A0A096MYP5_PAPAN Loading...

Mitochondrial ornithine transporter 1

Mitochondrial ornithine-citrulline antiporter. Catalyzes the exchange between cytosolic ornithine and mitochondrial citrulline plus an H(+), the proton compensates the positive charge of ornithine thus leading to an electroneutral transport. Plays a crucial role in the urea cycle, by connecting the cytosolic and the intramitochondrial reactions of the urea cycle. Lysine and arginine are also transported by the antiport mechanism. In addition, catalyzes an electroneutral exchange of ornithine or lysine for H(+), a reaction driven by the pH gradient across the inner membrane.

AlphaFold DB (Q9Y619), UniProt , Accession A0A096MYP5, Species PAPAN (Papio anubis, Olive baboon), Gene SLC25A15, Length 301 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
1M49.3Very low76.8Confident217 Ų21790.7 Ų90.7100%1.06952%0.518SS*.  01330-72.8174.4165.400108.6S3M1-S3 PolarHBondContact O-N 3.46Å
2K54.1Low77.8Confident209 Ų20987 Ų8791%0.90950%0.495SS*.  trans-60113.4169.5-79.1179.5176.8177.50106.6N4K2-N4 PolarHBondContact O-N 3.04Å
3S63.2Low78.4Confident55 Ų5590.1 Ų90.139%0.38551%0.508SS..  trans-48.6113.9-178.7360000109M1M1-S3 PolarHBondContact O-N 3.46Å
4N79.6Confident79.2Confident88 Ų8888.9 Ų88.947%0.47150%0.504SS..  trans-54126.8177.1179.9-21.9000107.6K2 A6 I7 Q8K2-N4 PolarHBondContact O-N 3.04Å; N4-A6 PolarHBondContact O-N 3.06Å; N4-A6 WeakPolarHBondContact OD1-CB 3.37Å; N4-A6 PolarHBondContact OD1-N 3.19Å; N4-I7 HydrophobicContact CB-CB 4.37Å; N4-I7 HydrophobicContact CB-CD1 3.92Å; N4-I7 HydrophobicContact CB-CG1 3.99Å; N4-I7 WeakPolarHBondContact O-CB 3.3Å; N4-I7 PolarHBondContact O-N 2.81Å; N4-Q8 PolarHBondContact O-N 2.85Å; N4-Q8 VanDerWaalsContact O-N 3.1Å
5P82.6Confident79.9Confident102 Ų10282.9 Ų82.966%0.66247%0.47SS*.Hα-helixtrans-50.4-32.9-179.3-28.533.9000113.3A9P5-A9 WeakPolarHBondContact O-CB 3.49Å; P5-A9 PolarHBondContact O-N 3.18Å
6A84.3Confident80.5Confident64 Ų6479.8 Ų79.853%0.52946%0.462SS..Hα-helixtrans-66.6-39.5176.500000113N4 A10N4-A6 PolarHBondContact O-N 3.06Å; N4-A6 WeakPolarHBondContact OD1-CB 3.37Å; N4-A6 PolarHBondContact OD1-N 3.19Å; A6-A10 WeakPolarHBondContact O-CB 3.14Å; A6-A10 PolarHBondContact O-N 3.28Å
7I86Confident81Confident69 Ų6978.4 Ų78.435%0.35446%0.462SS..Hα-helixtrans-68.8-45.1177.7-63.7176.4000109.7N4 A9 A10 I11 L298N4-I7 HydrophobicContact CB-CB 4.37Å; N4-I7 HydrophobicContact CB-CD1 3.92Å; N4-I7 HydrophobicContact CB-CG1 3.99Å; N4-I7 WeakPolarHBondContact O-CB 3.3Å; N4-I7 PolarHBondContact O-N 2.81Å; I7-A9 VanDerWaalsContact C-N 3.32Å; I7-A9 PolarHBondContact O-N 2.94Å; I7-A10 PolarHBondContact O-N 3.4Å; I7-A10 VanDerWaalsContact O-N 3.15Å; I7-I11 HydrophobicContact CG2-CD1 3.99Å; I7-I11 HydrophobicContact CG2-CG1 4.43Å; I7-I11 WeakPolarHBondContact O-CG1 3.42Å; I7-I11 PolarHBondContact O-N 2.74Å; I7-L298 HydrophobicContact CD1-CD1 4.26Å; I7-L298 HydrophobicContact CG2-CD1 3.67Å; I7-L298 HydrophobicContact CG2-CD2 3.77Å; I7-L298 HydrophobicContact CG2-CG 4.37Å
8Q84.2Confident81.6Confident68 Ų6876.1 Ų76.132%0.31845%0.453SS..Hα-helixtrans-60.4-43.5177-178.4170.7-7.300111.4N4 A10 I11 D12 M295N4-Q8 PolarHBondContact O-N 2.85Å; N4-Q8 VanDerWaalsContact O-N 3.1Å; Q8-A10 VanDerWaalsContact C-N 3.32Å; Q8-A10 PolarHBondContact O-N 3.33Å; Q8-I11 PolarHBondContact O-N 3.18Å; Q8-D12 WeakPolarHBondContact O-CB 3.3Å; Q8-D12 PolarHBondContact O-N 2.78Å; Q8-M295 HydrophobicContact CG-CE 4.03Å
9A84.9Confident82.1Confident58 Ų5872.2 Ų72.248%0.47943%0.43SS..Hα-helixtrans-60.2-40.5174.600000112.4P5 I7 D12 L13P5-A9 WeakPolarHBondContact O-CB 3.49Å; P5-A9 PolarHBondContact O-N 3.18Å; I7-A9 VanDerWaalsContact C-N 3.32Å; I7-A9 PolarHBondContact O-N 2.94Å; A9-D12 PolarHBondContact O-N 3.25Å; A9-L13 VanDerWaalsContact O-CB 3.22Å; A9-L13 WeakPolarHBondContact O-CB 3.48Å; A9-L13 PolarHBondContact O-N 2.91Å
10A88.3Confident82.5Confident54 Ų5469.2 Ų69.245%0.44642%0.415SS..Hα-helixtrans-65.9-39.7176.400000112.5A6 I7 Q8 T14A6-A10 WeakPolarHBondContact O-CB 3.14Å; A6-A10 PolarHBondContact O-N 3.28Å; I7-A10 PolarHBondContact O-N 3.4Å; I7-A10 VanDerWaalsContact O-N 3.15Å; Q8-A10 VanDerWaalsContact C-N 3.32Å; Q8-A10 PolarHBondContact O-N 3.33Å; A10-T14 WeakPolarHBondContact O-CB 3.45Å; A10-T14 PolarHBondContact O-N 3.14Å; A10-T14 PolarHBondContact O-OG1 2.89Å
