-N 3.31Å
79L90.3Very high90.1Very high41 Ų4160.1 Ų60.122%0.21529%0.292CS..Hα-helixtrans-61.2-43.5175.9-90.6-177.4000111M54 W75 M77 I82 L83 I147M54-L79 VanDerWaalsContact CE-CA 3.4Å; M54-L79 HydrophobicContact CE-CB 3.81Å; M54-L79 HydrophobicContact CE-CD2 3.53Å; M54-L79 HydrophobicContact CE-CG 3.33Å; W75-L79 VanDerWaalsContact NE1-CD1 3.25Å; W75-L79 WeakPolarHBondContact O-CB 3.47Å; W75-L79 PolarHBondContact O-N 3.4Å; M77-L79 VanDerWaalsContact C-N 3.3Å; M77-L79 PolarHBondContact O-N 2.85Å; L79-I82 WeakPolarHBondContact O-CG2 3.27Å; L79-L83 WeakPolarHBondContact O-CB 3.45Å; L79-L83 PolarHBondContact O-N 3.48Å; L79-L83 VanDerWaalsContact O-N 3.12Å; L79-I147 HydrophobicContact CD1-CD1 3.88Å; L79-I147 HydrophobicContact CD2-CD1 3.37Å; L79-I147 HydrophobicContact CG-CD1 4.23Å
80C90.3Very high90.3Very high43 Ų4358.2 Ų58.229%0.29128%0.277SS..Hα-helixtrans-61.7-47.8177.3-173.50000111.2K76 M77 N78 L83 L84K76-C80 WeakPolarHBondContact O-CB 3.49Å; K76-C80 PolarHBondContact O-N 3.49Å; M77-C80 WeakPolarHBondContact O-CB 3.31Å; M77-C80 PolarHBondContact O-N 3.33Å; M77-C80 VanDerWaalsContact O-N 3.14Å; N78-C80 VanDerWaalsContact C-N 3.33Å; N78-C80 PolarHBondContact O-N 2.86Å; C80-L83 PolarHBondContact O-N 3.27Å; C80-L84 WeakPolarHBondContact O-CB 3.32Å; C80-L84 VanDerWaalsContact O-CG 3.31Å; C80-L84 WeakPolarHBondContact O-CG 3.45Å; C80-L84 PolarHBondContact O-N 2.93Å
81V91.8Very high90.4Very high42 Ų4258.8 Ų58.826%0.25528%0.281SS..Hα-helixtrans-66.2-47.7-177.2177.30000111.8F50 M77 N78 L83 L84 I85F50-V81 HydrophobicContact CD2-CG1 3.77Å; F50-V81 HydrophobicContact CE1-CB 4.42Å; F50-V81 HydrophobicContact CE1-CG1 4.15Å; F50-V81 HydrophobicContact CE2-CB 4.43Å; F50-V81 HydrophobicContact CE2-CG1 3.36Å; F50-V81 HydrophobicContact CG-CG1 4.33Å; F50-V81 HydrophobicContact CZ-CB 4.28Å; F50-V81 HydrophobicContact CZ-CG1 3.57Å; M77-V81 WeakPolarHBondContact O-CG2 3.28Å; M77-V81 PolarHBondContact O-N 3.46Å; N78-V81 PolarHBondContact O-N 3.18Å; V81-L83 VanDerWaalsContact C-N 3.28Å; V81-L83 PolarHBondContact O-N 2.87Å; V81-L84 PolarHBondContact O-N 3.17Å; V81-I85 HydrophobicContact CG1-CD1 3.78Å; V81-I85 HydrophobicContact CG1-CG1 4.45Å; V81-I85 VanDerWaalsContact O-CG1 3.31Å; V81-I85 WeakPolarHBondContact O-CG1 3.48Å; V81-I85 PolarHBondContact O-N 2.96Å
82I91.3Very high90.6Very high33 Ų3361.3 Ų61.317%0.16929%0.292CS..Hα-helixtrans-64.4-36.4-178.9-157.8166.4000111.6F50 N78 L79 I85 L86F50-I82 HydrophobicContact CB-CD1 4.42Å; N78-I82 WeakPolarHBondContact O-CB 3.49Å; N78-I82 WeakPolarHBondContact O-CG2 3.41Å; N78-I82 PolarHBondContact O-N 3.31Å; L79-I82 WeakPolarHBondContact O-CG2 3.27Å; I82-I85 PolarHBondContact O-N 3.4Å; I82-L86 VanDerWaalsContact O-CB 3.23Å; I82-L86 WeakPolarHBondContact O-CB 3.25Å; I82-L86 PolarHBondContact O-N 2.97Å
83L90.4Very high90.6Very high16 Ų1657.7 Ų57.78%0.08428%0.278CS..Hα-helixtrans-70-40.7177.6-174.3121.9000111.7L79 C80 V81 L86 V87 L146 I147L79-L83 WeakPolarHBondContact O-CB 3.45Å; L79-L83 PolarHBondContact O-N 3.48Å; L79-L83 VanDerWaalsContact O-N 3.12Å; C80-L83 PolarHBondContact O-N 3.27Å; V81-L83 VanDerWaalsContact C-N 3.28Å; V81-L83 PolarHBondContact O-N 2.87Å; L83-L86 PolarHBondContact O-N 3.02Å; L83-V87 HydrophobicContact CG-CG2 4.41Å; L83-V87 VanDerWaalsContact O-CB 3.25Å; L83-V87 WeakPolarHBondContact O-CB 3.23Å; L83-V87 WeakPolarHBondContact O-CG2 3.32Å; L83-V87 PolarHBondContact O-N 3.44Å; L83-L146 HydrophobicContact CD1-CB 4.25Å; L83-L146 HydrophobicContact CD1-CG 3.96Å; L83-L146 HydrophobicContact CD2-CB 3.99Å; L83-L146 HydrophobicContact CD2-CD2 3.23Å; L83-L146 HydrophobicContact CD2-CG 3.51Å; L83-L146 HydrophobicContact CG-CD2 4.03Å; L83-L146 HydrophobicContact CG-CG 3.9Å; L83-I147 HydrophobicContact CD1-CB 3.95Å; L83-I147 HydrophobicContact CD1-CG1 4.41Å
84L90.7Very high90.5Very high85 Ų8557.3 Ų57.345%0.44528%0.279SS..Hα-helixtrans-61.2-43.7171.8-76174.4000111.6C80 V81 F88 M89C80-L84 WeakPolarHBondContact O-CB 3.32Å; C80-L84 VanDerWaalsContact O-CG 3.31Å; C80-L84 WeakPolarHBondContact O-CG 3.45Å; C80-L84 PolarHBondContact O-N 2.93Å; V81-L84 PolarHBondContact O-N 3.17Å; L84-F88 HydrophobicContact CD2-CD2 3.86Å; L84-F88 HydrophobicContact CD2-CE2 4.01Å; L84-F88 WeakPolarHBondContact O-CA 3.31Å; L84-F88 VanDerWaalsContact O-CB 3.28Å; L84-F88 WeakPolarHBondContact O-CB 3.39Å; L84-F88 PolarHBondContact O-N 2.93Å; L84-M89 PolarHBondContact O-N 3.32Å
85I91.3Very high90.4Very high21 Ų2156.2 Ų56.211%0.10828%0.275CS..Iπ-helixtrans-64.2-48.3178.8-66.8165.3000110.5I43 V46 T47 F50 V81 I82 M89 V90I43-I85 HydrophobicContact CG2-CG2 4.36Å; V46-I85 HydrophobicContact CG1-CD1 3.73Å; T47-I85 VanDerWaalsContact OG1-CG2 3.32Å; T47-I85 WeakPolarHBondContact OG1-CG2 3.37Å; F50-I85 HydrophobicContact CD2-CD1 4.11Å; F50-I85 HydrophobicContact CE2-CD1 4.4Å; V81-I85 HydrophobicContact CG1-CD1 3.78Å; V81-I85 HydrophobicContact CG1-CG1 4.45Å; V81-I85 VanDerWaalsContact O-CG1 3.31Å; V81-I85 WeakPolarHBondContact O-CG1 3.48Å; V81-I85 PolarHBondContact O-N 2.96Å; I82-I85 PolarHBondContact O-N 3.4Å; I85-M89 WeakPolarHBondContact O-CB 3.34Å; I85-M89 PolarHBondContact O-N 3.16Å; I85-V90 HydrophobicContact CG2-CG2 4.22Å; I85-V90 WeakPolarHBondContact O-CG2 3.28Å; I85-V90 PolarHBondContact O-N 3.48Å
86L90.1Very high90.2Very high88 Ų8852.5 Ų52.546%0.46126%0.261SS..Iπ-helixtrans-70.5-42.7-174.1-171147.3000112.6I82 L83 P91 V150I82-L86 VanDerWaalsContact O-CB 3.23Å; I82-L86 WeakPolarHBondContact O-CB 3.25Å; I82-L86 PolarHBondContact O-N 2.97Å; L83-L86 PolarHBondContact O-N 3.02Å; L86-P91 WeakPolarHBondContact O-CD 3.36Å; L86-V150 HydrophobicContact CD2-CG1 3.74Å; L86-V150 HydrophobicContact CD2-CG2 4.39Å
87V89.4Confident90Very high3 Ų352.3 Ų52.32%0.01826%0.26CS..Iπ-helixtrans-84.5-37.6-175.9176.40000111.8L83 P91 M121 F124 L146 V150L83-V87 HydrophobicContact CG-CG2 4.41Å; L83-V87 VanDerWaalsContact O-CB 3.25Å; L83-V87 WeakPolarHBondContact O-CB 3.23Å; L83-V87 WeakPolarHBondContact O-CG2 3.32Å; L83-V87 PolarHBondContact O-N 3.44Å; V87-P91 WeakPolarHBondContact O-CG 3.22Å; V87-M121 HydrophobicContact CG1-CE 3.62Å; V87-M121 HydrophobicContact CG1-SD 4.31Å; V87-M121 WeakPolarHBondContact O-CE 3.31Å; V87-F124 HydrophobicContact CG1-CE1 4.26Å; V87-F124 HydrophobicContact CG1-CZ 4.49Å; V87-F124 HydrophobicContact CG2-CZ 4.32Å; V87-L146 HydrophobicContact CG1-CD1 4.23Å; V87-L146 HydrophobicContact CG2-CD1 4.17Å; V87-L146 HydrophobicContact CG2-CG 4.42Å; V87-V150 HydrophobicContact CG2-CG2 3.5Å; V87-V150 VanDerWaalsContact CG2-CG2 3.5Å
88F90.1Very high89.8Confident74 Ų7452 Ų5233%0.32526%0.26SS..Iπ-helixtrans-102.9-58.6-173.4-64.9-98.9000112.4L84 F92 W117 M121 L146L84-F88 HydrophobicContact CD2-CD2 3.86Å; L84-F88 HydrophobicContact CD2-CE2 4.01Å; L84-F88 WeakPolarHBondContact O-CA 3.31Å; L84-F88 VanDerWaalsContact O-CB 3.28Å; L84-F88 WeakPolarHBondContact O-CB 3.39Å; L84-F88 PolarHBondContact O-N 2.93Å; F88-F92 WeakPolarHBondContact O-CB 3.4Å; F88-F92 PolarHBondContact O-N 2.78Å; F88-W117 HydrophobicContact CD1-CH2 4.27Å; F88-W117 AromaticContact CD1-CZ2 3.56Å; F88-W117 HydrophobicContact CD1-CZ2 3.56Å; F88-W117 HydrophobicContact CE1-CH2 4.46Å; F88-W117 HydrophobicContact CE1-CZ2 4.04Å; F88-W117 PolarHBondContact O-NE1 2.98Å; F88-M121 HydrophobicContact CE1-SD 4.21Å; F88-L146 HydrophobicContact CE2-CD2 4.27Å
89M89.9Confident89.5Confident94 Ų9452.2 Ų52.246%0.46326%0.261SS..Iπ-helixtrans-67.3-54-171.8-79.2-69.4-167.900112.3L84 I85 F92 Y93L84-M89 PolarHBondContact O-N 3.32Å; I85-M89 WeakPolarHBondContact O-CB 3.34Å; I85-M89 PolarHBondContact O-N 3.16Å; M89-F92 WeakPolarHBondContact O-CB 3.22Å; M89-F92 PolarHBondContact O-N 2.99Å; M89-F92 VanDerWaalsContact O-N 3.17Å; M89-Y93 HydrophobicContact CB-CD2 4.45Å; M89-Y93 HydrophobicContact CB-CE2 4.49Å; M89-Y93 WeakPolarHBondContact O-CD2 3.39Å; M89-Y93 PolarHBondContact O-N 3.18Å; M89-Y93 HydrophobicContact SD-CD2 4.37Å; M89-Y93 HydrophobicContact SD-CE2 3.64Å
90V89.9Confident89Confident52 Ų5252.8 Ų52.832%0.31527%0.268SS..Hα-helixtrans-54-53.5-176.1171.50000113I85 F92 Y93 I94I85-V90 HydrophobicContact CG2-CG2 4.22Å; I85-V90 WeakPolarHBondContact O-CG2 3.28Å; I85-V90 PolarHBondContact O-N 3.48Å; V90-F92 VanDerWaalsContact C-N 3.3Å; V90-F92 PolarHBondContact O-N 3.48Å; V90-Y93 PolarHBondContact O-N 2.86Å; V90-I94 HydrophobicContact CG1-CD1 3.65Å; V90-I94 HydrophobicContact CG1-CG1 4.45Å; V90-I94 WeakPolarHBondContact O-CG1 3.46Å; V90-I94 PolarHBondContact O-N 3.1Å
91P91.6Very high88.6Confident14 Ų1456.7 Ų56.79%0.09129%0.286CS..Hα-helixtrans-66.7-30.9-18023-31.5000113L86 V87 G95 F120L86-P91 WeakPolarHBondContact O-CD 3.36Å; V87-P91 WeakPolarHBondContact O-CG 3.22Å; P91-G95 PolarHBondContact O-N 2.9Å; P91-F120 HydrophobicContact CB-CD1 3.55Å; P91-F120 HydrophobicContact CB-CE1 3.54Å; P91-F120 HydrophobicContact CB-CG 4.1Å; P91-F120 HydrophobicContact CB-CZ 4.05Å; P91-F120 HydrophobicContact CG-CD1 3.84Å; P91-F120 HydrophobicContact CG-CE1 3.52Å; P91-F120 HydrophobicContact CG-CZ 4.27Å
92F90.7Very high88.2Confident69 Ų6958.6 Ų58.630%0.30329%0.294SS..Hα-helixtrans-63-45.4173.8179.3-99.1000111.3F88 M89 V90 G95 Y96 W117F88-F92 WeakPolarHBondContact O-CB 3.4Å; F88-F92 PolarHBondContact O-N 2.78Å; M89-F92 WeakPolarHBondContact O-CB 3.22Å; M89-F92 PolarHBondContact O-N 2.99Å; M89-F92 VanDerWaalsContact O-N 3.17Å; V90-F92 VanDerWaalsContact C-N 3.3Å; V90-F92 PolarHBondContact O-N 3.48Å; F92-G95 PolarHBondContact O-N 3.46Å; F92-Y96 WeakPolarHBondContact O-CB 3.4Å; F92-Y96 PolarHBondContact O-N 2.91Å; F92-W117 HydrophobicContact CB-CG 4.26Å; F92-W117 HydrophobicContact CD2-CB 4.21Å; F92-W117 HydrophobicContact CD2-CG 4.09Å