11I88.5Confident83Confident14 Ų1468.8 Ų68.87%0.07241%0.413CS..Hα-helixtrans-62.9-51174.6-69.4173.6000110.2I7 Q8 L13 T14 A15 R291 M294 M295 L298I7-I11 HydrophobicContact CG2-CD1 3.99Å; I7-I11 HydrophobicContact CG2-CG1 4.43Å; I7-I11 WeakPolarHBondContact O-CG1 3.42Å; I7-I11 PolarHBondContact O-N 2.74Å; Q8-I11 PolarHBondContact O-N 3.18Å; I11-L13 VanDerWaalsContact C-N 3.31Å; I11-L13 PolarHBondContact O-N 3.43Å; I11-T14 PolarHBondContact O-N 3.2Å; I11-A15 WeakPolarHBondContact O-CB 3.16Å; I11-A15 PolarHBondContact O-N 3.35Å; I11-R291 HydrophobicContact CG2-CG 4.07Å; I11-M294 HydrophobicContact CD1-CB 4.28Å; I11-M294 HydrophobicContact CG1-CB 4.04Å; I11-M294 HydrophobicContact CG1-SD 4.47Å; I11-M294 HydrophobicContact CG2-CB 3.88Å; I11-M294 HydrophobicContact CG2-CE 3.99Å; I11-M294 HydrophobicContact CG2-SD 4.32Å; I11-M294 WeakPolarHBondContact O-CE 3.41Å; I11-M295 HydrophobicContact CD1-CE 4.27Å; I11-M295 HydrophobicContact CD1-CG 4.48Å; I11-M295 HydrophobicContact CD1-SD 3.83Å; I11-M295 HydrophobicContact CG2-CE 4.25Å; I11-M295 HydrophobicContact CG2-CG 4.39Å; I11-L298 HydrophobicContact CD1-CD2 4.23Å
12D87.8Confident85.1Confident46 Ų4659.6 Ų59.625%0.24637%0.372CS..Hα-helixtrans-64.4-36.5-178.1-69.8-31.6000111.4Q8 A9 G16 R291Q8-D12 WeakPolarHBondContact O-CB 3.3Å; Q8-D12 PolarHBondContact O-N 2.78Å; A9-D12 PolarHBondContact O-N 3.25Å; D12-G16 PolarHBondContact O-N 3.22Å; D12-R291 WeakPolarHBondContact OD1-CD 3.14Å; D12-R291 IonicContact OD1-CZ 3.97Å; D12-R291 IonicContact OD1-NE 2.9Å; D12-R291 PolarHBondContact OD1-NE 3.41Å
13L86.6Confident87Confident127 Ų12750.5 Ų50.567%0.66533%0.334SS*.Hα-helixtrans-65.6-45.2174.5-174150.7000111.8A9 I11 G16 A17A9-L13 VanDerWaalsContact O-CB 3.22Å; A9-L13 WeakPolarHBondContact O-CB 3.48Å; A9-L13 PolarHBondContact O-N 2.91Å; I11-L13 VanDerWaalsContact C-N 3.31Å; I11-L13 PolarHBondContact O-N 3.43Å; L13-G16 PolarHBondContact O-N 3.45Å; L13-A17 WeakPolarHBondContact O-CB 3.27Å; L13-A17 PolarHBondContact O-N 2.96Å
14T89.7Confident88.3Confident73 Ų7348.7 Ų48.745%0.44832%0.321SS..Hα-helixtrans-66.1-42.8179.1-56.10000111A10 I11 G16 A17 A18 M294A10-T14 WeakPolarHBondContact O-CB 3.45Å; A10-T14 PolarHBondContact O-N 3.14Å; A10-T14 PolarHBondContact O-OG1 2.89Å; I11-T14 PolarHBondContact O-N 3.2Å; T14-G16 VanDerWaalsContact C-N 3.35Å; T14-A17 PolarHBondContact O-N 3.23Å; T14-A18 PolarHBondContact O-N 3.32Å; T14-M294 HydrophobicContact CG2-CE 4.08Å; T14-M294 HydrophobicContact CG2-SD 3.86Å
15A89.8Confident89Confident0 Ų047.9 Ų47.90%032%0.316CS..Hα-helixtrans-64.6-40.7175.800000111.7I11 A18 G19 Y287 S290 R291 M294I11-A15 WeakPolarHBondContact O-CB 3.16Å; I11-A15 PolarHBondContact O-N 3.35Å; A15-A18 PolarHBondContact O-N 3.31Å; A15-G19 PolarHBondContact O-N 3.36Å; A15-Y287 HydrophobicContact CB-CD2 3.77Å; A15-Y287 HydrophobicContact CB-CE2 3.87Å; A15-Y287 HydrophobicContact CB-CG 4.49Å; A15-S290 VanDerWaalsContact CA-OG 3.25Å; A15-S290 WeakPolarHBondContact CA-OG 3.42Å; A15-S290 VanDerWaalsContact CB-OG 3.3Å; A15-S290 WeakPolarHBondContact CB-OG 3.41Å; A15-R291 HydrophobicContact CB-CB 3.84Å; A15-M294 HydrophobicContact CB-CE 3.86Å
16G88.2Confident89.5Confident33 Ų3345.3 Ų45.334%0.3430%0.299SS..Hα-helixtrans-60.2-44.6173.600000112.3D12 L13 T14 G19 G20D12-G16 PolarHBondContact O-N 3.22Å; L13-G16 PolarHBondContact O-N 3.45Å; T14-G16 VanDerWaalsContact C-N 3.35Å; G16-G19 PolarHBondContact O-N 3.49Å; G16-G20 PolarHBondContact O-N 3.36Å
17A89.8Confident89.9Confident55 Ų5542.3 Ų42.346%0.45527%0.274SS..Hα-helixtrans-64.1-41.1176.400000112.3L13 T14 T21L13-A17 WeakPolarHBondContact O-CB 3.27Å; L13-A17 PolarHBondContact O-N 2.96Å; T14-A17 PolarHBondContact O-N 3.23Å; A17-T21 WeakPolarHBondContact O-CB 3.28Å; A17-T21 PolarHBondContact O-N 3.18Å; A17-T21 PolarHBondContact O-OG1 2.93Å
18A92.1Very high90.2Very high38 Ų3839 Ų3931%0.31426%0.257SS..Hα-helixtrans-63.2-46174.600000111.6T14 A15 T21 A22T14-A18 PolarHBondContact O-N 3.32Å; A15-A18 PolarHBondContact O-N 3.31Å; A18-T21 PolarHBondContact O-N 3.3Å; A18-A22 WeakPolarHBondContact O-CB 3.26Å; A18-A22 PolarHBondContact O-N 2.63Å
19G91.4Very high90.7Very high1 Ų136.8 Ų36.81%0.0125%0.249CC..Hα-helixtrans-59.3-48.8175.100000113A15 G16 T21 A22 C23A15-G19 PolarHBondContact O-N 3.36Å; G16-G19 PolarHBondContact O-N 3.49Å; G19-T21 VanDerWaalsContact C-N 3.33Å; G19-T21 PolarHBondContact O-N 3.22Å; G19-A22 PolarHBondContact O-N 2.68Å; G19-C23 WeakPolarHBondContact O-CB 3.41Å; G19-C23 PolarHBondContact O-N 3Å
20G90.2Very high91.1Very high13 Ų1336 Ų3613%0.13424%0.235CC..Hα-helixtrans-60.2-41.9176.200000112.3G16 C23 V24G16-G20 PolarHBondContact O-N 3.36Å; G20-C23 WeakPolarHBondContact O-CB 3.15Å; G20-C23 PolarHBondContact O-N 3.3Å; G20-V24 WeakPolarHBondContact O-CG2 3.23Å; G20-V24 PolarHBondContact O-N 3.22Å