93Y88.9Confident87.4Confident73 Ų7368.2 Ų68.229%0.28633%0.329SS..Hα-helixtrans-68-39178-82-75.6000113.2V39 I43 M89 V90 G95 Y96 F97V39-Y93 HydrophobicContact CB-CE1 4.47Å; V39-Y93 HydrophobicContact CG1-CD1 4.41Å; V39-Y93 HydrophobicContact CG1-CE1 3.43Å; V39-Y93 VanDerWaalsContact CG1-CE1 3.43Å; V39-Y93 HydrophobicContact CG1-CE2 4.46Å; V39-Y93 VanDerWaalsContact CG1-CZ 3.47Å; V39-Y93 WeakPolarHBondContact CG1-OH 3.23Å; I43-Y93 HydrophobicContact CD1-CD1 4.18Å; I43-Y93 HydrophobicContact CD1-CD2 3.33Å; I43-Y93 HydrophobicContact CD1-CE1 4.04Å; I43-Y93 HydrophobicContact CD1-CE2 3.17Å; I43-Y93 HydrophobicContact CD1-CG 3.86Å; I43-Y93 HydrophobicContact CG1-CE2 4.35Å; M89-Y93 HydrophobicContact CB-CD2 4.45Å; M89-Y93 HydrophobicContact CB-CE2 4.49Å; M89-Y93 WeakPolarHBondContact O-CD2 3.39Å; M89-Y93 PolarHBondContact O-N 3.18Å; M89-Y93 HydrophobicContact SD-CD2 4.37Å; M89-Y93 HydrophobicContact SD-CE2 3.64Å; V90-Y93 PolarHBondContact O-N 2.86Å; Y93-G95 VanDerWaalsContact C-N 3.34Å; Y93-Y96 PolarHBondContact O-N 3.24Å; Y93-F97 WeakPolarHBondContact O-CB 3.1Å; Y93-F97 PolarHBondContact O-N 3.24Å
94I88.6Confident86.4Confident94 Ų9475 Ų7548%0.48236%0.364SS..Hα-helixtrans-61.4-46.7174.1-67.5164.9000109.7V90 Y96 F97 I98V90-I94 HydrophobicContact CG1-CD1 3.65Å; V90-I94 HydrophobicContact CG1-CG1 4.45Å; V90-I94 WeakPolarHBondContact O-CG1 3.46Å; V90-I94 PolarHBondContact O-N 3.1Å; I94-Y96 VanDerWaalsContact C-N 3.34Å; I94-Y96 PolarHBondContact O-N 2.93Å; I94-F97 PolarHBondContact O-N 3.4Å; I94-I98 HydrophobicContact CG2-CD1 3.8Å; I94-I98 HydrophobicContact CG2-CG1 4.44Å; I94-I98 VanDerWaalsContact O-CG1 3.32Å; I94-I98 WeakPolarHBondContact O-CG1 3.46Å; I94-I98 PolarHBondContact O-N 3.15Å
95G88.2Confident85.3Confident1 Ų173.1 Ų73.11%0.0135%0.354CS..Hα-helixtrans-61.9-41.8177.400000112.9P91 F92 Y93 F97 I98 V99P91-G95 PolarHBondContact O-N 2.9Å; F92-G95 PolarHBondContact O-N 3.46Å; Y93-G95 VanDerWaalsContact C-N 3.34Å; G95-F97 VanDerWaalsContact C-N 3.31Å; G95-F97 PolarHBondContact O-N 3.4Å; G95-I98 PolarHBondContact O-N 3.48Å; G95-V99 WeakPolarHBondContact O-CG2 3.32Å; G95-V99 PolarHBondContact O-N 3.24Å
96Y88.1Confident84.4Confident52 Ų5278.7 Ų78.720%0.20438%0.379CS..Hα-helixtrans-60.4-42175177.8-96.6000111.8F92 Y93 I94 S100 R109 L110 S113F92-Y96 WeakPolarHBondContact O-CB 3.4Å; F92-Y96 PolarHBondContact O-N 2.91Å; Y93-Y96 PolarHBondContact O-N 3.24Å; I94-Y96 VanDerWaalsContact C-N 3.34Å; I94-Y96 PolarHBondContact O-N 2.93Å; Y96-S100 VanDerWaalsContact O-CB 3.23Å; Y96-S100 WeakPolarHBondContact O-CB 3.3Å; Y96-S100 PolarHBondContact O-N 3.41Å; Y96-R109 HydrophobicContact CD2-CG 4.39Å; Y96-R109 HydrophobicContact CE2-CG 4.15Å; Y96-R109 PolarHBondContact OH-NE 3.24Å; Y96-R109 PolarHBondContact OH-NH2 2.96Å; Y96-L110 HydrophobicContact CD2-CD2 4.17Å; Y96-L110 HydrophobicContact CE2-CD2 3.91Å; Y96-S113 WeakPolarHBondContact CA-OG 3.49Å; Y96-S113 WeakPolarHBondContact CB-OG 3.43Å; Y96-S113 PolarHBondContact N-OG 2.91Å; Y96-S113 VanDerWaalsContact N-OG 3.08Å
97F85.4Confident83.7Confident110 Ų11084.6 Ų84.648%0.48240%0.401SS..Hα-helixtrans-66.8-43.8178.5-170.5-98000112.2Y93 I94 G95 V99 S100 N101Y93-F97 WeakPolarHBondContact O-CB 3.1Å; Y93-F97 PolarHBondContact O-N 3.24Å; I94-F97 PolarHBondContact O-N 3.4Å; G95-F97 VanDerWaalsContact C-N 3.31Å; G95-F97 PolarHBondContact O-N 3.4Å; F97-V99 PolarHBondContact O-N 2.93Å; F97-S100 PolarHBondContact O-N 3.44Å; F97-N101 PolarHBondContact O-N 3.02Å; F97-N101 VanDerWaalsContact O-N 3.09Å
98I85.7Confident83.4Confident84 Ų8489.8 Ų89.843%0.43143%0.425SS..Hα-helixtrans-58.5-49.4176.2-68166.7000110.4I94 G95 S100 N101I94-I98 HydrophobicContact CG2-CD1 3.8Å; I94-I98 HydrophobicContact CG2-CG1 4.44Å; I94-I98 VanDerWaalsContact O-CG1 3.32Å; I94-I98 WeakPolarHBondContact O-CG1 3.46Å; I94-I98 PolarHBondContact O-N 3.15Å; G95-I98 PolarHBondContact O-N 3.48Å; I98-S100 VanDerWaalsContact C-N 3.32Å; I98-S100 PolarHBondContact O-N 2.86Å; I98-N101 WeakPolarHBondContact O-CB 3.42Å; I98-N101 PolarHBondContact O-N 3.43Å
99V86.2Confident83Confident8 Ų889.2 Ų89.25%0.04842%0.421CS..Hα-helixtrans-67.6-35.2179.7-178.80000111.1G95 F97 N101 I102 L105 R109 F112G95-V99 WeakPolarHBondContact O-CG2 3.32Å; G95-V99 PolarHBondContact O-N 3.24Å; F97-V99 PolarHBondContact O-N 2.93Å; V99-N101 PolarHBondContact O-N 2.98Å; V99-I102 PolarHBondContact O-N 3.43Å; V99-I102 VanDerWaalsContact O-N 3.13Å; V99-L105 HydrophobicContact CG1-CB 4.24Å; V99-L105 HydrophobicContact CG1-CD1 4.4Å; V99-R109 HydrophobicContact CB-CG 4.38Å; V99-R109 HydrophobicContact CG1-CB 4.29Å; V99-R109 HydrophobicContact CG1-CG 3.87Å; V99-F112 HydrophobicContact CG1-CB 3.91Å; V99-F112 HydrophobicContact CG2-CB 4.13Å
100S81.2Confident82.6Confident52 Ų5290.4 Ų90.436%0.36443%0.428SS..Hα-helixtrans-67.3-21.3177.2-164.80000113.6Y96 F97 I98 I102 R109Y96-S100 VanDerWaalsContact O-CB 3.23Å; Y96-S100 WeakPolarHBondContact O-CB 3.3Å; Y96-S100 PolarHBondContact O-N 3.41Å; F97-S100 PolarHBondContact O-N 3.44Å; I98-S100 VanDerWaalsContact C-N 3.32Å; I98-S100 PolarHBondContact O-N 2.86Å; S100-I102 VanDerWaalsContact C-N 3.32Å; S100-R109 PolarHBondContact OG-NH1 3.39Å; S100-R109 VanDerWaalsContact OG-NH1 3.15Å
101N82.1Confident82.5Confident125 Ų12593.2 Ų93.267%0.66844%0.441SS*.Hα-helixtrans-72.7-29.5174.2-162.2-56.5000111.3F97 I98 V99 R103F97-N101 PolarHBondContact O-N 3.02Å; F97-N101 VanDerWaalsContact O-N 3.09Å; I98-N101 WeakPolarHBondContact O-CB 3.42Å; I98-N101 PolarHBondContact O-N 3.43Å; V99-N101 PolarHBondContact O-N 2.98Å; N101-R103 PolarHBondContact O-N 2.93Å
102I82.3Confident82.3Confident82 Ų8295.9 Ų95.942%0.42145%0.452SS..  trans-83.2106.1-177.3-55.9171.4000109.9V99 S100 L104 L105V99-I102 PolarHBondContact O-N 3.43Å; V99-I102 VanDerWaalsContact O-N 3.13Å; S100-I102 VanDerWaalsContact C-N 3.32Å; I102-L104 HydrophobicContact CG2-CB 4.03Å; I102-L104 PolarHBondContact O-N 3.3Å; I102-L104 VanDerWaalsContact O-N 3.1Å; I102-L105 HydrophobicContact CG2-CD1 4.49Å; I102-L105 HydrophobicContact CG2-CG 4.34Å; I102-L105 PolarHBondContact O-N 2.93Å
103R74.3Confident82.2Confident236 Ų23692.6 Ų92.689%0.89144%0.437SS*.G310 helixtrans-57.4-26.7179.8-66.6-176.2-173.4-1721.6113.9N101 L105N101-R103 PolarHBondContact O-N 2.93Å; R103-L105 VanDerWaalsContact C-N 3.34Å; R103-L105 PolarHBondContact O-N 2.83Å
104L69.1Low82.3Confident159 Ų15991.7 Ų91.783%0.83244%0.441SS*.G310 helixtrans-70.3-25.2-173.9-148.983.9000114I102I102-L104 HydrophobicContact CG2-CB 4.03Å; I102-L104 PolarHBondContact O-N 3.3Å; I102-L104 VanDerWaalsContact O-N 3.1Å
105L68.9Low82.4Confident44 Ų4492 Ų9223%0.2344%0.443CS..G310 helixtrans-107.117.7-169.2-63.2179.5000113.7V99 I102 R103 K107 Q108 R109 F112V99-L105 HydrophobicContact CG1-CB 4.24Å; V99-L105 HydrophobicContact CG1-CD1 4.4Å; I102-L105 HydrophobicContact CG2-CD1 4.49Å; I102-L105 HydrophobicContact CG2-CG 4.34Å; I102-L105 PolarHBondContact O-N 2.93Å; R103-L105 VanDerWaalsContact C-N 3.34Å; R103-L105 PolarHBondContact O-N 2.83Å; L105-K107 VanDerWaalsContact C-N 3.25Å; L105-K107 PolarHBondContact O-N 3.29Å; L105-K107 VanDerWaalsContact O-N 3.13Å; L105-Q108 CarbonylContact O-C 3.48Å; L105-Q108 PolarHBondContact O-N 3.45Å; L105-Q108 VanDerWaalsContact O-N 3.1Å; L105-R109 WeakPolarHBondContact O-CA 3.38Å; L105-R109 PolarHBondContact O-N 3.02Å; L105-F112 HydrophobicContact CB-CD2 4.33Å; L105-F112 HydrophobicContact CD1-CB 4.39Å; L105-F112 HydrophobicContact CD1-CD1 4.07Å; L105-F112 HydrophobicContact CD1-CD2 4.01Å; L105-F112 HydrophobicContact CD1-CE1 4.35Å; L105-F112 HydrophobicContact CD1-CE2 4.31Å; L105-F112 HydrophobicContact CD1-CG 3.89Å; L105-F112 HydrophobicContact CD1-CZ 4.46Å; L105-F112 HydrophobicContact CD2-CD2 3.99Å; L105-F112 HydrophobicContact CD2-CE1 4.47Å; L105-F112 HydrophobicContact CD2-CE2 3.57Å; L105-F112 HydrophobicContact CD2-CZ 3.84Å; L105-F112 HydrophobicContact CG-CD2 4.33Å; L105-F112 HydrophobicContact CG-CE2 4.39Å
106H72.3Confident82.5Confident138 Ų13895.4 Ų95.464%0.63946%0.46SS*.G310 helixtrans-57.9-34.1-171.3-162.1-81.5000113.7
107K75.6Confident82.7Confident213 Ų21395.3 Ų95.393%0.92646%0.46SS*.G310 helixtrans-77.2-23-178.3-135.9178.7-174.7-175.90113.9L105L105-K107 VanDerWaalsContact C-N 3.25Å; L105-K107 PolarHBondContact O-N 3.29Å; L105-K107 VanDerWaalsContact O-N 3.13Å
108Q82.3Confident83Confident111 Ų11194.7 Ų94.752%0.51946%0.461SS..G310 helixtrans-122.721.2-179-69.3-174.7-13.700112.6L105 L110 L111 F112L105-Q108 CarbonylContact O-C 3.48Å; L105-Q108 PolarHBondContact O-N 3.45Å; L105-Q108 VanDerWaalsContact O-N 3.1Å; Q108-L110 VanDerWaalsContact C-N 3.26Å; Q108-L110 PolarHBondContact O-N 2.91Å; Q108-L110 VanDerWaalsContact O-N 3.14Å; Q108-L111 HydrophobicContact CB-CB 4.43Å; Q108-L111 WeakPolarHBondContact O-CB 3.34Å; Q108-L111 PolarHBondContact O-N 3.29Å; Q108-F112 HydrophobicContact CB-CD2 3.83Å; Q108-F112 HydrophobicContact CB-CE2 3.83Å; Q108-F112 WeakPolarHBondContact O-CD2 3.33Å; Q108-F112 PolarHBondContact O-N 2.93Å; Q108-F112 VanDerWaalsContact O-N 3.13Å
109R81.3Confident83.3Confident63 Ų6394.6 Ų94.624%0.23846%0.464CS..Hα-helixtrans-50.9-43.3-173.7178.5173.666.3-167.9-4.8113.3Y96 V99 S100 L105 S113Y96-R109 HydrophobicContact CD2-CG 4.39Å; Y96-R109 HydrophobicContact CE2-CG 4.15Å; Y96-R109 PolarHBondContact OH-NE 3.24Å; Y96-R109 PolarHBondContact OH-NH2 2.96Å; V99-R109 HydrophobicContact CB-CG 4.38Å; V99-R109 HydrophobicContact CG1-CB 4.29Å; V99-R109 HydrophobicContact CG1-CG 3.87Å; S100-R109 PolarHBondContact OG-NH1 3.39Å; S100-R109 VanDerWaalsContact OG-NH1 3.15Å; L105-R109 WeakPolarHBondContact O-CA 3.38Å; L105-R109 PolarHBondContact O-N 3.02Å; R109-S113 VanDerWaalsContact O-CB 3.28Å; R109-S113 WeakPolarHBondContact O-CB 3.23Å; R109-S113 PolarHBondContact O-N 2.87Å
110L83.1Confident83.5Confident118 Ų11898.2 Ų98.262%0.61848%0.48SS*.Hα-helixtrans-67.8-38.2-179.9-66.8176.5000112.5Y96 Q108 S113 C114Y96-L110 HydrophobicContact CD2-CD2 4.17Å; Y96-L110 HydrophobicContact CE2-CD2 3.91Å; Q108-L110 VanDerWaalsContact C-N 3.26Å; Q108-L110 PolarHBondContact O-N 2.91Å; Q108-L110 VanDerWaalsContact O-N 3.14Å; L110-S113 PolarHBondContact O-N 3.37Å; L110-C114 VanDerWaalsContact O-CB 3.31Å; L110-C114 WeakPolarHBondContact O-CB 3.44Å; L110-C114 PolarHBondContact O-N 3.29Å