21T92.8Very high91.3Very high61 Ų6134.8 Ų34.837%0.37422%0.22SC..Hα-helixtrans-64.6-46.3177.1-57.80000111.7A17 A18 G19 C23 V24 L25 L71A17-T21 WeakPolarHBondContact O-CB 3.28Å; A17-T21 PolarHBondContact O-N 3.18Å; A17-T21 PolarHBondContact O-OG1 2.93Å; A18-T21 PolarHBondContact O-N 3.3Å; G19-T21 VanDerWaalsContact C-N 3.33Å; G19-T21 PolarHBondContact O-N 3.22Å; T21-C23 VanDerWaalsContact C-N 3.33Å; T21-C23 PolarHBondContact O-N 3.09Å; T21-V24 PolarHBondContact O-N 3.04Å; T21-L25 HydrophobicContact CG2-CD1 3.93Å; T21-L25 HydrophobicContact CG2-CG 4.37Å; T21-L25 WeakPolarHBondContact O-CB 3.39Å; T21-L25 VanDerWaalsContact O-CG 3.32Å; T21-L25 WeakPolarHBondContact O-CG 3.42Å; T21-L25 PolarHBondContact O-N 2.67Å; T21-L71 HydrophobicContact CG2-CD2 4.19Å
22A93.6Very high91.4Very high24 Ų2434.1 Ų34.120%0.19822%0.217CC..Hα-helixtrans-62.1-40.8177.600000112A18 G19 L25 T26 A282 A286A18-A22 WeakPolarHBondContact O-CB 3.26Å; A18-A22 PolarHBondContact O-N 2.63Å; G19-A22 PolarHBondContact O-N 2.68Å; A22-L25 PolarHBondContact O-N 3Å; A22-T26 WeakPolarHBondContact O-CB 3.24Å; A22-T26 WeakPolarHBondContact O-CG2 3.34Å; A22-T26 PolarHBondContact O-N 3.35Å; A22-T26 PolarHBondContact O-OG1 3.33Å; A22-A282 HydrophobicContact CB-CB 4.22Å; A22-A286 HydrophobicContact CB-CB 3.57Å
23C92.6Very high91.7Very high18 Ų1832.5 Ų32.512%0.12221%0.208CC..Hα-helixtrans-57.7-49.1174.5-1750000111.9G19 G20 T21 T26 G27 L283G19-C23 WeakPolarHBondContact O-CB 3.41Å; G19-C23 PolarHBondContact O-N 3Å; G20-C23 WeakPolarHBondContact O-CB 3.15Å; G20-C23 PolarHBondContact O-N 3.3Å; T21-C23 VanDerWaalsContact C-N 3.33Å; T21-C23 PolarHBondContact O-N 3.09Å; C23-T26 PolarHBondContact O-OG1 3.28Å; C23-G27 WeakPolarHBondContact O-CA 3.1Å; C23-G27 PolarHBondContact O-N 3.03Å; C23-L283 HydrophobicContact CB-CB 3.92Å; C23-L283 HydrophobicContact CB-CD1 3.97Å; C23-L283 HydrophobicContact CB-CG 4.32Å
24V91.8Very high92Very high17 Ų1727.6 Ų27.610%0.10318%0.181CC..Hα-helixtrans-65.2-45.9179.3172.70000110.6G20 T21 T26 G27 Q28 T67 A70 L71 N74G20-V24 WeakPolarHBondContact O-CG2 3.23Å; G20-V24 PolarHBondContact O-N 3.22Å; T21-V24 PolarHBondContact O-N 3.04Å; V24-T26 PolarHBondContact O-N 2.91Å; V24-G27 PolarHBondContact O-N 3.06Å; V24-Q28 WeakPolarHBondContact O-CB 3.44Å; V24-Q28 PolarHBondContact O-N 3.28Å; V24-T67 HydrophobicContact CG1-CG2 4.3Å; V24-A70 HydrophobicContact CG1-CB 3.81Å; V24-L71 HydrophobicContact CB-CD2 3.65Å; V24-L71 HydrophobicContact CB-CG 4.32Å; V24-L71 HydrophobicContact CG1-CD2 3.79Å; V24-L71 HydrophobicContact CG1-CG 3.88Å; V24-L71 HydrophobicContact CG2-CD2 3.93Å; V24-N74 HydrophobicContact CG2-CB 4.47Å
25L93.2Very high92.1Very high70 Ų7024.6 Ų24.637%0.36616%0.163SC..Hα-helixtrans-63.5-40.7-177.8-71.9174.6000113.4T21 A22 Y64 T67T21-L25 HydrophobicContact CG2-CD1 3.93Å; T21-L25 HydrophobicContact CG2-CG 4.37Å; T21-L25 WeakPolarHBondContact O-CB 3.39Å; T21-L25 VanDerWaalsContact O-CG 3.32Å; T21-L25 WeakPolarHBondContact O-CG 3.42Å; T21-L25 PolarHBondContact O-N 2.67Å; A22-L25 PolarHBondContact O-N 3Å; L25-Y64 HydrophobicContact CD2-CD1 4.46Å; L25-Y64 HydrophobicContact CD2-CE1 4.35Å; L25-Y64 WeakPolarHBondContact O-CE1 3.36Å; L25-Y64 PolarHBondContact O-OH 3.38Å; L25-T67 HydrophobicContact CD2-CG2 3.7Å
26T93.2Very high92.2Very high49 Ų4924.8 Ų24.830%0.30116%0.164SC..Hα-helixtrans-79.4-29.3178.5540000112.4A22 C23 V24 A279 A282A22-T26 WeakPolarHBondContact O-CB 3.24Å; A22-T26 WeakPolarHBondContact O-CG2 3.34Å; A22-T26 PolarHBondContact O-N 3.35Å; A22-T26 PolarHBondContact O-OG1 3.33Å; C23-T26 PolarHBondContact O-OG1 3.28Å; V24-T26 PolarHBondContact O-N 2.91Å; T26-A279 WeakPolarHBondContact OG1-CA 2.97Å; T26-A282 HydrophobicContact CG2-CB 3.64Å; T26-A282 WeakPolarHBondContact OG1-CB 3.2Å
27G92.9Very high92.3Very high1 Ų124 Ų241%0.0115%0.152CC..Hα-helixtrans-80.3-27.5177.800000114.5C23 V24 F30 D31C23-G27 WeakPolarHBondContact O-CA 3.1Å; C23-G27 PolarHBondContact O-N 3.03Å; V24-G27 PolarHBondContact O-N 3.06Å; G27-F30 PolarHBondContact O-N 3.01Å; G27-F30 VanDerWaalsContact O-N 3.09Å; G27-D31 PolarHBondContact O-N 3.15Å
28Q93Very high92.3Very high0 Ų021.5 Ų21.50%013%0.13CC..Hα-helixtrans-56.9-42.8-171.3-17270.611.100114.1V24 F30 D31 T32 F63 Y64 K65 G66 T67V24-Q28 WeakPolarHBondContact O-CB 3.44Å; V24-Q28 PolarHBondContact O-N 3.28Å; Q28-F30 PolarHBondContact O-N 3.43Å; Q28-D31 PolarHBondContact O-N 2.88Å; Q28-T32 PolarHBondContact O-N 3.44Å; Q28-T32 PolarHBondContact O-OG1 2.92Å; Q28-T32 VanDerWaalsContact O-OG1 3.12Å; Q28-F63 WeakPolarHBondContact CG-O 3.48Å; Q28-Y64 HydrophobicContact CB-CD1 4.43Å; Q28-K65 PolarHBondContact NE2-O 3.04Å; Q28-G66 PolarHBondContact NE2-O 3.27Å; Q28-T67 WeakPolarHBondContact CG-OG1 3.38Å