111L87.1Confident83.8Confident112 Ų11297.2 Ų97.259%0.58647%0.469SS*.Hα-helixtrans-65.6-48.5179.2-16899.6000110.9Q108 S113 C114 L115Q108-L111 HydrophobicContact CB-CB 4.43Å; Q108-L111 WeakPolarHBondContact O-CB 3.34Å; Q108-L111 PolarHBondContact O-N 3.29Å; L111-S113 PolarHBondContact O-N 3Å; L111-C114 WeakPolarHBondContact O-CB 3.39Å; L111-C114 PolarHBondContact O-N 2.98Å; L111-L115 PolarHBondContact O-N 3.47Å
112F87.9Confident84.2Confident70 Ų7099 Ų9931%0.30747%0.468SS..Hα-helixtrans-65.3-38177.4-78.4-80.1000112.3V99 L105 Q108 C114 L115 L116V99-F112 HydrophobicContact CG1-CB 3.91Å; V99-F112 HydrophobicContact CG2-CB 4.13Å; L105-F112 HydrophobicContact CB-CD2 4.33Å; L105-F112 HydrophobicContact CD1-CB 4.39Å; L105-F112 HydrophobicContact CD1-CD1 4.07Å; L105-F112 HydrophobicContact CD1-CD2 4.01Å; L105-F112 HydrophobicContact CD1-CE1 4.35Å; L105-F112 HydrophobicContact CD1-CE2 4.31Å; L105-F112 HydrophobicContact CD1-CG 3.89Å; L105-F112 HydrophobicContact CD1-CZ 4.46Å; L105-F112 HydrophobicContact CD2-CD2 3.99Å; L105-F112 HydrophobicContact CD2-CE1 4.47Å; L105-F112 HydrophobicContact CD2-CE2 3.57Å; L105-F112 HydrophobicContact CD2-CZ 3.84Å; L105-F112 HydrophobicContact CG-CD2 4.33Å; L105-F112 HydrophobicContact CG-CE2 4.39Å; Q108-F112 HydrophobicContact CB-CD2 3.83Å; Q108-F112 HydrophobicContact CB-CE2 3.83Å; Q108-F112 WeakPolarHBondContact O-CD2 3.33Å; Q108-F112 PolarHBondContact O-N 2.93Å; Q108-F112 VanDerWaalsContact O-N 3.13Å; F112-C114 VanDerWaalsContact C-N 3.33Å; F112-C114 PolarHBondContact O-N 3.12Å; F112-L115 PolarHBondContact O-N 3Å; F112-L116 WeakPolarHBondContact O-CB 3.49Å; F112-L116 PolarHBondContact O-N 3.34Å
113S88.2Confident84.4Confident0 Ų0101.1 Ų101.10%047%0.474CS..Hα-helixtrans-62.5-40.6173.3-173.80000111.8Y96 R109 L110 L111 W117Y96-S113 WeakPolarHBondContact CA-OG 3.49Å; Y96-S113 WeakPolarHBondContact CB-OG 3.43Å; Y96-S113 PolarHBondContact N-OG 2.91Å; Y96-S113 VanDerWaalsContact N-OG 3.08Å; R109-S113 VanDerWaalsContact O-CB 3.28Å; R109-S113 WeakPolarHBondContact O-CB 3.23Å; R109-S113 PolarHBondContact O-N 2.87Å; L110-S113 PolarHBondContact O-N 3.37Å; L111-S113 PolarHBondContact O-N 3Å; S113-W117 VanDerWaalsContact O-CB 3.27Å; S113-W117 WeakPolarHBondContact O-CB 3.32Å; S113-W117 PolarHBondContact O-N 3.16Å
114C89.8Confident85Confident54 Ų5491 Ų9137%0.36544%0.437SS..Hα-helixtrans-66.7-41.5176.3-173.90000111.5L110 L111 F112 W117 L118L110-C114 VanDerWaalsContact O-CB 3.31Å; L110-C114 WeakPolarHBondContact O-CB 3.44Å; L110-C114 PolarHBondContact O-N 3.29Å; L111-C114 WeakPolarHBondContact O-CB 3.39Å; L111-C114 PolarHBondContact O-N 2.98Å; F112-C114 VanDerWaalsContact C-N 3.33Å; F112-C114 PolarHBondContact O-N 3.12Å; C114-W117 PolarHBondContact O-N 3.03Å; C114-L118 WeakPolarHBondContact O-CB 3.42Å; C114-L118 WeakPolarHBondContact O-CG 3.48Å; C114-L118 PolarHBondContact O-N 2.85Å
115L91.4Very high85.6Confident101 Ų10188.7 Ų88.753%0.52942%0.417SS..Hα-helixtrans-65-42.3177.3-170.9146.4000112L111 F112 W117 L118 T119L111-L115 PolarHBondContact O-N 3.47Å; F112-L115 PolarHBondContact O-N 3Å; L115-W117 VanDerWaalsContact C-N 3.34Å; L115-L118 PolarHBondContact O-N 3.49Å; L115-T119 WeakPolarHBondContact O-CB 3.41Å; L115-T119 PolarHBondContact O-N 2.95Å; L115-T119 PolarHBondContact O-OG1 3.05Å
116L90.4Very high86.3Confident71 Ų7192.2 Ų92.237%0.37243%0.431SS..Hα-helixtrans-64.6-40.6175.2-169.6122.7000111.3F112 T119 F120F112-L116 WeakPolarHBondContact O-CB 3.49Å; F112-L116 PolarHBondContact O-N 3.34Å; L116-T119 PolarHBondContact O-N 3.03Å; L116-F120 WeakPolarHBondContact O-CB 3.42Å; L116-F120 PolarHBondContact O-N 3.46Å
117W92.6Very high86.5Confident51 Ų5189.3 Ų89.319%0.19342%0.42CS..Hα-helixtrans-63.7-43.6174.1176.979000112.7F88 F92 S113 C114 L115 T119 F120 M121F88-W117 HydrophobicContact CD1-CH2 4.27Å; F88-W117 AromaticContact CD1-CZ2 3.56Å; F88-W117 HydrophobicContact CD1-CZ2 3.56Å; F88-W117 HydrophobicContact CE1-CH2 4.46Å; F88-W117 HydrophobicContact CE1-CZ2 4.04Å; F88-W117 PolarHBondContact O-NE1 2.98Å; F92-W117 HydrophobicContact CB-CG 4.26Å; F92-W117 HydrophobicContact CD2-CB 4.21Å; F92-W117 HydrophobicContact CD2-CG 4.09Å; S113-W117 VanDerWaalsContact O-CB 3.27Å; S113-W117 WeakPolarHBondContact O-CB 3.32Å; S113-W117 PolarHBondContact O-N 3.16Å; C114-W117 PolarHBondContact O-N 3.03Å; L115-W117 VanDerWaalsContact C-N 3.34Å; W117-T119 VanDerWaalsContact C-N 3.34Å; W117-T119 PolarHBondContact O-N 2.82Å; W117-F120 WeakPolarHBondContact O-CB 3.44Å; W117-F120 PolarHBondContact O-N 3.16Å; W117-M121 HydrophobicContact CD2-CG 4.3Å; W117-M121 HydrophobicContact CH2-CG 3.89Å; W117-M121 HydrophobicContact CZ2-CE 4.32Å; W117-M121 HydrophobicContact CZ2-CG 3.51Å; W117-M121 HydrophobicContact CZ2-SD 4.07Å; W117-M121 HydrophobicContact CZ3-CG 4.41Å; W117-M121 PolarHBondContact O-N 2.88Å
118L91.1Very high86.2Confident97 Ų9779.5 Ų79.551%0.50838%0.378SS..Hα-helixtrans-63.4-40.2175.1-76.1172.3000111.9C114 L115 F120 M121 Y122C114-L118 WeakPolarHBondContact O-CB 3.42Å; C114-L118 WeakPolarHBondContact O-CG 3.48Å; C114-L118 PolarHBondContact O-N 2.85Å; L115-L118 PolarHBondContact O-N 3.49Å; L118-F120 VanDerWaalsContact C-N 3.33Å; L118-M121 WeakPolarHBondContact O-CB 3.47Å; L118-M121 PolarHBondContact O-N 3.38Å; L118-Y122 PolarHBondContact O-N 3.11Å
119T91.6Very high85.8Confident81 Ų8177.6 Ų77.650%0.49737%0.372SS..Hα-helixtrans-62-43.5174.9-570000110.9L115 L116 W117 Y122 F123L115-T119 WeakPolarHBondContact O-CB 3.41Å; L115-T119 PolarHBondContact O-N 2.95Å; L115-T119 PolarHBondContact O-OG1 3.05Å; L116-T119 PolarHBondContact O-N 3.03Å; W117-T119 VanDerWaalsContact C-N 3.34Å; W117-T119 PolarHBondContact O-N 2.82Å; T119-Y122 PolarHBondContact O-N 3.34Å; T119-F123 PolarHBondContact O-N 3.48Å
120F90.6Very high85.2Confident85 Ų8578.8 Ų78.837%0.37339%0.388SS..Hα-helixtrans-61.5-45.9174.2172.4-93.9000111.8P91 L116 W117 L118 Y122 F123 F124P91-F120 HydrophobicContact CB-CD1 3.55Å; P91-F120 HydrophobicContact CB-CE1 3.54Å; P91-F120 HydrophobicContact CB-CG 4.1Å; P91-F120 HydrophobicContact CB-CZ 4.05Å; P91-F120 HydrophobicContact CG-CD1 3.84Å; P91-F120 HydrophobicContact CG-CE1 3.52Å; P91-F120 HydrophobicContact CG-CZ 4.27Å; L116-F120 WeakPolarHBondContact O-CB 3.42Å; L116-F120 PolarHBondContact O-N 3.46Å; W117-F120 WeakPolarHBondContact O-CB 3.44Å; W117-F120 PolarHBondContact O-N 3.16Å; L118-F120 VanDerWaalsContact C-N 3.33Å; F120-Y122 VanDerWaalsContact C-N 3.32Å; F120-Y122 PolarHBondContact O-N 3.33Å; F120-F123 PolarHBondContact O-N 2.8Å; F120-F124 HydrophobicContact CE1-CB 4.42Å; F120-F124 VanDerWaalsContact O-CB 3.24Å; F120-F124 WeakPolarHBondContact O-CB 3.01Å; F120-F124 PolarHBondContact O-N 3.15Å
121M88.1Confident84.1Confident30 Ų3078.3 Ų78.315%0.14838%0.381CS..Hα-helixtrans-57.7-43.6175.2-82-65.6116.900112.2V87 F88 W117 L118 F124 W125V87-M121 HydrophobicContact CG1-CE 3.62Å; V87-M121 HydrophobicContact CG1-SD 4.31Å; V87-M121 WeakPolarHBondContact O-CE 3.31Å; F88-M121 HydrophobicContact CE1-SD 4.21Å; W117-M121 HydrophobicContact CD2-CG 4.3Å; W117-M121 HydrophobicContact CH2-CG 3.89Å; W117-M121 HydrophobicContact CZ2-CE 4.32Å; W117-M121 HydrophobicContact CZ2-CG 3.51Å; W117-M121 HydrophobicContact CZ2-SD 4.07Å; W117-M121 HydrophobicContact CZ3-CG 4.41Å; W117-M121 PolarHBondContact O-N 2.88Å; L118-M121 WeakPolarHBondContact O-CB 3.47Å; L118-M121 PolarHBondContact O-N 3.38Å; M121-F124 PolarHBondContact O-N 3.4Å; M121-W125 WeakPolarHBondContact O-CB 3.44Å; M121-W125 PolarHBondContact O-N 3.01Å
122Y89.7Confident82.8Confident164 Ų16478.9 Ų78.964%0.64339%0.391SS*.Hα-helixtrans-61.6-46.9176.5173.1-100000111.8L118 T119 F120 W125 K126L118-Y122 PolarHBondContact O-N 3.11Å; T119-Y122 PolarHBondContact O-N 3.34Å; F120-Y122 VanDerWaalsContact C-N 3.32Å; F120-Y122 PolarHBondContact O-N 3.33Å; Y122-W125 WeakPolarHBondContact O-CB 3.43Å; Y122-W125 PolarHBondContact O-N 3.35Å; Y122-K126 WeakPolarHBondContact O-CB 3.33Å; Y122-K126 PolarHBondContact O-N 3.2Å
123F87.9Confident81.2Confident125 Ų12580.2 Ų80.255%0.54840%0.401SS..Hα-helixtrans-65.7-43178.5-170.1-107.9000112.1T119 F120 W125 K126 L127T119-F123 PolarHBondContact O-N 3.48Å; F120-F123 PolarHBondContact O-N 2.8Å; F123-W125 VanDerWaalsContact C-N 3.26Å; F123-W125 PolarHBondContact O-N 3.14Å; F123-K126 PolarHBondContact O-N 3.41Å; F123-K126 VanDerWaalsContact O-N 3.13Å; F123-L127 HydrophobicContact CD1-CD1 3.59Å; F123-L127 HydrophobicContact CD1-CG 4Å; F123-L127 HydrophobicContact CE1-CD1 3.26Å; F123-L127 HydrophobicContact CE1-CD2 4.13Å; F123-L127 HydrophobicContact CE1-CG 3.73Å; F123-L127 HydrophobicContact CE2-CG 4.47Å; F123-L127 HydrophobicContact CZ-CD1 3.96Å; F123-L127 HydrophobicContact CZ-CD2 3.93Å; F123-L127 HydrophobicContact CZ-CG 3.96Å; F123-L127 WeakPolarHBondContact O-CB 3.32Å; F123-L127 WeakPolarHBondContact O-CG 3.26Å; F123-L127 PolarHBondContact O-N 3.17Å
124F85.9Confident79.5Confident23 Ų2387.2 Ų87.210%0.10144%0.437CS..Hα-helixtrans-57.9-40.3174.5176.9-92.4000111.5V87 F120 M121 G128 L146 R149 V150 I153V87-F124 HydrophobicContact CG1-CE1 4.26Å; V87-F124 HydrophobicContact CG1-CZ 4.49Å; V87-F124 HydrophobicContact CG2-CZ 4.32Å; F120-F124 HydrophobicContact CE1-CB 4.42Å; F120-F124 VanDerWaalsContact O-CB 3.24Å; F120-F124 WeakPolarHBondContact O-CB 3.01Å; F120-F124 PolarHBondContact O-N 3.15Å; M121-F124 PolarHBondContact O-N 3.4Å; F124-G128 PolarHBondContact O-N 2.94Å; F124-L146 HydrophobicContact CE1-CD1 3.39Å; F124-L146 HydrophobicContact CZ-CD1 3.69Å; F124-R149 HydrophobicContact CZ-CB 4.11Å; F124-V150 HydrophobicContact CE2-CG2 4.02Å; F124-V150 HydrophobicContact CZ-CG2 3.67Å; F124-I153 HydrophobicContact CD2-CD1 3.8Å; F124-I153 HydrophobicContact CE2-CD1 3.6Å
125W82Confident77.4Confident112 Ų11287.5 Ų87.542%0.42444%0.44SS..Hα-helixtrans-65.5-46.5174.3-161.2-61.9000111.8M121 Y122 F123 L127 G128 D129 I140 L141 R149M121-W125 WeakPolarHBondContact O-CB 3.44Å; M121-W125 PolarHBondContact O-N 3.01Å; Y122-W125 WeakPolarHBondContact O-CB 3.43Å; Y122-W125 PolarHBondContact O-N 3.35Å; F123-W125 VanDerWaalsContact C-N 3.26Å; F123-W125 PolarHBondContact O-N 3.14Å; W125-L127 VanDerWaalsContact C-N 3.34Å; W125-L127 PolarHBondContact O-N 3.41Å; W125-G128 PolarHBondContact O-N 2.96Å; W125-G128 VanDerWaalsContact O-N 3.07Å; W125-D129 PolarHBondContact O-N 2.85Å; W125-I140 HydrophobicContact CH2-CG2 3.27Å; W125-I140 HydrophobicContact CZ2-CG2 3.15Å; W125-L141 HydrophobicContact CH2-CD2 4.25Å; W125-L141 HydrophobicContact CZ3-CD2 4.08Å; W125-R149 PolarHBondContact O-NH1 3.32Å
126K82.8Confident75.6Confident118 Ų11889.2 Ų89.251%0.51346%0.457SS..Hα-helixtrans-66.4-35.2-176.4-162.868.9-170.6159.60113Y122 F123 G128 D129 P130Y122-K126 WeakPolarHBondContact O-CB 3.33Å; Y122-K126 PolarHBondContact O-N 3.2Å; F123-K126 PolarHBondContact O-N 3.41Å; F123-K126 VanDerWaalsContact O-N 3.13Å; K126-G128 PolarHBondContact O-N 3.31Å; K126-D129 IonicContact NZ-OD2 3.38Å; K126-D129 PolarHBondContact NZ-OD2 2.79Å; K126-D129 PolarHBondContact O-N 2.9Å; K126-P130 WeakPolarHBondContact O-CD 3.27Å
127L76.8Confident74Confident77 Ų7794.7 Ų94.740%0.40348%0.478SS..Hα-helixtrans-66.2-24.1173.3-76.3-179.4000113.3F123 W125 P130F123-L127 HydrophobicContact CD1-CD1 3.59Å; F123-L127 HydrophobicContact CD1-CG 4Å; F123-L127 HydrophobicContact CE1-CD1 3.26Å; F123-L127 HydrophobicContact CE1-CD2 4.13Å; F123-L127 HydrophobicContact CE1-CG 3.73Å; F123-L127 HydrophobicContact CE2-CG 4.47Å; F123-L127 HydrophobicContact CZ-CD1 3.96Å; F123-L127 HydrophobicContact CZ-CD2 3.93Å; F123-L127 HydrophobicContact CZ-CG 3.96Å; F123-L127 WeakPolarHBondContact O-CB 3.32Å; F123-L127 WeakPolarHBondContact O-CG 3.26Å; F123-L127 PolarHBondContact O-N 3.17Å; W125-L127 VanDerWaalsContact C-N 3.34Å; W125-L127 PolarHBondContact O-N 3.41Å; L127-P130 WeakPolarHBondContact O-CD 3.37Å
128G70.6Confident72.1Confident6 Ų697.4 Ų97.46%0.06249%0.493CS..Hα-helixtrans-86.6-18.6179.100000114.9F124 W125 K126 F131F124-G128 PolarHBondContact O-N 2.94Å; W125-G128 PolarHBondContact O-N 2.96Å; W125-G128 VanDerWaalsContact O-N 3.07Å; K126-G128 PolarHBondContact O-N 3.31Å; G128-F131 PolarHBondContact O-N 2.95Å
129D72.2Confident70.5Confident71 Ų7195.4 Ų95.438%0.3850%0.495SS..THydrogen-bonded Turntrans-60.6-38179.1-68.4-14.8000115.3W125 K126 F131 R149W125-D129 PolarHBondContact O-N 2.85Å; K126-D129 IonicContact NZ-OD2 3.38Å; K126-D129 PolarHBondContact NZ-OD2 2.79Å; K126-D129 PolarHBondContact O-N 2.9Å; D129-F131 PolarHBondContact O-N 3.48Å; D129-F131 VanDerWaalsContact O-N 3.15Å; D129-R149 IonicContact OD1-NH2 3.68Å
130P69Low68.9Low88 Ų8897.9 Ų97.957%0.57150%0.504SS*.THydrogen-bonded Turntrans-70.4-3.9-179.724.2-32.1000114.8K126 L127 P132K126-P130 WeakPolarHBondContact O-CD 3.27Å; L127-P130 WeakPolarHBondContact O-CD 3.37Å; P130-P132 VanDerWaalsContact O-CD 3.23Å; P130-P132 WeakPolarHBondContact O-CD 3.42Å
131F61.2Low67.5Low108 Ų108100.7 Ų100.747%0.47452%0.522SS..  trans-114.987.2-178.3-61.7-72.8000112G128 D129 I133 V152G128-F131 PolarHBondContact O-N 2.95Å; D129-F131 PolarHBondContact O-N 3.48Å; D129-F131 VanDerWaalsContact O-N 3.15Å; F131-I133 HydrophobicContact CB-CD1 4.49Å; F131-I133 HydrophobicContact CB-CG1 4.46Å; F131-I133 PolarHBondContact O-N 2.83Å; F131-I133 VanDerWaalsContact O-N 3.07Å; F131-V152 HydrophobicContact CD2-CG1 4.02Å; F131-V152 HydrophobicContact CE1-CG1 4.29Å; F131-V152 HydrophobicContact CE2-CG1 3.75Å; F131-V152 HydrophobicContact CG-CG1 4.41Å; F131-V152 HydrophobicContact CZ-CG1 3.89Å
132P58.9Low66.7Low124 Ų124100.5 Ų100.581%0.80552%0.524SS*.  trans-81.484.1177.132.8-33.7000110.5P130P130-P132 VanDerWaalsContact O-CD 3.23Å; P130-P132 WeakPolarHBondContact O-CD 3.42Å
133I54.4Low66.1Low99 Ų9995.8 Ų95.851%0.50851%0.509SS..  trans-113.383.1177.2-38174.8000108.7F131F131-I133 HydrophobicContact CB-CD1 4.49Å; F131-I133 HydrophobicContact CB-CG1 4.46Å; F131-I133 PolarHBondContact O-N 2.83Å; F131-I133 VanDerWaalsContact O-N 3.07Å
134L51.7Low65.6Low147 Ų14796.1 Ų96.177%0.7751%0.512SS*.SBendtrans93.3120164-75.9123.2000122.4
135S45.4Very low65.3Low59 Ų5997.2 Ų97.241%0.41352%0.517SS..  trans64.3110.5152-152.40000119.6K137S135-K137 PolarHBondContact O-N 3.35Å
136P55.4Low65.3Low138 Ų13893.5 Ų93.590%0.89651%0.506SS*.THydrogen-bonded Turntrans-7012.8177.430-34.4000114.4
137K55.7Low65.4Low185 Ų18590.9 Ų90.980%0.80450%0.497SS*.THydrogen-bonded Turntrans-104.6-10.6-175.9-68.5-170175.9-175.20114.6S135S135-K137 PolarHBondContact O-N 3.35Å
138H52.1Low65.7Low109 Ų10989 Ų8951%0.50549%0.49SS..SBendtrans-106.9133.7175.6-71.793.5000110.3
139G57.8Low66.5Low54 Ų5491 Ų9156%0.55750%0.495SS*.  trans-58.3166.7-170.900000114.4L141 S142 Q145G139-L141 PolarHBondContact O-N 3.01Å; G139-S142 PolarHBondContact O-N 3.27Å; G139-Q145 PolarHBondContact O-OE1 3.47Å
140I58.4Low67.2Low134 Ų13489 Ų8969%0.68749%0.486SS*.THydrogen-bonded Turntrans-56.3-16.9-172.6-59.4162.3000114.1W125W125-I140 HydrophobicContact CH2-CG2 3.27Å; W125-I140 HydrophobicContact CZ2-CG2 3.15Å
141L61.1Low68.1Low144 Ų14486.5 Ų86.575%0.75448%0.476SS*.THydrogen-bonded Turntrans-120.933.2179-64.8175.8000112.6W125 G139W125-L141 HydrophobicContact CH2-CD2 4.25Å; W125-L141 HydrophobicContact CZ3-CD2 4.08Å; G139-L141 PolarHBondContact O-N 3.01Å
142S72.3Confident69.4Low26 Ų2683.1 Ų83.118%0.18246%0.464CS..  trans-67.7134.8175.1-169.30000111G139 E144 Q145 L146G139-S142 PolarHBondContact O-N 3.27Å; S142-E144 PolarHBondContact O-N 2.83Å; S142-E144 VanDerWaalsContact O-N 3.16Å; S142-Q145 PolarHBondContact O-N 2.97Å; S142-L146 PolarHBondContact O-N 2.92Å; S142-L146 VanDerWaalsContact O-N 3.16Å
143I75.6Confident70.8Confident65 Ų6579.3 Ų79.333%0.33344%0.437SS..Hα-helixtrans-54.8-35.4179-68.7165.3000111.1Q145 L146 I147I143-Q145 PolarHBondContact O-N 3.42Å; I143-L146 PolarHBondContact O-N 3.31Å; I143-I147 WeakPolarHBondContact O-CG2 3.43Å; I143-I147 PolarHBondContact O-N 3.35Å
144E78.6Confident72.5Confident131 Ų13175.9 Ų75.961%0.61243%0.425SS*.Hα-helixtrans-66.4-33.9179.2-64.6-178.1173.500113.3S142 I147 S148S142-E144 PolarHBondContact O-N 2.83Å; S142-E144 VanDerWaalsContact O-N 3.16Å; E144-I147 WeakPolarHBondContact O-CG2 3.41Å; E144-S148 PolarHBondContact O-N 2.88Å; E144-S148 PolarHBondContact O-OG 3.33Å
145Q78.7Confident74.4Confident46 Ų4673.5 Ų73.522%0.21542%0.417CS..Hα-helixtrans-77.3-35.8176.2-69.1173.8-10.200111.1G139 S142 I143 S148 R149G139-Q145 PolarHBondContact O-OE1 3.47Å; S142-Q145 PolarHBondContact O-N 2.97Å; I143-Q145 PolarHBondContact O-N 3.42Å; Q145-S148 PolarHBondContact O-OG 2.89Å; Q145-R149 WeakPolarHBondContact O-CD 3.32Å; Q145-R149 WeakPolarHBondContact O-CG 3.3Å; Q145-R149 PolarHBondContact O-N 3.37Å
146L81.6Confident76.5Confident35 Ų3574 Ų7418%0.18342%0.417CS..Hα-helixtrans-69.1-39.6178-170.748.1000110.9L83 V87 F88 F124 S142 I143 R149 V150L83-L146 HydrophobicContact CD1-CB 4.25Å; L83-L146 HydrophobicContact CD1-CG 3.96Å; L83-L146 HydrophobicContact CD2-CB 3.99Å; L83-L146 HydrophobicContact CD2-CD2 3.23Å; L83-L146 HydrophobicContact CD2-CG 3.51Å; L83-L146 HydrophobicContact CG-CD2 4.03Å; L83-L146 HydrophobicContact CG-CG 3.9Å; V87-L146 HydrophobicContact CG1-CD1 4.23Å; V87-L146 HydrophobicContact CG2-CD1 4.17Å; V87-L146 HydrophobicContact CG2-CG 4.42Å; F88-L146 HydrophobicContact CE2-CD2 4.27Å; F124-L146 HydrophobicContact CE1-CD1 3.39Å; F124-L146 HydrophobicContact CZ-CD1 3.69Å; S142-L146 PolarHBondContact O-N 2.92Å; S142-L146 VanDerWaalsContact O-N 3.16Å; I143-L146 PolarHBondContact O-N 3.31Å; L146-R149 PolarHBondContact O-N 2.83Å; L146-V150 HydrophobicContact CD1-CG2 4.47Å; L146-V150 WeakPolarHBondContact O-CG2 3.29Å; L146-V150 PolarHBondContact O-N 2.91Å
147I85.8Confident78.3Confident63 Ų6371.8 Ų71.832%0.32340%0.398SS..Hα-helixtrans-68.6-36.8176.7-164.2162.9000112.8L79 L83 I143 E144 G151L79-I147 HydrophobicContact CD1-CD1 3.88Å; L79-I147 HydrophobicContact CD2-CD1 3.37Å; L79-I147 HydrophobicContact CG-CD1 4.23Å; L83-I147 HydrophobicContact CD1-CB 3.95Å; L83-I147 HydrophobicContact CD1-CG1 4.41Å; I143-I147 WeakPolarHBondContact O-CG2 3.43Å; I143-I147 PolarHBondContact O-N 3.35Å; E144-I147 WeakPolarHBondContact O-CG2 3.41Å; I147-G151 PolarHBondContact O-N 3.41Å
148S83.5Confident80.1Confident36 Ų3669.7 Ų69.725%0.25239%0.392SS..Hα-helixtrans-65.7-41.4176.965.50000111.5E144 Q145 G151 V152E144-S148 PolarHBondContact O-N 2.88Å; E144-S148 PolarHBondContact O-OG 3.33Å; Q145-S148 PolarHBondContact O-OG 2.89Å; S148-G151 PolarHBondContact O-N 3.37Å; S148-V152 WeakPolarHBondContact O-CG2 3.19Å; S148-V152 PolarHBondContact O-N 2.85Å
149R86.6Confident82.2Confident48 Ų4867.4 Ų67.418%0.18139%0.392CS..Hα-helixtrans-62.2-50.5175.4-69.5170.3-177.9-125.2-2.5112.3F124 W125 D129 Q145 L146 G151 V152 I153F124-R149 HydrophobicContact CZ-CB 4.11Å; W125-R149 PolarHBondContact O-NH1 3.32Å; D129-R149 IonicContact OD1-NH2 3.68Å; Q145-R149 WeakPolarHBondContact O-CD 3.32Å; Q145-R149 WeakPolarHBondContact O-CG 3.3Å; Q145-R149 PolarHBondContact O-N 3.37Å; L146-R149 PolarHBondContact O-N 2.83Å; R149-G151 VanDerWaalsContact C-N 3.27Å; R149-G151 PolarHBondContact O-N 3.48Å; R149-V152 PolarHBondContact O-N 3.11Å; R149-I153 WeakPolarHBondContact O-CG1 3.5Å; R149-I153 PolarHBondContact O-N 3.28Å; R149-I153 VanDerWaalsContact O-N 3.14Å