29P94.2Very high92.1Very high21 Ų2120.2 Ų20.214%0.13612%0.118CC..Hα-helixtrans-56.2-41.3177.4-2736.2000112.7T32 M33 F63 Y64P29-T32 PolarHBondContact O-N 3.25Å; P29-M33 WeakPolarHBondContact O-CE 3.48Å; P29-M33 WeakPolarHBondContact O-CG 3.13Å; P29-M33 PolarHBondContact O-N 2.88Å; P29-F63 HydrophobicContact CB-CB 3.98Å; P29-F63 HydrophobicContact CB-CD1 4.04Å; P29-F63 HydrophobicContact CB-CG 4.27Å; P29-F63 HydrophobicContact CG-CB 4.22Å; P29-Y64 HydrophobicContact CG-CE2 4.08Å
30F93.7Very high92Very high42 Ų4220.8 Ų20.818%0.18412%0.121CC..Hα-helixtrans-72.4-37.1178.7-58.1-81.1000112.7G27 Q28 T32 M33 K34 P271 I274 R275 P278G27-F30 PolarHBondContact O-N 3.01Å; G27-F30 VanDerWaalsContact O-N 3.09Å; Q28-F30 PolarHBondContact O-N 3.43Å; F30-T32 VanDerWaalsContact C-N 3.31Å; F30-M33 HydrophobicContact CB-CE 4.36Å; F30-M33 HydrophobicContact CD1-CE 3.56Å; F30-M33 HydrophobicContact CE1-CE 4.04Å; F30-M33 HydrophobicContact CG-CE 4.1Å; F30-M33 PolarHBondContact O-N 2.92Å; F30-K34 WeakPolarHBondContact O-CB 3.38Å; F30-K34 PolarHBondContact O-N 3.38Å; F30-P271 HydrophobicContact CB-CB 4.34Å; F30-P271 HydrophobicContact CD1-CB 4.49Å; F30-I274 HydrophobicContact CD1-CB 4.34Å; F30-I274 HydrophobicContact CD1-CG2 4.1Å; F30-I274 HydrophobicContact CE1-CB 4.1Å; F30-I274 HydrophobicContact CE1-CG2 3.38Å; F30-I274 HydrophobicContact CZ-CG2 3.83Å; F30-R275 HydrophobicContact CB-CB 3.53Å; F30-R275 HydrophobicContact CB-CG 3.71Å; F30-R275 HydrophobicContact CD2-CB 4.03Å; F30-R275 HydrophobicContact CD2-CG 4.02Å; F30-R275 HydrophobicContact CG-CB 3.81Å; F30-R275 HydrophobicContact CG-CG 4.15Å; F30-P278 HydrophobicContact CD2-CG 4.42Å; F30-P278 HydrophobicContact CE2-CG 3.67Å; F30-P278 HydrophobicContact CZ-CG 4.17Å
31D91.6Very high91.6Very high28 Ų2821.8 Ų21.815%0.1513%0.125CC..Hα-helixtrans-62.1-42.2173-81-5.7000111.3G27 Q28 K34 V35 K131 R275G27-D31 PolarHBondContact O-N 3.15Å; Q28-D31 PolarHBondContact O-N 2.88Å; D31-K34 WeakPolarHBondContact O-CB 3.48Å; D31-K34 PolarHBondContact O-N 3.48Å; D31-V35 WeakPolarHBondContact O-CG2 3.45Å; D31-V35 PolarHBondContact O-N 2.98Å; D31-K131 IonicContact OD2-NZ 3.86Å; D31-K131 PolarHBondContact OD2-NZ 3.49Å; D31-R275 WeakPolarHBondContact OD1-CD 3.38Å; D31-R275 IonicContact OD1-NE 2.65Å; D31-R275 PolarHBondContact OD1-NE 2.88Å
32T92.3Very high91.2Very high0 Ų026.3 Ų26.30%015%0.147CC..Hα-helixtrans-62.9-45.4176.3-620000110.7Q28 P29 F30 K34 V35 K36 F63 Q135Q28-T32 PolarHBondContact O-N 3.44Å; Q28-T32 PolarHBondContact O-OG1 2.92Å; Q28-T32 VanDerWaalsContact O-OG1 3.12Å; P29-T32 PolarHBondContact O-N 3.25Å; F30-T32 VanDerWaalsContact C-N 3.31Å; T32-K34 PolarHBondContact O-N 3.49Å; T32-V35 PolarHBondContact O-N 2.99Å; T32-K36 HydrophobicContact CG2-CD 4.19Å; T32-K36 WeakPolarHBondContact O-CB 3.09Å; T32-K36 VanDerWaalsContact O-CG 3.28Å; T32-K36 WeakPolarHBondContact O-CG 3.3Å; T32-K36 PolarHBondContact O-N 3.07Å; T32-F63 PolarHBondContact OG1-O 3.13Å; T32-Q135 HydrophobicContact CG2-CB 4.35Å; T32-Q135 HydrophobicContact CG2-CG 4.28Å; T32-Q135 PolarHBondContact OG1-NE2 2.89Å; T32-Q135 VanDerWaalsContact OG1-NE2 3.11Å
33M92.5Very high90.8Very high11 Ų1128.1 Ų28.15%0.05415%0.153CC..Hα-helixtrans-62.3-41.1174.9-69.7-176.8-68.500112.1P29 F30 K36 M37 L47 C51 F63 P271P29-M33 WeakPolarHBondContact O-CE 3.48Å; P29-M33 WeakPolarHBondContact O-CG 3.13Å; P29-M33 PolarHBondContact O-N 2.88Å; F30-M33 HydrophobicContact CB-CE 4.36Å; F30-M33 HydrophobicContact CD1-CE 3.56Å; F30-M33 HydrophobicContact CE1-CE 4.04Å; F30-M33 HydrophobicContact CG-CE 4.1Å; F30-M33 PolarHBondContact O-N 2.92Å; M33-K36 PolarHBondContact O-N 2.65Å; M33-M37 WeakPolarHBondContact O-CB 3.23Å; M33-M37 VanDerWaalsContact O-CG 3.23Å; M33-M37 WeakPolarHBondContact O-CG 3.33Å; M33-M37 PolarHBondContact O-N 3.31Å; M33-L47 HydrophobicContact CB-CD1 3.97Å; M33-L47 HydrophobicContact CE-CD1 3.87Å; M33-L47 HydrophobicContact CG-CD1 4.32Å; M33-L47 HydrophobicContact SD-CD1 3.51Å; M33-L47 VanDerWaalsContact SD-CD1 3.51Å; M33-C51 HydrophobicContact SD-CB 3.77Å; M33-F63 HydrophobicContact CG-CD1 4.45Å; M33-F63 HydrophobicContact CG-CE1 4.1Å; M33-F63 HydrophobicContact SD-CE1 4.11Å; M33-P271 HydrophobicContact CB-CB 4.31Å