150V87.9Confident84Confident31 Ų3170.6 Ų70.619%0.18840%0.396CS..Hα-helixtrans-61.2-39.6176.2175.10000110.6L86 V87 F124 L146 I153 G154L86-V150 HydrophobicContact CD2-CG1 3.74Å; L86-V150 HydrophobicContact CD2-CG2 4.39Å; V87-V150 HydrophobicContact CG2-CG2 3.5Å; V87-V150 VanDerWaalsContact CG2-CG2 3.5Å; F124-V150 HydrophobicContact CE2-CG2 4.02Å; F124-V150 HydrophobicContact CZ-CG2 3.67Å; L146-V150 HydrophobicContact CD1-CG2 4.47Å; L146-V150 WeakPolarHBondContact O-CG2 3.29Å; L146-V150 PolarHBondContact O-N 2.91Å; V150-I153 PolarHBondContact O-N 3Å; V150-G154 PolarHBondContact O-N 3.45Å
151G88.3Confident85.7Confident34 Ų3470.1 Ų70.135%0.35139%0.394SS..Hα-helixtrans-60.8-47.9178.200000112.8I147 S148 R149 G154 V155I147-G151 PolarHBondContact O-N 3.41Å; S148-G151 PolarHBondContact O-N 3.37Å; R149-G151 VanDerWaalsContact C-N 3.27Å; R149-G151 PolarHBondContact O-N 3.48Å; G151-G154 PolarHBondContact O-N 3.45Å; G151-V155 WeakPolarHBondContact O-CB 3.18Å; G151-V155 VanDerWaalsContact O-CG2 3.26Å; G151-V155 WeakPolarHBondContact O-CG2 3.31Å; G151-V155 PolarHBondContact O-N 3.21Å
152V86.9Confident87.3Confident37 Ų3767.3 Ų67.322%0.22439%0.386CS..Hα-helixtrans-63.4-45.6178.1174.10000111.3F131 S148 R149 G154 V155 T156F131-V152 HydrophobicContact CD2-CG1 4.02Å; F131-V152 HydrophobicContact CE1-CG1 4.29Å; F131-V152 HydrophobicContact CE2-CG1 3.75Å; F131-V152 HydrophobicContact CG-CG1 4.41Å; F131-V152 HydrophobicContact CZ-CG1 3.89Å; S148-V152 WeakPolarHBondContact O-CG2 3.19Å; S148-V152 PolarHBondContact O-N 2.85Å; R149-V152 PolarHBondContact O-N 3.11Å; V152-G154 VanDerWaalsContact C-N 3.33Å; V152-G154 PolarHBondContact O-N 2.89Å; V152-V155 PolarHBondContact O-N 3.22Å; V152-T156 HydrophobicContact CG1-CG2 4.44Å; V152-T156 WeakPolarHBondContact O-CB 3.41Å; V152-T156 VanDerWaalsContact O-CG2 3.29Å; V152-T156 WeakPolarHBondContact O-CG2 3.23Å; V152-T156 PolarHBondContact O-N 3.38Å; V152-T156 PolarHBondContact O-OG1 3.46Å
153I88.4Confident88.4Confident45 Ų4567.8 Ų67.823%0.23140%0.395CS..Hα-helixtrans-62.7-42.9176.9-63.7165.6000110.4F124 R149 V150 T156 L157F124-I153 HydrophobicContact CD2-CD1 3.8Å; F124-I153 HydrophobicContact CE2-CD1 3.6Å; R149-I153 WeakPolarHBondContact O-CG1 3.5Å; R149-I153 PolarHBondContact O-N 3.28Å; R149-I153 VanDerWaalsContact O-N 3.14Å; V150-I153 PolarHBondContact O-N 3Å; I153-T156 WeakPolarHBondContact CA-OG1 3.35Å; I153-T156 PolarHBondContact O-OG1 2.86Å; I153-L157 HydrophobicContact CG2-CD1 3.94Å; I153-L157 HydrophobicContact CG2-CG 4.48Å; I153-L157 WeakPolarHBondContact O-CB 3.27Å; I153-L157 VanDerWaalsContact O-CG 3.22Å; I153-L157 WeakPolarHBondContact O-CG 3.36Å; I153-L157 PolarHBondContact O-N 2.98Å
154G90Very high89.2Confident26 Ų2671.6 Ų71.627%0.26841%0.41SS..Hα-helixtrans-63.3-48.3178.100000112.7V150 G151 V152 L157 M158V150-G154 PolarHBondContact O-N 3.45Å; G151-G154 PolarHBondContact O-N 3.45Å; V152-G154 VanDerWaalsContact C-N 3.33Å; V152-G154 PolarHBondContact O-N 2.89Å; G154-L157 PolarHBondContact O-N 2.91Å; G154-M158 WeakPolarHBondContact O-CB 3.43Å; G154-M158 VanDerWaalsContact O-CG 3.27Å; G154-M158 WeakPolarHBondContact O-CG 3.36Å; G154-M158 PolarHBondContact O-N 3.33Å
155V91.8Very high89.8Confident98 Ų9867 Ų6759%0.59440%0.398SS*.Hα-helixtrans-65.9-41.4180172.20000111.3G151 V152 M158 A159G151-V155 WeakPolarHBondContact O-CB 3.18Å; G151-V155 VanDerWaalsContact O-CG2 3.26Å; G151-V155 WeakPolarHBondContact O-CG2 3.31Å; G151-V155 PolarHBondContact O-N 3.21Å; V152-V155 PolarHBondContact O-N 3.22Å; V155-M158 PolarHBondContact O-N 2.9Å; V155-A159 VanDerWaalsContact O-CB 3.32Å; V155-A159 WeakPolarHBondContact O-CB 3.44Å; V155-A159 PolarHBondContact O-N 3.14Å
156T91.1Very high90.4Very high69 Ų6968 Ų6842%0.42341%0.414SS..Hα-helixtrans-62.9-43.6175.749.40000111.5V152 I153 A159 L160V152-T156 HydrophobicContact CG1-CG2 4.44Å; V152-T156 WeakPolarHBondContact O-CB 3.41Å; V152-T156 VanDerWaalsContact O-CG2 3.29Å; V152-T156 WeakPolarHBondContact O-CG2 3.23Å; V152-T156 PolarHBondContact O-N 3.38Å; V152-T156 PolarHBondContact O-OG1 3.46Å; I153-T156 WeakPolarHBondContact CA-OG1 3.35Å; I153-T156 PolarHBondContact O-OG1 2.86Å; T156-A159 PolarHBondContact O-N 3.07Å; T156-L160 VanDerWaalsContact O-CG 3.3Å; T156-L160 WeakPolarHBondContact O-CG 3.26Å; T156-L160 PolarHBondContact O-N 2.9Å
157L92.6Very high90.9Very high92 Ų9271.2 Ų71.248%0.48244%0.435SS..Hα-helixtrans-63.6-43.8174.1-70.4173.5000111.9I153 G154 A159 L160 L161I153-L157 HydrophobicContact CG2-CD1 3.94Å; I153-L157 HydrophobicContact CG2-CG 4.48Å; I153-L157 WeakPolarHBondContact O-CB 3.27Å; I153-L157 VanDerWaalsContact O-CG 3.22Å; I153-L157 WeakPolarHBondContact O-CG 3.36Å; I153-L157 PolarHBondContact O-N 2.98Å; G154-L157 PolarHBondContact O-N 2.91Å; L157-A159 VanDerWaalsContact C-N 3.32Å; L157-A159 PolarHBondContact O-N 3.45Å; L157-L160 PolarHBondContact O-N 2.89Å; L157-L161 WeakPolarHBondContact O-CD1 3.28Å; L157-L161 PolarHBondContact O-N 3.08Å
158M93Very high91Very high141 Ų14171.3 Ų71.370%0.69544%0.436SS*.Hα-helixtrans-60.3-41.3175.6-74.4178.8-17700111.8G154 V155 S162G154-M158 WeakPolarHBondContact O-CB 3.43Å; G154-M158 VanDerWaalsContact O-CG 3.27Å; G154-M158 WeakPolarHBondContact O-CG 3.36Å; G154-M158 PolarHBondContact O-N 3.33Å; V155-M158 PolarHBondContact O-N 2.9Å; M158-S162 WeakPolarHBondContact O-CB 2.85Å; M158-S162 PolarHBondContact O-N 3.07Å
159A95.6Very high91Very high61 Ų6172.6 Ų72.650%0.50445%0.445SS..Hα-helixtrans-64.1-43.4176.600000111.8V155 T156 L157 G163V155-A159 VanDerWaalsContact O-CB 3.32Å; V155-A159 WeakPolarHBondContact O-CB 3.44Å; V155-A159 PolarHBondContact O-N 3.14Å; T156-A159 PolarHBondContact O-N 3.07Å; L157-A159 VanDerWaalsContact C-N 3.32Å; L157-A159 PolarHBondContact O-N 3.45Å; A159-G163 PolarHBondContact O-N 3.38Å
160L95.8Very high90.9Very high120 Ų12073.3 Ų73.363%0.62846%0.455SS*.Hα-helixtrans-65.3-45.4177.2-70.2173.9000112.1T156 L157 G163 F164T156-L160 VanDerWaalsContact O-CG 3.3Å; T156-L160 WeakPolarHBondContact O-CG 3.26Å; T156-L160 PolarHBondContact O-N 2.9Å; L157-L160 PolarHBondContact O-N 2.89Å; L160-G163 PolarHBondContact O-N 3.49Å; L160-F164 PolarHBondContact O-N 3.33Å
161L93.6Very high90.7Very high124 Ų12480.9 Ų80.965%0.64948%0.482SS*.Hα-helixtrans-64.6-42.7177.4-9077.8000111.4L157 G163 F164 G165L157-L161 WeakPolarHBondContact O-CD1 3.28Å; L157-L161 PolarHBondContact O-N 3.08Å; L161-G163 VanDerWaalsContact C-N 3.34Å; L161-F164 PolarHBondContact O-N 3.35Å; L161-G165 PolarHBondContact O-N 3.48Å
162S95.8Very high90.4Very high85 Ų8582.7 Ų82.759%0.59449%0.486SS*.Hα-helixtrans-64-40.3175.5-170.30000111.5M158 G165 A166M158-S162 WeakPolarHBondContact O-CB 2.85Å; M158-S162 PolarHBondContact O-N 3.07Å; S162-G165 PolarHBondContact O-N 3.46Å; S162-A166 WeakPolarHBondContact O-CB 3.36Å; S162-A166 PolarHBondContact O-N 2.57Å
163G94.9Very high90Very high36 Ų3688.1 Ų88.137%0.37150%0.503SS..Hα-helixtrans-62.6-46.2175.400000112.1A159 L160 L161 G165 A166 V167A159-G163 PolarHBondContact O-N 3.38Å; L160-G163 PolarHBondContact O-N 3.49Å; L161-G163 VanDerWaalsContact C-N 3.34Å; G163-G165 PolarHBondContact O-N 3.01Å; G163-A166 PolarHBondContact O-N 3.45Å; G163-V167 WeakPolarHBondContact O-CG2 3.45Å; G163-V167 PolarHBondContact O-N 2.94Å; G163-V167 VanDerWaalsContact O-N 3.14Å
164F92.9Very high89.2Confident145 Ų14590.9 Ų90.964%0.63652%0.517SS*.Hα-helixtrans-61.5-43.3174.6-179.7-100.3000112L160 L161 A166 V167 N168L160-F164 PolarHBondContact O-N 3.33Å; L161-F164 PolarHBondContact O-N 3.35Å; F164-A166 VanDerWaalsContact C-N 3.33Å; F164-A166 PolarHBondContact O-N 2.83Å; F164-V167 PolarHBondContact O-N 3.44Å; F164-N168 HydrophobicContact CE1-CB 4.29Å; F164-N168 HydrophobicContact CZ-CB 4.48Å; F164-N168 VanDerWaalsContact O-CB 3.31Å; F164-N168 WeakPolarHBondContact O-CB 3.34Å; F164-N168 PolarHBondContact O-N 2.87Å
165G90.8Very high88.2Confident36 Ų3693.1 Ų93.137%0.37153%0.529SS..Hα-helixtrans-60.8-40.9175.600000112.7L161 S162 G163 V167 N168 C169L161-G165 PolarHBondContact O-N 3.48Å; S162-G165 PolarHBondContact O-N 3.46Å; G163-G165 PolarHBondContact O-N 3.01Å; G165-V167 VanDerWaalsContact C-N 3.27Å; G165-V167 PolarHBondContact O-N 2.93Å; G165-N168 PolarHBondContact O-N 3.4Å; G165-C169 WeakPolarHBondContact O-CB 3.34Å; G165-C169 PolarHBondContact O-N 3.19Å
166A92.6Very high87Confident67 Ų6797.1 Ų97.155%0.55453%0.534SS*.Hα-helixtrans-66.8-25177.400000113.5S162 G163 F164 P170S162-A166 WeakPolarHBondContact O-CB 3.36Å; S162-A166 PolarHBondContact O-N 2.57Å; G163-A166 PolarHBondContact O-N 3.45Å; F164-A166 VanDerWaalsContact C-N 3.33Å; F164-A166 PolarHBondContact O-N 2.83Å; A166-P170 WeakPolarHBondContact O-CD 3.46Å; A166-P170 WeakPolarHBondContact O-CG 3.5Å
167V90.5Very high85.8Confident101 Ų101101.8 Ų101.861%0.61255%0.549SS*.Hα-helixtrans-90.3-38.3174.9178.20000111.8G163 F164 G165 P170 Y171G163-V167 WeakPolarHBondContact O-CG2 3.45Å; G163-V167 PolarHBondContact O-N 2.94Å; G163-V167 VanDerWaalsContact O-N 3.14Å; F164-V167 PolarHBondContact O-N 3.44Å; G165-V167 VanDerWaalsContact C-N 3.27Å; G165-V167 PolarHBondContact O-N 2.93Å; V167-P170 VanDerWaalsContact O-CD 3.26Å; V167-P170 WeakPolarHBondContact O-CD 3.04Å; V167-P170 VanDerWaalsContact O-CG 3.27Å; V167-P170 WeakPolarHBondContact O-CG 3.43Å; V167-Y171 WeakPolarHBondContact O-CB 3.46Å; V167-Y171 PolarHBondContact O-N 3.2Å; V167-Y171 VanDerWaalsContact O-N 3.07Å
168N89.1Confident84.6Confident66 Ų66102.9 Ų102.935%0.35356%0.555SS.*Hα-helixtrans-68.6-37.4-179.9-170.5-0.9000112.2F164 G165 Y171 T172F164-N168 HydrophobicContact CE1-CB 4.29Å; F164-N168 HydrophobicContact CZ-CB 4.48Å; F164-N168 VanDerWaalsContact O-CB 3.31Å; F164-N168 WeakPolarHBondContact O-CB 3.34Å; F164-N168 PolarHBondContact O-N 2.87Å; G165-N168 PolarHBondContact O-N 3.4Å; N168-Y171 PolarHBondContact O-N 2.91Å; N168-T172 WeakPolarHBondContact O-CB 3.39Å; N168-T172 PolarHBondContact O-N 3.49Å; N168-T172 PolarHBondContact O-OG1 3.43Å; N168-T172 PolarHBondContact OD1-OG1 3.02Å; N168-T172 VanDerWaalsContact OD1-OG1 3.11Å
169C82.9Confident83.5Confident63 Ų63104.4 Ų104.443%0.42655%0.553SS.*Hα-helixtrans-54.8-57.6175.8179.20000112.5G165 Y171 T172 Y173G165-C169 WeakPolarHBondContact O-CB 3.34Å; G165-C169 PolarHBondContact O-N 3.19Å; C169-Y171 PolarHBondContact O-N 3.38Å; C169-T172 PolarHBondContact O-N 2.87Å; C169-Y173 HydrophobicContact CB-CD2 4.44Å; C169-Y173 HydrophobicContact CB-CE2 4.46Å; C169-Y173 WeakPolarHBondContact O-CB 3.34Å; C169-Y173 WeakPolarHBondContact O-CD2 3.46Å; C169-Y173 PolarHBondContact O-N 3.37Å; C169-Y173 WeakPolarHBondContact SG-CD2 3.15Å; C169-Y173 WeakPolarHBondContact SG-CE2 3.35Å
170P84.9Confident82.2Confident62 Ų62108.7 Ų108.740%0.40357%0.567SS.*Hα-helixtrans-66.3-37.2174.625.7-32.8000111.7A166 V167 T172 Y173 M174A166-P170 WeakPolarHBondContact O-CD 3.46Å; A166-P170 WeakPolarHBondContact O-CG 3.5Å; V167-P170 VanDerWaalsContact O-CD 3.26Å; V167-P170 WeakPolarHBondContact O-CD 3.04Å; V167-P170 VanDerWaalsContact O-CG 3.27Å; V167-P170 WeakPolarHBondContact O-CG 3.43Å; P170-T172 PolarHBondContact O-N 3.43Å; P170-Y173 PolarHBondContact O-N 3.14Å; P170-M174 WeakPolarHBondContact O-CA 3.33Å; P170-M174 WeakPolarHBondContact O-CB 3.15Å; P170-M174 PolarHBondContact O-N 3.03Å
171Y83.7Confident81.2Confident191 Ų191107.6 Ų107.675%0.74957%0.565SS**Hα-helixtrans-55.9-41.2176.3-173.1-96.1000112.4V167 N168 C169V167-Y171 WeakPolarHBondContact O-CB 3.46Å; V167-Y171 PolarHBondContact O-N 3.2Å; V167-Y171 VanDerWaalsContact O-N 3.07Å; N168-Y171 PolarHBondContact O-N 2.91Å; C169-Y171 PolarHBondContact O-N 3.38Å
172T81.9Confident80.6Confident72 Ų72105.4 Ų105.444%0.44256%0.557SS.*Hα-helixtrans-76.6-49179.4-56.10000111.8N168 C169 P170 S175N168-T172 WeakPolarHBondContact O-CB 3.39Å; N168-T172 PolarHBondContact O-N 3.49Å; N168-T172 PolarHBondContact O-OG1 3.43Å; N168-T172 PolarHBondContact OD1-OG1 3.02Å; N168-T172 VanDerWaalsContact OD1-OG1 3.11Å; C169-T172 PolarHBondContact O-N 2.87Å; P170-T172 PolarHBondContact O-N 3.43Å; T172-S175 PolarHBondContact O-OG 2.86Å
173Y78.7Confident80Confident150 Ų150107.3 Ų107.359%0.58856%0.561SS**Hα-helixtrans-82.8-28-174.3-61.3-53.1000114.4C169 P170 S175 Y176 F177C169-Y173 HydrophobicContact CB-CD2 4.44Å; C169-Y173 HydrophobicContact CB-CE2 4.46Å; C169-Y173 WeakPolarHBondContact O-CB 3.34Å; C169-Y173 WeakPolarHBondContact O-CD2 3.46Å; C169-Y173 PolarHBondContact O-N 3.37Å; C169-Y173 WeakPolarHBondContact SG-CD2 3.15Å; C169-Y173 WeakPolarHBondContact SG-CE2 3.35Å; P170-Y173 PolarHBondContact O-N 3.14Å; Y173-S175 VanDerWaalsContact C-N 3.26Å; Y173-S175 PolarHBondContact O-N 3.36Å; Y173-Y176 VanDerWaalsContact O-CB 3.27Å; Y173-Y176 WeakPolarHBondContact O-CB 3.06Å; Y173-Y176 PolarHBondContact O-N 2.98Å; Y173-F177 WeakPolarHBondContact O-CD2 3.19Å
174M71.1Confident79.6Confident103 Ų103110.1 Ų110.151%0.50757%0.57SS.*Hα-helixtrans-64.8-32.9178.9-169.282.5178.900111.1P170 Y176 F177 L178P170-M174 WeakPolarHBondContact O-CA 3.33Å; P170-M174 WeakPolarHBondContact O-CB 3.15Å; P170-M174 PolarHBondContact O-N 3.03Å; M174-Y176 PolarHBondContact O-N 3.5Å; M174-F177 PolarHBondContact O-N 2.9Å; M174-F177 VanDerWaalsContact O-N 3.13Å; M174-L178 HydrophobicContact CB-CD1 4.44Å; M174-L178 HydrophobicContact CE-CD1 3.78Å; M174-L178 HydrophobicContact CE-CD2 4.05Å; M174-L178 HydrophobicContact CE-CG 3.88Å; M174-L178 HydrophobicContact CG-CD1 3.35Å; M174-L178 HydrophobicContact CG-CG 3.92Å; M174-L178 WeakPolarHBondContact O-CB 3.45Å; M174-L178 WeakPolarHBondContact O-CG 3.27Å; M174-L178 PolarHBondContact O-N 3.17Å; M174-L178 HydrophobicContact SD-CD1 4.39Å
175S69.2Low79.2Confident74 Ų74106.5 Ų106.552%0.51756%0.558SS.*Hα-helixtrans-61.3-26.217475.10000113.3T172 Y173 R179T172-S175 PolarHBondContact O-OG 2.86Å; Y173-S175 VanDerWaalsContact C-N 3.26Å; Y173-S175 PolarHBondContact O-N 3.36Å; S175-R179 VanDerWaalsContact O-CB 3.23Å; S175-R179 WeakPolarHBondContact O-CB 3.41Å; S175-R179 PolarHBondContact O-N 3.31Å
176Y66.8Low79Confident182 Ų182108.8 Ų108.871%0.71456%0.561SS**Hα-helixtrans-74.1-38.4175-174.7-96.2000111.7Y173 M174Y173-Y176 VanDerWaalsContact O-CB 3.27Å; Y173-Y176 WeakPolarHBondContact O-CB 3.06Å; Y173-Y176 PolarHBondContact O-N 2.98Å; M174-Y176 PolarHBondContact O-N 3.5Å
177F66.2Low78.9Confident167 Ų167110 Ų11073%0.73256%0.558SS**Hα-helixtrans-83-27.9179.4-70.7-74.4000114Y173 M174Y173-F177 WeakPolarHBondContact O-CD2 3.19Å; M174-F177 PolarHBondContact O-N 2.9Å; M174-F177 VanDerWaalsContact O-N 3.13Å
178L65.9Low79Confident115 Ų115107.1 Ų107.160%0.60254%0.544SS*.Hα-helixtrans-85.7-12.5178.9-75.4169000113.7M174 N180M174-L178 HydrophobicContact CB-CD1 4.44Å; M174-L178 HydrophobicContact CE-CD1 3.78Å; M174-L178 HydrophobicContact CE-CD2 4.05Å; M174-L178 HydrophobicContact CE-CG 3.88Å; M174-L178 HydrophobicContact CG-CD1 3.35Å; M174-L178 HydrophobicContact CG-CG 3.92Å; M174-L178 WeakPolarHBondContact O-CB 3.45Å; M174-L178 WeakPolarHBondContact O-CG 3.27Å; M174-L178 PolarHBondContact O-N 3.17Å; M174-L178 HydrophobicContact SD-CD1 4.39Å; L178-N180 PolarHBondContact O-N 3.28Å; L178-N180 VanDerWaalsContact O-N 3.17Å
179R71.3Confident79.1Confident173 Ų173109.7 Ų109.765%0.65356%0.557SS**  trans-8199.7179.7-176157.1173.1169.3-4.5109.5S175 V181S175-R179 VanDerWaalsContact O-CB 3.23Å; S175-R179 WeakPolarHBondContact O-CB 3.41Å; S175-R179 PolarHBondContact O-N 3.31Å; R179-V181 PolarHBondContact O-N 2.74Å
180N68.3Low79.6Confident150 Ų150111.8 Ų111.880%0.80256%0.561SS**  trans-61.1110.8165.5-78-49.9000108.6L178L178-N180 PolarHBondContact O-N 3.28Å; L178-N180 VanDerWaalsContact O-N 3.17Å
181V72.9Confident80.2Confident98 Ų98117.3 Ų117.359%0.59457%0.573SS**  trans-82118.5178.3-178.20000108.1R179 I186R179-V181 PolarHBondContact O-N 2.74Å; V181-I186 HydrophobicContact CG1-CD1 3.95Å; V181-I186 HydrophobicContact CG1-CG1 3.57Å
182T81.3Confident80.6Confident77 Ų77116.1 Ų116.147%0.47257%0.568SS.*  trans-94148.2174.6-50.90000109.6T184 D185 I186T182-T184 WeakPolarHBondContact CG2-OG1 3.42Å; T182-T184 PolarHBondContact O-N 2.89Å; T182-T184 VanDerWaalsContact O-N 3.08Å; T182-D185 WeakPolarHBondContact O-CA 2.85Å; T182-D185 WeakPolarHBondContact O-CB 3.14Å; T182-D185 PolarHBondContact O-N 3.41Å; T182-I186 PolarHBondContact O-N 3.13Å
183D84.4Confident81.3Confident126 Ų126118.2 Ų118.267%0.67458%0.575SS**Hα-helixtrans-55.4-30.1-179.9-64.8-42.7000113.5D185 I186 L187D183-D185 VanDerWaalsContact C-N 3.32Å; D183-D185 PolarHBondContact O-N 3.5Å; D183-I186 PolarHBondContact O-N 3.06Å; D183-L187 PolarHBondContact O-N 3.25Å; D183-L187 VanDerWaalsContact O-N 3.11Å
184T85.4Confident82.1Confident94 Ų94115.2 Ų115.258%0.57757%0.569SS**Hα-helixtrans-63.2-36.2173.852.20000112.9T182 A188T182-T184 WeakPolarHBondContact CG2-OG1 3.42Å; T182-T184 PolarHBondContact O-N 2.89Å; T182-T184 VanDerWaalsContact O-N 3.08Å; T184-A188 WeakPolarHBondContact O-CB 3.46Å; T184-A188 PolarHBondContact O-N 3.35Å
185D84.9Confident83.3Confident70 Ų70116.2 Ų116.237%0.37457%0.573SS.*Hα-helixtrans-72.4-35.6178.6-67.1-21.4000111T182 D183 A188 L189T182-D185 WeakPolarHBondContact O-CA 2.85Å; T182-D185 WeakPolarHBondContact O-CB 3.14Å; T182-D185 PolarHBondContact O-N 3.41Å; D183-D185 VanDerWaalsContact C-N 3.32Å; D183-D185 PolarHBondContact O-N 3.5Å; D185-A188 PolarHBondContact O-N 3.07Å; D185-L189 VanDerWaalsContact O-CB 3.32Å; D185-L189 WeakPolarHBondContact O-CB 3.36Å; D185-L189 PolarHBondContact O-N 3.17Å
186I85.9Confident84.6Confident84 Ų84115.9 Ų115.943%0.43157%0.567SS.*Hα-helixtrans-62.7-51.4175.7-57.7176.4000109.6V181 T182 D183 A188 L189 E190V181-I186 HydrophobicContact CG1-CD1 3.95Å; V181-I186 HydrophobicContact CG1-CG1 3.57Å; T182-I186 PolarHBondContact O-N 3.13Å; D183-I186 PolarHBondContact O-N 3.06Å; I186-A188 VanDerWaalsContact C-N 3.31Å; I186-A188 PolarHBondContact O-N 2.86Å; I186-L189 PolarHBondContact O-N 2.9Å; I186-L189 VanDerWaalsContact O-N 3.15Å; I186-E190 WeakPolarHBondContact O-CB 3.44Å; I186-E190 PolarHBondContact O-N 3.47Å
187L92.1Very high86Confident93 Ų93112 Ų11249%0.48756%0.557SS.*Hα-helixtrans-60.7-39.1177-77.5163.3000112.3D183 R191D183-L187 PolarHBondContact O-N 3.25Å; D183-L187 VanDerWaalsContact O-N 3.11Å; L187-R191 WeakPolarHBondContact O-CG 3.2Å; L187-R191 PolarHBondContact O-N 3.44Å
188A91.3Very high87.5Confident40 Ų40109 Ų10933%0.33155%0.549SS..Hα-helixtrans-66-39.6175.800000112T184 D185 I186 R192T184-A188 WeakPolarHBondContact O-CB 3.46Å; T184-A188 PolarHBondContact O-N 3.35Å; D185-A188 PolarHBondContact O-N 3.07Å; I186-A188 VanDerWaalsContact C-N 3.31Å; I186-A188 PolarHBondContact O-N 2.86Å; A188-R192 VanDerWaalsContact O-CG 3.31Å; A188-R192 WeakPolarHBondContact O-CG 3.41Å; A188-R192 PolarHBondContact O-N 3.41Å; A188-R192 VanDerWaalsContact O-N 3.1Å
189L91.8Very high88.9Confident120 Ų120109 Ų10963%0.62855%0.547SS*.Hα-helixtrans-69.6-40.2177.8-16470000111.5D185 I186 R192 L193D185-L189 VanDerWaalsContact O-CB 3.32Å; D185-L189 WeakPolarHBondContact O-CB 3.36Å; D185-L189 PolarHBondContact O-N 3.17Å; I186-L189 PolarHBondContact O-N 2.9Å; I186-L189 VanDerWaalsContact O-N 3.15Å; L189-R192 PolarHBondContact O-N 3.34Å; L189-L193 WeakPolarHBondContact O-CB 3.28Å; L189-L193 PolarHBondContact O-N 2.93Å
190E94.6Very high90.1Very high106 Ų106105 Ų10550%0.49554%0.537SS..Hα-helixtrans-60.6-45.9174.7-172.5178.9-173.700111.3I186 R192 L193 L194I186-E190 WeakPolarHBondContact O-CB 3.44Å; I186-E190 PolarHBondContact O-N 3.47Å; E190-R192 VanDerWaalsContact C-N 3.34Å; E190-R192 PolarHBondContact O-N 2.97Å; E190-L193 WeakPolarHBondContact O-CB 3.25Å; E190-L193 PolarHBondContact O-N 2.86Å; E190-L194 HydrophobicContact CG-CD1 4.38Å; E190-L194 WeakPolarHBondContact O-CG 3.34Å; E190-L194 PolarHBondContact O-N 3.2Å
191R95.5Very high91.5Very high178 Ų178102 Ų10267%0.67252%0.521SS*.Hα-helixtrans-59.4-42.9174.2-74.3175.9-177-179.52.2112.2L187 L193 L194 Q195L187-R191 WeakPolarHBondContact O-CG 3.2Å; L187-R191 PolarHBondContact O-N 3.44Å; R191-L193 VanDerWaalsContact C-N 3.34Å; R191-L194 PolarHBondContact O-N 3.43Å; R191-Q195 WeakPolarHBondContact O-CB 3.34Å; R191-Q195 VanDerWaalsContact O-CG 3.28Å; R191-Q195 WeakPolarHBondContact O-CG 3.32Å; R191-Q195 PolarHBondContact O-N 2.93Å