34K92.8Very high90.6Very high25 Ų2527.8 Ų27.811%0.10915%0.149CC..Hα-helixtrans-55.4-57.2175174.3-166.6175-1790110.5F30 D31 T32 K36 M37 Q38 Y228 D231 P271F30-K34 WeakPolarHBondContact O-CB 3.38Å; F30-K34 PolarHBondContact O-N 3.38Å; D31-K34 WeakPolarHBondContact O-CB 3.48Å; D31-K34 PolarHBondContact O-N 3.48Å; T32-K34 PolarHBondContact O-N 3.49Å; K34-K36 VanDerWaalsContact C-N 3.33Å; K34-K36 PolarHBondContact O-N 2.76Å; K34-M37 PolarHBondContact O-N 2.9Å; K34-Q38 VanDerWaalsContact CE-NE2 3.31Å; K34-Q38 HydrophobicContact CG-CG 4.43Å; K34-Q38 WeakPolarHBondContact O-CB 3.26Å; K34-Q38 VanDerWaalsContact O-CG 3.28Å; K34-Q38 WeakPolarHBondContact O-CG 3.38Å; K34-Q38 PolarHBondContact O-N 2.9Å; K34-Y228 WeakPolarHBondContact CE-OH 3.4Å; K34-D231 IonicContact NZ-OD2 2.73Å; K34-D231 PolarHBondContact NZ-OD2 3.24Å; K34-P271 HydrophobicContact CB-CG 4.32Å
35V92.1Very high90.2Very high10 Ų1038.5 Ų38.56%0.06119%0.188CC..Hα-helixtrans-64.9-38.7-174.5176.30000111.3D31 T32 Q38 T39 C132 Q135 T136 V239D31-V35 WeakPolarHBondContact O-CG2 3.45Å; D31-V35 PolarHBondContact O-N 2.98Å; T32-V35 PolarHBondContact O-N 2.99Å; V35-Q38 PolarHBondContact O-N 3.36Å; V35-T39 WeakPolarHBondContact O-CB 3.12Å; V35-T39 PolarHBondContact O-N 3.24Å; V35-T39 PolarHBondContact O-OG1 2.92Å; V35-C132 HydrophobicContact CG1-CB 4.14Å; V35-Q135 HydrophobicContact CG1-CB 4.44Å; V35-Q135 VanDerWaalsContact CG2-OE1 3.3Å; V35-T136 HydrophobicContact CG1-CG2 3.77Å; V35-V239 HydrophobicContact CG1-CG2 4.43Å
36K91.6Very high89.9Confident3 Ų336 Ų361%0.01318%0.179CC..Hα-helixtrans-61.5-48.3174.4-75-176.5178.3-157.80112.6T32 M33 K34 Q38 T39 F40 Y44 T54 Q135 T136 E139T32-K36 HydrophobicContact CG2-CD 4.19Å; T32-K36 WeakPolarHBondContact O-CB 3.09Å; T32-K36 VanDerWaalsContact O-CG 3.28Å; T32-K36 WeakPolarHBondContact O-CG 3.3Å; T32-K36 PolarHBondContact O-N 3.07Å; M33-K36 PolarHBondContact O-N 2.65Å; K34-K36 VanDerWaalsContact C-N 3.33Å; K34-K36 PolarHBondContact O-N 2.76Å; K36-Q38 VanDerWaalsContact C-N 3.31Å; K36-Q38 PolarHBondContact O-N 3.5Å; K36-T39 PolarHBondContact O-N 2.85Å; K36-F40 PolarHBondContact O-N 3.37Å; K36-Y44 HydrophobicContact CB-CD2 4.41Å; K36-Y44 HydrophobicContact CB-CE2 3.79Å; K36-T54 VanDerWaalsContact NZ-CG2 3.31Å; K36-T54 PolarHBondContact NZ-OG1 3.22Å; K36-Q135 WeakPolarHBondContact CE-O 3.48Å; K36-T136 HydrophobicContact CG-CG2 4.41Å; K36-E139 WeakPolarHBondContact CE-OE1 3.26Å; K36-E139 IonicContact NZ-OE1 2.59Å; K36-E139 PolarHBondContact NZ-OE1 2.93Å; K36-E139 IonicContact NZ-OE2 3.22Å
37M91.2Very high89.8Confident18 Ų1835.2 Ų35.29%0.08917%0.173CC..Hα-helixtrans-65.6-33177.5-71.5-179.568.500112.9M33 K34 L47 C50 S267 P271M33-M37 WeakPolarHBondContact O-CB 3.23Å; M33-M37 VanDerWaalsContact O-CG 3.23Å; M33-M37 WeakPolarHBondContact O-CG 3.33Å; M33-M37 PolarHBondContact O-N 3.31Å; K34-M37 PolarHBondContact O-N 2.9Å; M37-L47 HydrophobicContact SD-CB 4.43Å; M37-L47 HydrophobicContact SD-CD1 4.36Å; M37-C50 HydrophobicContact CG-CB 3.96Å; M37-C50 HydrophobicContact SD-CB 4.27Å; M37-S267 PolarHBondContact O-OG 2.88Å; M37-P271 HydrophobicContact SD-CG 4.05Å
38Q89.7Confident89.7Confident2 Ų240.9 Ų40.91%0.00921%0.208CC..Hα-helixtrans-71.9-32.1176.3-76.3-179.9-23.100112.4K34 V35 K36 Y228 C232 S235 R236 S267K34-Q38 VanDerWaalsContact CE-NE2 3.31Å; K34-Q38 HydrophobicContact CG-CG 4.43Å; K34-Q38 WeakPolarHBondContact O-CB 3.26Å; K34-Q38 VanDerWaalsContact O-CG 3.28Å; K34-Q38 WeakPolarHBondContact O-CG 3.38Å; K34-Q38 PolarHBondContact O-N 2.9Å; V35-Q38 PolarHBondContact O-N 3.36Å; K36-Q38 VanDerWaalsContact C-N 3.31Å; K36-Q38 PolarHBondContact O-N 3.5Å; Q38-Y228 PolarHBondContact NE2-OH 2.9Å; Q38-C232 HydrophobicContact CG-CB 4.46Å; Q38-S235 WeakPolarHBondContact CB-OG 3.34Å; Q38-S235 PolarHBondContact OE1-OG 2.96Å; Q38-S235 VanDerWaalsContact OE1-OG 3.1Å; Q38-R236 PolarHBondContact O-NE 3.02Å; Q38-R236 PolarHBondContact O-NH2 2.62Å; Q38-S267 WeakPolarHBondContact CG-O 3.33Å; Q38-S267 PolarHBondContact NE2-O 3.44Å
39T88Confident89.6Confident10 Ų1042.7 Ų42.76%0.06122%0.217CC..Hα-helixtrans-91.4-34.6-174.8-52.20000112.8V35 K36 P41 V239V35-T39 WeakPolarHBondContact O-CB 3.12Å; V35-T39 PolarHBondContact O-N 3.24Å; V35-T39 PolarHBondContact O-OG1 2.92Å; K36-T39 PolarHBondContact O-N 2.85Å; T39-P41 VanDerWaalsContact C-CD 3.48Å; T39-P41 WeakPolarHBondContact O-CD 3.21Å; T39-V239 HydrophobicContact CG2-CB 3.73Å; T39-V239 HydrophobicContact CG2-CG1 3.59Å; T39-V239 HydrophobicContact CG2-CG2 4.17Å
40F88.8Confident89.5Confident13 Ų1341.7 Ų41.76%0.05721%0.211CC..  trans-125.868.3-175.6-51.7-79.3000110.9K36 D42 L43 Y44 T136 E139 M140K36-F40 PolarHBondContact O-N 3.37Å; F40-D42 VanDerWaalsContact C-N 3.27Å; F40-D42 PolarHBondContact O-N 3.48Å; F40-L43 HydrophobicContact CB-CB 3.76Å; F40-L43 HydrophobicContact CB-CD2 4.29Å; F40-L43 PolarHBondContact O-N 2.92Å; F40-Y44 HydrophobicContact CB-CD2 4.23Å; F40-Y44 HydrophobicContact CB-CE2 4.11Å; F40-Y44 HydrophobicContact CD2-CE2 4.49Å; F40-Y44 WeakPolarHBondContact O-CD2 3.14Å; F40-T136 HydrophobicContact CE2-CG2 3.85Å; F40-E139 HydrophobicContact CD2-CB 3.89Å; F40-E139 HydrophobicContact CD2-CG 4.1Å; F40-E139 HydrophobicContact CE1-CB 4.21Å; F40-E139 HydrophobicContact CE2-CB 3.38Å; F40-E139 HydrophobicContact CE2-CG 3.99Å; F40-E139 HydrophobicContact CG-CB 4.49Å; F40-E139 HydrophobicContact CZ-CB 3.56Å; F40-M140 HydrophobicContact CE1-SD 3.91Å; F40-M140 HydrophobicContact CZ-CG 3.9Å; F40-M140 HydrophobicContact CZ-SD 3.65Å
41P82.1Confident89.4Confident35 Ų3542.1 Ų42.123%0.22722%0.218CC..THydrogen-bonded Turntrans-59.5-38.2-178.527.2-37.2000112.2T39 L43 E260T39-P41 VanDerWaalsContact C-CD 3.48Å; T39-P41 WeakPolarHBondContact O-CD 3.21Å; P41-L43 VanDerWaalsContact C-N 3.29Å; P41-L43 PolarHBondContact O-N 3.01Å; P41-E260 WeakPolarHBondContact CG-OE2 3.26Å
42D84.5Confident89.5Confident155 Ų15546.4 Ų46.483%0.82924%0.241SC*.THydrogen-bonded Turntrans-73.2-22.4-178.4-53.2-44.3000113F40F40-D42 VanDerWaalsContact C-N 3.27Å; F40-D42 PolarHBondContact O-N 3.48Å
43L85.9Confident89.5Confident63 Ų6349.1 Ų49.133%0.3325%0.252SS..THydrogen-bonded Turntrans-81.4-26.9-177.4-172.159.7000112.1F40 P41 K53 E139F40-L43 HydrophobicContact CB-CB 3.76Å; F40-L43 HydrophobicContact CB-CD2 4.29Å; F40-L43 PolarHBondContact O-N 2.92Å; P41-L43 VanDerWaalsContact C-N 3.29Å; P41-L43 PolarHBondContact O-N 3.01Å; L43-K53 PolarHBondContact O-NZ 3.38Å; L43-E139 HydrophobicContact CD2-CG 4.07Å
44Y86.8Confident89.3Confident11 Ų1148.6 Ų48.64%0.04325%0.25CC..  trans-125.5115.5-171.5-58.4-64.1000111.5K36 F40 G46 D49 C50 K53 E139K36-Y44 HydrophobicContact CB-CD2 4.41Å; K36-Y44 HydrophobicContact CB-CE2 3.79Å; F40-Y44 HydrophobicContact CB-CD2 4.23Å; F40-Y44 HydrophobicContact CB-CE2 4.11Å; F40-Y44 HydrophobicContact CD2-CE2 4.49Å; F40-Y44 WeakPolarHBondContact O-CD2 3.14Å; Y44-G46 PolarHBondContact O-N 2.92Å; Y44-D49 WeakPolarHBondContact CA-OD2 3.17Å; Y44-C50 VanDerWaalsContact CD1-CA 3.45Å; Y44-C50 HydrophobicContact CD1-CB 3.79Å; Y44-C50 HydrophobicContact CE1-CB 4.35Å; Y44-C50 HydrophobicContact CG-CB 3.94Å; Y44-K53 HydrophobicContact CD1-CB 4.46Å; Y44-K53 HydrophobicContact CD1-CD 3.87Å; Y44-K53 HydrophobicContact CE1-CB 3.92Å; Y44-K53 HydrophobicContact CE1-CD 3.92Å; Y44-E139 VanDerWaalsContact OH-CG 3.24Å; Y44-E139 WeakPolarHBondContact OH-CG 3.41Å; Y44-E139 PolarHBondContact OH-OE1 3.34Å; Y44-E139 VanDerWaalsContact OH-OE1 3.07Å
45R84.2Confident89.3Confident241 Ų24154.2 Ų54.291%0.90927%0.271SS*.SBendtrans-72.6-14.8179.3-65.4-177.5178.7179.8-0.6113.5D49R45-D49 HydrophobicContact CB-CB 4.41Å; R45-D49 PolarHBondContact N-OD2 3Å
46G88Confident89.2Confident19 Ų1957.9 Ų57.920%0.19630%0.298CS..SBendtrans171.7-174.8-178.400000112.4Y44 T48 D49 C50Y44-G46 PolarHBondContact O-N 2.92Å; G46-T48 PolarHBondContact O-N 3.11Å; G46-D49 PolarHBondContact O-N 3.4Å; G46-C50 WeakPolarHBondContact O-CB 3.33Å; G46-C50 PolarHBondContact O-N 3.27Å
47L89.2Confident89Confident32 Ų3261.2 Ų61.217%0.16831%0.313CS..Hα-helixtrans-62.3-44.8-176.4179.360.3000112.8M33 M37 C50 C51 P271 I274M33-L47 HydrophobicContact CB-CD1 3.97Å; M33-L47 HydrophobicContact CE-CD1 3.87Å; M33-L47 HydrophobicContact CG-CD1 4.32Å; M33-L47 HydrophobicContact SD-CD1 3.51Å; M33-L47 VanDerWaalsContact SD-CD1 3.51Å; M37-L47 HydrophobicContact SD-CB 4.43Å; M37-L47 HydrophobicContact SD-CD1 4.36Å; L47-C50 PolarHBondContact O-N 2.92Å; L47-C51 WeakPolarHBondContact O-CB 2.99Å; L47-C51 PolarHBondContact O-N 3.44Å; L47-P271 HydrophobicContact CD1-CB 3.66Å; L47-P271 HydrophobicContact CD1-CG 3.87Å; L47-I274 HydrophobicContact CD2-CD1 3.47Å; L47-I274 VanDerWaalsContact CD2-CD1 3.47Å
48T90.7Very high88.8Confident120 Ų12062 Ų6274%0.73632%0.319SS*.Hα-helixtrans-66.9-42.1-178.750.50000111.7G46 C51 L52G46-T48 PolarHBondContact O-N 3.11Å; T48-C51 WeakPolarHBondContact O-CB 3.33Å; T48-C51 PolarHBondContact O-N 2.7Å; T48-L52 WeakPolarHBondContact O-CB 3.34Å; T48-L52 PolarHBondContact O-N 2.85Å