192R93.5Very high92.5Very high166 Ų166100.1 Ų100.163%0.62651%0.512SS*.Hα-helixtrans-64.8-38.4176.5-73.3173.6-176.9-168.82.6112A188 L189 E190 T196A188-R192 VanDerWaalsContact O-CG 3.31Å; A188-R192 WeakPolarHBondContact O-CG 3.41Å; A188-R192 PolarHBondContact O-N 3.41Å; A188-R192 VanDerWaalsContact O-N 3.1Å; L189-R192 PolarHBondContact O-N 3.34Å; E190-R192 VanDerWaalsContact C-N 3.34Å; E190-R192 PolarHBondContact O-N 2.97Å; R192-T196 WeakPolarHBondContact O-CB 3.44Å; R192-T196 PolarHBondContact O-N 3.41Å; R192-T196 PolarHBondContact O-OG1 2.65Å
193L95.6Very high93.2Very high116 Ų116103.4 Ų103.461%0.60752%0.52SS*.Hα-helixtrans-65.3-47.3177.5-176.6124.9000110.9L189 E190 R191 Q195 T196 M197L189-L193 WeakPolarHBondContact O-CB 3.28Å; L189-L193 PolarHBondContact O-N 2.93Å; E190-L193 WeakPolarHBondContact O-CB 3.25Å; E190-L193 PolarHBondContact O-N 2.86Å; R191-L193 VanDerWaalsContact C-N 3.34Å; L193-Q195 PolarHBondContact O-N 3.04Å; L193-T196 PolarHBondContact O-N 3.2Å; L193-T196 VanDerWaalsContact O-N 3.16Å; L193-M197 WeakPolarHBondContact O-CB 3.42Å; L193-M197 PolarHBondContact O-N 3.48Å
194L96.4Very high93.7Very high88 Ų88104 Ų10446%0.46152%0.516SS..Hα-helixtrans-59.7-45.6175.4-70.8171.9000111.7E190 R191 T196 M197 D198E190-L194 HydrophobicContact CG-CD1 4.38Å; E190-L194 WeakPolarHBondContact O-CG 3.34Å; E190-L194 PolarHBondContact O-N 3.2Å; R191-L194 PolarHBondContact O-N 3.43Å; L194-T196 VanDerWaalsContact C-N 3.29Å; L194-T196 PolarHBondContact O-N 2.94Å; L194-M197 WeakPolarHBondContact O-CB 3.48Å; L194-M197 PolarHBondContact O-N 3.34Å; L194-M197 VanDerWaalsContact O-N 3.17Å; L194-D198 PolarHBondContact O-N 3Å
195Q96.4Very high94.1Very high124 Ų124106 Ų10658%0.57952%0.517SS*.Hα-helixtrans-58.3-40.6174.4-75.6175.4-14.900112.6R191 L193 D198 M199R191-Q195 WeakPolarHBondContact O-CB 3.34Å; R191-Q195 VanDerWaalsContact O-CG 3.28Å; R191-Q195 WeakPolarHBondContact O-CG 3.32Å; R191-Q195 PolarHBondContact O-N 2.93Å; L193-Q195 PolarHBondContact O-N 3.04Å; Q195-D198 PolarHBondContact O-N 3.31Å; Q195-M199 WeakPolarHBondContact O-CG 3.45Å; Q195-M199 PolarHBondContact O-N 3.45Å
196T96Very high94.4Very high66 Ų66111 Ų11141%0.40553%0.531SS..Hα-helixtrans-68.6-39.7178.4-54.90000111.2R192 L193 L194 M199 I200R192-T196 WeakPolarHBondContact O-CB 3.44Å; R192-T196 PolarHBondContact O-N 3.41Å; R192-T196 PolarHBondContact O-OG1 2.65Å; L193-T196 PolarHBondContact O-N 3.2Å; L193-T196 VanDerWaalsContact O-N 3.16Å; L194-T196 VanDerWaalsContact C-N 3.29Å; L194-T196 PolarHBondContact O-N 2.94Å; T196-M199 PolarHBondContact O-N 3.01Å; T196-I200 HydrophobicContact CG2-CD1 4.15Å; T196-I200 VanDerWaalsContact O-CG1 3.27Å; T196-I200 WeakPolarHBondContact O-CG1 3.47Å; T196-I200 PolarHBondContact O-N 3.29Å
197M96.9Very high94.7Very high102 Ų102113 Ų11350%0.50254%0.539SS..Hα-helixtrans-60.6-44.4174.3-178.6168.8147.700111.4L193 L194 M199 I200 I201L193-M197 WeakPolarHBondContact O-CB 3.42Å; L193-M197 PolarHBondContact O-N 3.48Å; L194-M197 WeakPolarHBondContact O-CB 3.48Å; L194-M197 PolarHBondContact O-N 3.34Å; L194-M197 VanDerWaalsContact O-N 3.17Å; M197-M199 PolarHBondContact O-N 3.38Å; M197-I200 WeakPolarHBondContact O-CB 3.31Å; M197-I200 PolarHBondContact O-N 2.99Å; M197-I201 HydrophobicContact CE-CD1 4.12Å; M197-I201 HydrophobicContact CG-CD1 4.03Å; M197-I201 WeakPolarHBondContact O-CG1 3.42Å; M197-I201 PolarHBondContact O-N 3.23Å
198D96.4Very high94.8Very high104 Ų104111 Ų11156%0.55654%0.536SS*.Hα-helixtrans-63-41.4175.7-72.8-26.5000112.4L194 Q195 I200 I201 S202L194-D198 PolarHBondContact O-N 3Å; Q195-D198 PolarHBondContact O-N 3.31Å; D198-I200 VanDerWaalsContact C-N 3.33Å; D198-I200 PolarHBondContact O-N 2.81Å; D198-I201 PolarHBondContact O-N 3.17Å; D198-S202 WeakPolarHBondContact O-CB 3.37Å; D198-S202 PolarHBondContact O-N 3.38Å
199M96Very high94.8Very high113 Ų113113.6 Ų113.656%0.55754%0.543SS*.Hα-helixtrans-61.1-41.5173.4-76.2-168-69.100112.1Q195 T196 M197 S202 K203Q195-M199 WeakPolarHBondContact O-CG 3.45Å; Q195-M199 PolarHBondContact O-N 3.45Å; T196-M199 PolarHBondContact O-N 3.01Å; M197-M199 PolarHBondContact O-N 3.38Å; M199-S202 PolarHBondContact O-N 3.24Å; M199-K203 WeakPolarHBondContact O-CB 3.34Å; M199-K203 WeakPolarHBondContact O-CG 3.28Å; M199-K203 PolarHBondContact O-N 3.38Å
200I96.9Very high94.6Very high89 Ų89110.3 Ų110.346%0.45653%0.533SS..Hα-helixtrans-63.8-46.1176.8-69.5164.6000110.3T196 M197 D198 S202 K203 K204T196-I200 HydrophobicContact CG2-CD1 4.15Å; T196-I200 VanDerWaalsContact O-CG1 3.27Å; T196-I200 WeakPolarHBondContact O-CG1 3.47Å; T196-I200 PolarHBondContact O-N 3.29Å; M197-I200 WeakPolarHBondContact O-CB 3.31Å; M197-I200 PolarHBondContact O-N 2.99Å; D198-I200 VanDerWaalsContact C-N 3.33Å; D198-I200 PolarHBondContact O-N 2.81Å; I200-S202 VanDerWaalsContact C-N 3.35Å; I200-S202 PolarHBondContact O-N 3.12Å; I200-K203 PolarHBondContact O-N 3.4Å; I200-K204 HydrophobicContact CG2-CD 4.37Å; I200-K204 HydrophobicContact CG2-CG 4.48Å; I200-K204 WeakPolarHBondContact O-CB 3.25Å; I200-K204 WeakPolarHBondContact O-CG 3.31Å; I200-K204 PolarHBondContact O-N 3.49Å
201I96.8Very high94.2Very high89 Ų89113.5 Ų113.546%0.45654%0.54SS..Hα-helixtrans-61.1-45.3177.8-68.2166.2000110.3M197 D198 K203 K204 K205M197-I201 HydrophobicContact CE-CD1 4.12Å; M197-I201 HydrophobicContact CG-CD1 4.03Å; M197-I201 WeakPolarHBondContact O-CG1 3.42Å; M197-I201 PolarHBondContact O-N 3.23Å; D198-I201 PolarHBondContact O-N 3.17Å; I201-K203 PolarHBondContact O-N 2.95Å; I201-K204 PolarHBondContact O-N 2.86Å; I201-K205 WeakPolarHBondContact O-CB 3.09Å; I201-K205 PolarHBondContact O-N 2.69Å
202S94.5Very high93.6Very high58 Ų58114 Ų11441%0.40654%0.542SS..Hα-helixtrans-59.8-44.8176.5-179.90000112D198 M199 I200 K205 R206D198-S202 WeakPolarHBondContact O-CB 3.37Å; D198-S202 PolarHBondContact O-N 3.38Å; M199-S202 PolarHBondContact O-N 3.24Å; I200-S202 VanDerWaalsContact C-N 3.35Å; I200-S202 PolarHBondContact O-N 3.12Å; S202-K205 PolarHBondContact O-N 2.75Å; S202-R206 WeakPolarHBondContact O-CB 3.34Å; S202-R206 WeakPolarHBondContact O-CG 3.4Å; S202-R206 PolarHBondContact O-N 3.25Å
203K95.7Very high93.2Very high145 Ų145109.9 Ų109.963%0.6354%0.535SS*.Hα-helixtrans-64.3-41.9174.9-75.6-170.3178.6-172.20112.2M199 I200 I201 R206 M207M199-K203 WeakPolarHBondContact O-CB 3.34Å; M199-K203 WeakPolarHBondContact O-CG 3.28Å; M199-K203 PolarHBondContact O-N 3.38Å; I200-K203 PolarHBondContact O-N 3.4Å; I201-K203 PolarHBondContact O-N 2.95Å; K203-R206 PolarHBondContact O-N 3.46Å; K203-M207 WeakPolarHBondContact O-CG 3.37Å; K203-M207 PolarHBondContact O-N 2.93Å
204K94.1Very high92.3Very high138 Ų138111.3 Ų111.360%0.654%0.541SS*.Hα-helixtrans-62.4-42.8174.9-76.7-171.7176.8-1700111.8I200 I201 M207 A208I200-K204 HydrophobicContact CG2-CD 4.37Å; I200-K204 HydrophobicContact CG2-CG 4.48Å; I200-K204 WeakPolarHBondContact O-CB 3.25Å; I200-K204 WeakPolarHBondContact O-CG 3.31Å; I200-K204 PolarHBondContact O-N 3.49Å; I201-K204 PolarHBondContact O-N 2.86Å; K204-M207 HydrophobicContact CG-CE 4.26Å; K204-M207 PolarHBondContact O-N 3.37Å; K204-A208 WeakPolarHBondContact O-CB 3.3Å; K204-A208 PolarHBondContact O-N 2.87Å
205K94.6Very high91.3Very high136 Ų136113.3 Ų113.359%0.59155%0.546SS*.Hα-helixtrans-61.3-45174.7-171.5179.6178177.30111I201 S202 A208 M209I201-K205 WeakPolarHBondContact O-CB 3.09Å; I201-K205 PolarHBondContact O-N 2.69Å; S202-K205 PolarHBondContact O-N 2.75Å; K205-A208 PolarHBondContact O-N 3.26Å; K205-M209 HydrophobicContact CG-CE 4.04Å; K205-M209 HydrophobicContact CG-SD 4.33Å; K205-M209 WeakPolarHBondContact O-CB 3.24Å; K205-M209 VanDerWaalsContact O-CG 3.3Å; K205-M209 WeakPolarHBondContact O-CG 3.21Å; K205-M209 PolarHBondContact O-N 3.06Å
206R92.2Very high90Very high177 Ų177113.4 Ų113.467%0.66855%0.547SS*.Hα-helixtrans-59.6-45.5174.7-76.9178.5169.6-170-2112.2S202 K203 M209 A210S202-R206 WeakPolarHBondContact O-CB 3.34Å; S202-R206 WeakPolarHBondContact O-CG 3.4Å; S202-R206 PolarHBondContact O-N 3.25Å; K203-R206 PolarHBondContact O-N 3.46Å; R206-M209 HydrophobicContact CG-CE 4.45Å; R206-M209 PolarHBondContact O-N 3.39Å; R206-A210 VanDerWaalsContact O-CB 3.3Å; R206-A210 WeakPolarHBondContact O-CB 3.49Å; R206-A210 PolarHBondContact O-N 2.91Å
207M92.3Very high88.4Confident124 Ų124118.3 Ų118.361%0.61156%0.562SS**Hα-helixtrans-63.7-42.3176.7-72.5-173.3-77.900112.3K203 K204 A210 R211K203-M207 WeakPolarHBondContact O-CG 3.37Å; K203-M207 PolarHBondContact O-N 2.93Å; K204-M207 HydrophobicContact CG-CE 4.26Å; K204-M207 PolarHBondContact O-N 3.37Å; M207-A210 PolarHBondContact O-N 3.11Å; M207-R211 WeakPolarHBondContact O-CB 3.48Å; M207-R211 PolarHBondContact O-N 3.48Å
208A92.3Very high86.6Confident51 Ų51115.2 Ų115.242%0.42156%0.556SS.*Hα-helixtrans-65.3-41.8176.800000112.2K204 K205 R211 R212K204-A208 WeakPolarHBondContact O-CB 3.3Å; K204-A208 PolarHBondContact O-N 2.87Å; K205-A208 PolarHBondContact O-N 3.26Å; A208-R211 PolarHBondContact O-N 3.49Å; A208-R212 WeakPolarHBondContact O-CG 3.46Å; A208-R212 PolarHBondContact O-N 3.44Å
209M91.2Very high84.4Confident96 Ų96117 Ų11747%0.47356%0.561SS.*Hα-helixtrans-65.6-43175.2-71.8-172.5-56.700111.8K205 R206 R211 R212 T213K205-M209 HydrophobicContact CG-CE 4.04Å; K205-M209 HydrophobicContact CG-SD 4.33Å; K205-M209 WeakPolarHBondContact O-CB 3.24Å; K205-M209 VanDerWaalsContact O-CG 3.3Å; K205-M209 WeakPolarHBondContact O-CG 3.21Å; K205-M209 PolarHBondContact O-N 3.06Å; R206-M209 HydrophobicContact CG-CE 4.45Å; R206-M209 PolarHBondContact O-N 3.39Å; M209-R211 VanDerWaalsContact C-N 3.33Å; M209-R211 PolarHBondContact O-N 3.14Å; M209-R212 PolarHBondContact O-N 3.07Å; M209-T213 PolarHBondContact O-N 3.49Å; M209-T213 PolarHBondContact O-OG1 2.95Å