49D91.8Very high88.8Confident37 Ų3763 Ų6320%0.19833%0.329CS..Hα-helixtrans-63.5-43.7174.1-176.548.9000111.4Y44 R45 G46 C51 L52 K53Y44-D49 WeakPolarHBondContact CA-OD2 3.17Å; R45-D49 HydrophobicContact CB-CB 4.41Å; R45-D49 PolarHBondContact N-OD2 3Å; G46-D49 PolarHBondContact O-N 3.4Å; D49-C51 VanDerWaalsContact C-N 3.32Å; D49-C51 PolarHBondContact O-N 3.31Å; D49-L52 PolarHBondContact O-N 3.03Å; D49-K53 VanDerWaalsContact O-CB 3.3Å; D49-K53 WeakPolarHBondContact O-CB 3.35Å; D49-K53 WeakPolarHBondContact O-CG 3.18Å; D49-K53 PolarHBondContact O-N 3.19Å; D49-K53 WeakPolarHBondContact OD1-CE 3.36Å; D49-K53 IonicContact OD1-NZ 3.87Å; D49-K53 PolarHBondContact OD1-NZ 3.12Å; D49-K53 IonicContact OD2-NZ 3.89Å; D49-K53 PolarHBondContact OD2-NZ 2.83Å
50C91.2Very high88.8Confident0 Ų068.8 Ų68.80%035%0.354CS..Hα-helixtrans-60.3-41.5174.3-175.20000112.4M37 Y44 G46 L47 T54M37-C50 HydrophobicContact CG-CB 3.96Å; M37-C50 HydrophobicContact SD-CB 4.27Å; Y44-C50 VanDerWaalsContact CD1-CA 3.45Å; Y44-C50 HydrophobicContact CD1-CB 3.79Å; Y44-C50 HydrophobicContact CE1-CB 4.35Å; Y44-C50 HydrophobicContact CG-CB 3.94Å; G46-C50 WeakPolarHBondContact O-CB 3.33Å; G46-C50 PolarHBondContact O-N 3.27Å; L47-C50 PolarHBondContact O-N 2.92Å; C50-T54 WeakPolarHBondContact O-CB 3.28Å; C50-T54 PolarHBondContact O-N 2.79Å; C50-T54 PolarHBondContact O-OG1 3.28Å
51C92.4Very high88.8Confident51 Ų5178.4 Ų78.435%0.34539%0.39SS..Hα-helixtrans-63.7-53.4176.8-1740000110.9M33 L47 T48 D49 K53 T54 Y55 F63M33-C51 HydrophobicContact SD-CB 3.77Å; L47-C51 WeakPolarHBondContact O-CB 2.99Å; L47-C51 PolarHBondContact O-N 3.44Å; T48-C51 WeakPolarHBondContact O-CB 3.33Å; T48-C51 PolarHBondContact O-N 2.7Å; D49-C51 VanDerWaalsContact C-N 3.32Å; D49-C51 PolarHBondContact O-N 3.31Å; C51-K53 PolarHBondContact O-N 2.97Å; C51-T54 PolarHBondContact O-N 2.98Å; C51-Y55 WeakPolarHBondContact O-CB 3.41Å; C51-Y55 PolarHBondContact O-N 3.21Å; C51-F63 WeakPolarHBondContact O-CZ 3.48Å
52L93.6Very high89Confident118 Ų11876.9 Ų76.962%0.61838%0.38SS*.Hα-helixtrans-62.7-44.6-176.8-174.663.9000111.9T48 D49 Y55 S56T48-L52 WeakPolarHBondContact O-CB 3.34Å; T48-L52 PolarHBondContact O-N 2.85Å; D49-L52 PolarHBondContact O-N 3.03Å; L52-Y55 PolarHBondContact O-N 3.31Å; L52-S56 WeakPolarHBondContact O-CB 3.46Å; L52-S56 PolarHBondContact O-N 3.13Å; L52-S56 PolarHBondContact O-OG 2.75Å
53K91.9Very high89.3Confident57 Ų5770.1 Ų70.125%0.24834%0.344CS..Hα-helixtrans-63.7-42.7175.6-76.8173.1174.61620112.1L43 Y44 D49 C51 Y55 S56 Q57L43-K53 PolarHBondContact O-NZ 3.38Å; Y44-K53 HydrophobicContact CD1-CB 4.46Å; Y44-K53 HydrophobicContact CD1-CD 3.87Å; Y44-K53 HydrophobicContact CE1-CB 3.92Å; Y44-K53 HydrophobicContact CE1-CD 3.92Å; D49-K53 VanDerWaalsContact O-CB 3.3Å; D49-K53 WeakPolarHBondContact O-CB 3.35Å; D49-K53 WeakPolarHBondContact O-CG 3.18Å; D49-K53 PolarHBondContact O-N 3.19Å; D49-K53 WeakPolarHBondContact OD1-CE 3.36Å; D49-K53 IonicContact OD1-NZ 3.87Å; D49-K53 PolarHBondContact OD1-NZ 3.12Å; D49-K53 IonicContact OD2-NZ 3.89Å; D49-K53 PolarHBondContact OD2-NZ 2.83Å; C51-K53 PolarHBondContact O-N 2.97Å; K53-Y55 VanDerWaalsContact C-N 3.31Å; K53-Y55 PolarHBondContact O-N 2.99Å; K53-S56 WeakPolarHBondContact CA-OG 3.15Å; K53-S56 PolarHBondContact O-N 3.27Å; K53-S56 PolarHBondContact O-OG 2.76Å; K53-S56 VanDerWaalsContact O-OG 3.14Å; K53-Q57 WeakPolarHBondContact O-CB 3.1Å; K53-Q57 WeakPolarHBondContact O-CG 3.13Å; K53-Q57 PolarHBondContact O-N 3.22Å; K53-Q57 PolarHBondContact O-OE1 3.38Å
54T89.5Confident89.5Confident0 Ų070.7 Ų70.70%034%0.342CS..Hα-helixtrans-62.2-43.1177.4-65.30000111K36 C50 C51 V58 G59 F63K36-T54 VanDerWaalsContact NZ-CG2 3.31Å; K36-T54 PolarHBondContact NZ-OG1 3.22Å; C50-T54 WeakPolarHBondContact O-CB 3.28Å; C50-T54 PolarHBondContact O-N 2.79Å; C50-T54 PolarHBondContact O-OG1 3.28Å; C51-T54 PolarHBondContact O-N 2.98Å; T54-V58 PolarHBondContact O-N 3.09Å; T54-G59 PolarHBondContact O-N 2.83Å; T54-F63 HydrophobicContact CG2-CD1 4.02Å; T54-F63 HydrophobicContact CG2-CD2 4.28Å; T54-F63 HydrophobicContact CG2-CE1 3.73Å; T54-F63 HydrophobicContact CG2-CE2 4.01Å; T54-F63 HydrophobicContact CG2-CG 4.29Å; T54-F63 HydrophobicContact CG2-CZ 3.73Å
55Y91.9Very high89.5Confident143 Ų14372 Ų7256%0.56135%0.348SS*.Hα-helixtrans-65.5-45.1177.3-177-100.6000112C51 L52 K53 Q57 G59 F63C51-Y55 WeakPolarHBondContact O-CB 3.41Å; C51-Y55 PolarHBondContact O-N 3.21Å; L52-Y55 PolarHBondContact O-N 3.31Å; K53-Y55 VanDerWaalsContact C-N 3.31Å; K53-Y55 PolarHBondContact O-N 2.99Å; Y55-Q57 PolarHBondContact O-N 3.13Å; Y55-G59 WeakPolarHBondContact O-CA 3.27Å; Y55-G59 PolarHBondContact O-N 2.79Å; Y55-F63 HydrophobicContact CD2-CE2 4.37Å
56S90.3Very high89.6Confident88 Ų8860.8 Ų60.862%0.61531%0.307SS*.Hα-helixtrans-69.9-32.1-179.366.60000113.3L52 K53L52-S56 WeakPolarHBondContact O-CB 3.46Å; L52-S56 PolarHBondContact O-N 3.13Å; L52-S56 PolarHBondContact O-OG 2.75Å; K53-S56 WeakPolarHBondContact CA-OG 3.15Å; K53-S56 PolarHBondContact O-N 3.27Å; K53-S56 PolarHBondContact O-OG 2.76Å; K53-S56 VanDerWaalsContact O-OG 3.14Å