210A88.7Confident82.3Confident50 Ų50116.1 Ų116.141%0.41356%0.562SS.*Hα-helixtrans-60.9-41.2174.600000111.6R206 M207 T213 M214R206-A210 VanDerWaalsContact O-CB 3.3Å; R206-A210 WeakPolarHBondContact O-CB 3.49Å; R206-A210 PolarHBondContact O-N 2.91Å; M207-A210 PolarHBondContact O-N 3.11Å; A210-T213 WeakPolarHBondContact CA-OG1 3.47Å; A210-T213 PolarHBondContact O-N 3.02Å; A210-T213 PolarHBondContact O-OG1 3.11Å; A210-M214 WeakPolarHBondContact O-CB 3.42Å; A210-M214 WeakPolarHBondContact O-CG 3.35Å; A210-M214 PolarHBondContact O-N 3.05Å
211R86.3Confident80Confident173 Ų173120.2 Ų120.265%0.65358%0.579SS**Hα-helixtrans-64-42.9174.7-166.1173.6-172.1-137.90.9111.6M207 A208 M209 M214 F215M207-R211 WeakPolarHBondContact O-CB 3.48Å; M207-R211 PolarHBondContact O-N 3.48Å; A208-R211 PolarHBondContact O-N 3.49Å; M209-R211 VanDerWaalsContact C-N 3.33Å; M209-R211 PolarHBondContact O-N 3.14Å; R211-M214 WeakPolarHBondContact O-CB 3.37Å; R211-M214 PolarHBondContact O-N 3.38Å; R211-F215 HydrophobicContact CG-CD2 4.01Å; R211-F215 HydrophobicContact CG-CE2 3.88Å; R211-F215 VanDerWaalsContact O-CD2 3.24Å; R211-F215 WeakPolarHBondContact O-CD2 3.37Å; R211-F215 PolarHBondContact O-N 2.93Å
212R83.8Confident77.5Confident190 Ų190123.2 Ų123.272%0.71760%0.596SS**Hα-helixtrans-63.6-42175.5-75.4-177.6179.5-177.2-0112.8A208 M209 F215 Q216A208-R212 WeakPolarHBondContact O-CG 3.46Å; A208-R212 PolarHBondContact O-N 3.44Å; M209-R212 PolarHBondContact O-N 3.07Å; R212-F215 PolarHBondContact O-N 3.37Å; R212-Q216 PolarHBondContact O-N 3.49Å
213T83.4Confident75Confident78 Ų78128 Ų12848%0.47961%0.61SS.*Hα-helixtrans-68.6-34.3175.824.90000112.3M209 A210 Q216 K217M209-T213 PolarHBondContact O-N 3.49Å; M209-T213 PolarHBondContact O-OG1 2.95Å; A210-T213 WeakPolarHBondContact CA-OG1 3.47Å; A210-T213 PolarHBondContact O-N 3.02Å; A210-T213 PolarHBondContact O-OG1 3.11Å; T213-Q216 PolarHBondContact O-N 2.88Å; T213-K217 WeakPolarHBondContact O-CB 3.43Å; T213-K217 PolarHBondContact O-N 2.82Å
214M77.7Confident72.4Confident147 Ų147127 Ų12772%0.72462%0.618SS**Hα-helixtrans-62.8-42.7170.1-72.9-86.3-170.500111.7A210 R211 K217 G218A210-M214 WeakPolarHBondContact O-CB 3.42Å; A210-M214 WeakPolarHBondContact O-CG 3.35Å; A210-M214 PolarHBondContact O-N 3.05Å; R211-M214 WeakPolarHBondContact O-CB 3.37Å; R211-M214 PolarHBondContact O-N 3.38Å; M214-K217 PolarHBondContact O-N 3.24Å; M214-G218 PolarHBondContact O-N 3.16Å
215F74.8Confident70.2Confident130 Ų130125.5 Ų125.557%0.5763%0.625SS**Hα-helixtrans-65.4-43.6174.4-87.7-73.2000112.5R211 R212 G218 E219R211-F215 HydrophobicContact CG-CD2 4.01Å; R211-F215 HydrophobicContact CG-CE2 3.88Å; R211-F215 VanDerWaalsContact O-CD2 3.24Å; R211-F215 WeakPolarHBondContact O-CD2 3.37Å; R211-F215 PolarHBondContact O-N 2.93Å; R212-F215 PolarHBondContact O-N 3.37Å; F215-G218 CarbonylContact O-C 3.58Å; F215-G218 PolarHBondContact O-N 3.32Å; F215-E219 PolarHBondContact O-N 3.49Å
216Q69.4Low68.4Low126 Ų126121.3 Ų121.359%0.58962%0.621SS**Hα-helixtrans-64.8-39.5174.7-83.1-174.3-20.600112.4R212 T213 G218 E219 V220R212-Q216 PolarHBondContact O-N 3.49Å; T213-Q216 PolarHBondContact O-N 2.88Å; Q216-G218 VanDerWaalsContact C-N 3.32Å; Q216-E219 PolarHBondContact O-N 2.95Å; Q216-V220 WeakPolarHBondContact O-CB 3.35Å; Q216-V220 VanDerWaalsContact O-CG2 3.23Å; Q216-V220 WeakPolarHBondContact O-CG2 3.47Å; Q216-V220 PolarHBondContact O-N 3.17Å
217K62.3Low66.6Low168 Ų168120.4 Ų120.473%0.7362%0.622SS**Hα-helixtrans-64.8-36.2171.7-97-176169.3-178.10112T213 M214 V220 H221T213-K217 WeakPolarHBondContact O-CB 3.43Å; T213-K217 PolarHBondContact O-N 2.82Å; M214-K217 PolarHBondContact O-N 3.24Å; K217-V220 PolarHBondContact O-N 3.31Å; K217-H221 WeakPolarHBondContact O-CB 3.45Å; K217-H221 PolarHBondContact O-N 2.91Å
218G58.7Low64.9Low37 Ų37123.3 Ų123.338%0.38163%0.626SS.*Hα-helixtrans-65.1-39.1173.300000113.1M214 F215 Q216 H221 N222M214-G218 PolarHBondContact O-N 3.16Å; F215-G218 CarbonylContact O-C 3.58Å; F215-G218 PolarHBondContact O-N 3.32Å; Q216-G218 VanDerWaalsContact C-N 3.32Å; G218-H221 PolarHBondContact O-N 3.41Å; G218-N222 PolarHBondContact O-N 3.46Å; G218-N222 VanDerWaalsContact O-N 3.08Å
219E51.4Low63.2Low141 Ų141124 Ų12466%0.65964%0.638SS**Hα-helixtrans-71.8-35.7173.4-85.8-171.7127.200112.9F215 Q216 H221 N222 K223F215-E219 PolarHBondContact O-N 3.49Å; Q216-E219 PolarHBondContact O-N 2.95Å; E219-H221 VanDerWaalsContact C-N 3.27Å; E219-H221 PolarHBondContact O-N 2.73Å; E219-N222 PolarHBondContact O-N 3.32Å; E219-K223 PolarHBondContact O-N 3.11Å
220V51.3Low61.5Low96 Ų96125.7 Ų125.758%0.58265%0.646SS**Hα-helixtrans-70.3-25.4174.3174.50000111.4Q216 K217Q216-V220 WeakPolarHBondContact O-CB 3.35Å; Q216-V220 VanDerWaalsContact O-CG2 3.23Å; Q216-V220 WeakPolarHBondContact O-CG2 3.47Å; Q216-V220 PolarHBondContact O-N 3.17Å; K217-V220 PolarHBondContact O-N 3.31Å
221H48.3Very low60.1Low175 Ų175127.1 Ų127.181%0.8165%0.646SS**Hα-helixtrans-83-23.5172.6-156.348.6000113.6K217 G218 E219K217-H221 WeakPolarHBondContact O-CB 3.45Å; K217-H221 PolarHBondContact O-N 2.91Å; G218-H221 PolarHBondContact O-N 3.41Å; E219-H221 VanDerWaalsContact C-N 3.27Å; E219-H221 PolarHBondContact O-N 2.73Å
222N43.8Very low58.4Low151 Ų151125.7 Ų125.781%0.80765%0.645SS**Hα-helixtrans-89.8-8.9174.5-102.8-28.9000114.3G218 E219G218-N222 PolarHBondContact O-N 3.46Å; G218-N222 VanDerWaalsContact O-N 3.08Å; E219-N222 PolarHBondContact O-N 3.32Å
223K42Very low56.9Low159 Ų159120.2 Ų120.269%0.69164%0.635SS**SBendtrans-90.5124.7165.3-140.7171.7-173.51730106.8E219 S225E219-K223 PolarHBondContact O-N 3.11Å; K223-S225 PolarHBondContact O-N 3.09Å
224P41.5Very low55.5Low123 Ų123121.5 Ų121.580%0.79964%0.643SS**  trans-67.389.4176.328.2-31.5000108G226P224-G226 PolarHBondContact O-N 3.5Å
225S48.8Very low54.2Low107 Ų107119.8 Ų119.875%0.74864%0.641SS**  trans-77.753.4165.169.50000108.6K223K223-S225 PolarHBondContact O-N 3.09Å
226G55.4Low52.8Low49 Ų49119.5 Ų119.551%0.50565%0.65SS.*  trans-92.5104.717200000108P224 W228P224-G226 PolarHBondContact O-N 3.5Å; G226-W228 PolarHBondContact O-N 2.95Å
227F55.6Low51.7Low158 Ų158118.3 Ų118.369%0.69366%0.656SS**SBendtrans70.1-31151.1-149.8-113.7000118.3G229 M230 I231F227-G229 PolarHBondContact O-N 2.9Å; F227-M230 PolarHBondContact O-N 3.21Å; F227-I231 HydrophobicContact CD1-CD1 3.6Å; F227-I231 HydrophobicContact CD1-CG1 4.38Å; F227-I231 HydrophobicContact CE1-CD1 3.71Å; F227-I231 HydrophobicContact CE1-CG1 4.39Å
228W55.7Low50.8Low184 Ų184114.8 Ų114.870%0.69766%0.658SS**Hα-helixtrans-72.3-25-173.1-109.981.9000115.4G226G226-W228 PolarHBondContact O-N 2.95Å
229G57Low49.6Very low65 Ų65119.2 Ų119.267%0.6768%0.683SS**Hα-helixtrans-72.9-28.7177.900000113.5F227F227-G229 PolarHBondContact O-N 2.9Å
230M56.6Low48.7Very low133 Ų133116.1 Ų116.166%0.65569%0.689SS**Hα-helixtrans-85.6-25.4-176.6-158.1157.574.300112.4F227 S233 V234F227-M230 PolarHBondContact O-N 3.21Å; M230-S233 PolarHBondContact O-OG 3.07Å; M230-V234 WeakPolarHBondContact O-CG2 3.34Å
231I57.6Low48Very low80 Ų80116.7 Ų116.741%0.4170%0.697SS.*Hα-helixtrans-76.8-32.3176.4-53.2168.8000111.1F227 V234 T235F227-I231 HydrophobicContact CD1-CD1 3.6Å; F227-I231 HydrophobicContact CD1-CG1 4.38Å; F227-I231 HydrophobicContact CE1-CD1 3.71Å; F227-I231 HydrophobicContact CE1-CG1 4.39Å; I231-V234 PolarHBondContact O-N 3.28Å; I231-T235 PolarHBondContact O-N 3.39Å; I231-T235 PolarHBondContact O-OG1 3.28Å
232K52.2Low47.2Very low142 Ų142117.1 Ų117.162%0.61770%0.699SS**Hα-helixtrans-71.4-26.3176.2-80.3-162.1178.7-171.40114.1T236K232-T236 PolarHBondContact O-OG1 2.85Å
233S52.2Low46.6Very low75 Ų75114.2 Ų114.252%0.52469%0.691SS.*Hα-helixtrans-80.7-21.5174.963.20000113.2M230M230-S233 PolarHBondContact O-OG 3.07Å
234V53.2Low46.2Very low105 Ų105113.7 Ų113.764%0.63669%0.694SS**Hα-helixtrans-88.4-22179.8175.70000112.2M230 I231M230-V234 WeakPolarHBondContact O-CG2 3.34Å; I231-V234 PolarHBondContact O-N 3.28Å
235T49.7Very low45.8Very low111 Ų111115 Ų11568%0.68169%0.693SS**THydrogen-bonded Turntrans-84.9-10.9-179.1-47.40000113.4I231I231-T235 PolarHBondContact O-N 3.39Å; I231-T235 PolarHBondContact O-OG1 3.28Å
236T45.3Very low45Very low125 Ų125115.5 Ų115.577%0.76770%0.695SS**THydrogen-bonded Turntrans-96.27.1179.6-19.20000113.9K232K232-T236 PolarHBondContact O-OG1 2.85Å
237S46.7Very low45Very low101 Ų101118.3 Ų118.371%0.70671%0.705SS**SBendtrans-112.415.2-173.9-49.70000115.1
238A44.3Very low44Very low93 Ų93116.3 Ų116.377%0.76971%0.711SS**  trans-138.282.4179.300000112.4
239S33.5Very low43.2Very low131 Ų131116.1 Ų116.192%0.91675%0.748SS**  trans-162.6122149.9-175.60000109.9
240G32.4Very low42.5Very low75 Ų75118.7 Ų118.777%0.77375%0.752SS**  trans12372.8161.600000115.4
241S35.4Very low41.7Very low108 Ų108117.9 Ų117.976%0.75576%0.757SS**  trans-66.2164.9153.143.90000112
242E31.4Very low40.9Very low184 Ų184120 Ų12086%0.8678%0.776SS**  trans96.4133.8168.9-59.2-174.8172.600115.4
243S32.4Very low40.2Very low90 Ų90118.7 Ų118.763%0.62979%0.786SS**  cis-176.5168.2-8.351.70000107.5
244I32.9Very low39.4Very low148 Ų148121.4 Ų121.476%0.75980%0.802SS**  trans97.6109.9152.6-58.5168.1000119.7
245L33.8Very low38.5Very low151 Ų151122.5 Ų122.579%0.79181%0.813SS**  trans54.5115.7140.7-96.982.8000123.7
246C32.6Very low37.7Very low117 Ų117123.4 Ų123.479%0.79182%0.822SS**  71.1158.9116.1-82.80000122.2
247P53.9Low37.1Very low108 Ų108123.2 Ų123.270%0.70183%0.827SS**  -121.8179.9-124.643.5-32000115.9
248S35.7Very low36.3Very low117 Ų117125.1 Ų125.182%0.81884%0.837SS**  trans68.3106.8153.7-62.70000119.2
249A37.7Very low35.6Very low179 Ų179128 Ų128100%1.47984%0.843SS**  -170.50118.100000109.1

Retrieved 249 of 249 residues in 70.4 ms (Link to these results)

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