57Q88.2Confident89.7Confident72 Ų7260.7 Ų60.734%0.33630%0.303SS..Hα-helixtrans-88.6-38.8-174.8-71.7174-14.400114.1K53 Y55 Y138K53-Q57 WeakPolarHBondContact O-CB 3.1Å; K53-Q57 WeakPolarHBondContact O-CG 3.13Å; K53-Q57 PolarHBondContact O-N 3.22Å; K53-Q57 PolarHBondContact O-OE1 3.38Å; Y55-Q57 PolarHBondContact O-N 3.13Å; Q57-Y138 HydrophobicContact CB-CD1 4.42Å; Q57-Y138 HydrophobicContact CB-CE1 3.55Å; Q57-Y138 HydrophobicContact CG-CE1 4.05Å
58V86Confident89.8Confident35 Ų3562.5 Ų62.521%0.21232%0.318CS..Hα-helixtrans-124.5-12.7-172.6-166.80000112.1T54 G62 Y138T54-V58 PolarHBondContact O-N 3.09Å; V58-G62 VanDerWaalsContact CG1-CA 3.48Å; V58-Y138 HydrophobicContact CG2-CD1 3.63Å; V58-Y138 HydrophobicContact CG2-CD2 3.7Å; V58-Y138 HydrophobicContact CG2-CE1 4.02Å; V58-Y138 HydrophobicContact CG2-CE2 4.03Å; V58-Y138 HydrophobicContact CG2-CG 3.47Å; V58-Y138 VanDerWaalsContact CG2-CG 3.47Å
59G89.7Confident89.8Confident22 Ų2257 Ų5723%0.22729%0.285CS..  trans70.1-167.2-173.900000113T54 Y55 R61 G62T54-G59 PolarHBondContact O-N 2.83Å; Y55-G59 WeakPolarHBondContact O-CA 3.27Å; Y55-G59 PolarHBondContact O-N 2.79Å; G59-R61 PolarHBondContact O-N 3.1Å; G59-G62 PolarHBondContact O-N 3.32Å
60F88.7Confident89.8Confident132 Ų13255.6 Ų55.658%0.57928%0.278SS*.Hα-helixtrans-59.1-33.5-176.9-168.5-103.3000113.5G62 F63 Y64F60-G62 PolarHBondContact O-N 3.38Å; F60-F63 PolarHBondContact O-N 3.27Å; F60-Y64 HydrophobicContact CD1-CD2 4.17Å; F60-Y64 HydrophobicContact CD1-CE2 4.12Å; F60-Y64 AromaticContact CE1-CD2 3.78Å; F60-Y64 HydrophobicContact CE1-CD2 3.78Å; F60-Y64 AromaticContact CE1-CE2 3.36Å; F60-Y64 HydrophobicContact CE1-CE2 3.36Å; F60-Y64 AromaticContact CE2-CE2 3.97Å; F60-Y64 HydrophobicContact CE2-CE2 3.97Å; F60-Y64 HydrophobicContact CZ-CD2 4.14Å; F60-Y64 AromaticContact CZ-CE2 3.29Å; F60-Y64 HydrophobicContact CZ-CE2 3.29Å; F60-Y64 AromaticContact CZ-CZ 3.97Å
61R87.4Confident89.8Confident216 Ų21657.7 Ų57.782%0.81529%0.289SS*.Hα-helixtrans-60.9-26.7177.1-69.4-178.1175.3-179.7-1.4112.8G59 F63 Y64 K65G59-R61 PolarHBondContact O-N 3.1Å; R61-F63 VanDerWaalsContact C-N 3.32Å; R61-F63 PolarHBondContact O-N 2.95Å; R61-Y64 PolarHBondContact O-N 2.97Å; R61-K65 PolarHBondContact O-N 3.44Å
62G86.9Confident89.8Confident2 Ų259.9 Ų59.92%0.02130%0.296CS..Hα-helixtrans-60.6-39.7177.600000112.8V58 G59 F60 Y64 K65V58-G62 VanDerWaalsContact CG1-CA 3.48Å; G59-G62 PolarHBondContact O-N 3.32Å; F60-G62 PolarHBondContact O-N 3.38Å; G62-Y64 VanDerWaalsContact C-N 3.32Å; G62-Y64 PolarHBondContact O-N 2.89Å; G62-K65 PolarHBondContact O-N 3.4Å
63F89.8Confident89.7Confident14 Ų1454.7 Ų54.76%0.06127%0.271CS..Hα-helixtrans-67.8-31.3-178.7-67.2-74000113.3Q28 P29 T32 M33 C51 T54 Y55 F60 R61Q28-F63 WeakPolarHBondContact CG-O 3.48Å; P29-F63 HydrophobicContact CB-CB 3.98Å; P29-F63 HydrophobicContact CB-CD1 4.04Å; P29-F63 HydrophobicContact CB-CG 4.27Å; P29-F63 HydrophobicContact CG-CB 4.22Å; T32-F63 PolarHBondContact OG1-O 3.13Å; M33-F63 HydrophobicContact CG-CD1 4.45Å; M33-F63 HydrophobicContact CG-CE1 4.1Å; M33-F63 HydrophobicContact SD-CE1 4.11Å; C51-F63 WeakPolarHBondContact O-CZ 3.48Å; T54-F63 HydrophobicContact CG2-CD1 4.02Å; T54-F63 HydrophobicContact CG2-CD2 4.28Å; T54-F63 HydrophobicContact CG2-CE1 3.73Å; T54-F63 HydrophobicContact CG2-CE2 4.01Å; T54-F63 HydrophobicContact CG2-CG 4.29Å; T54-F63 HydrophobicContact CG2-CZ 3.73Å; Y55-F63 HydrophobicContact CD2-CE2 4.37Å; F60-F63 PolarHBondContact O-N 3.27Å; R61-F63 VanDerWaalsContact C-N 3.32Å; R61-F63 PolarHBondContact O-N 2.95Å
64Y91.1Very high89.5Confident75 Ų7554.5 Ų54.529%0.29427%0.273SS..THydrogen-bonded Turntrans-97.19.2-178.2-68.9-92.5000113.2L25 Q28 P29 F60 R61 G62 G66 T67L25-Y64 HydrophobicContact CD2-CD1 4.46Å; L25-Y64 HydrophobicContact CD2-CE1 4.35Å; L25-Y64 WeakPolarHBondContact O-CE1 3.36Å; L25-Y64 PolarHBondContact O-OH 3.38Å; Q28-Y64 HydrophobicContact CB-CD1 4.43Å; P29-Y64 HydrophobicContact CG-CE2 4.08Å; F60-Y64 HydrophobicContact CD1-CD2 4.17Å; F60-Y64 HydrophobicContact CD1-CE2 4.12Å; F60-Y64 AromaticContact CE1-CD2 3.78Å; F60-Y64 HydrophobicContact CE1-CD2 3.78Å; F60-Y64 AromaticContact CE1-CE2 3.36Å; F60-Y64 HydrophobicContact CE1-CE2 3.36Å; F60-Y64 AromaticContact CE2-CE2 3.97Å; F60-Y64 HydrophobicContact CE2-CE2 3.97Å; F60-Y64 HydrophobicContact CZ-CD2 4.14Å; F60-Y64 AromaticContact CZ-CE2 3.29Å; F60-Y64 HydrophobicContact CZ-CE2 3.29Å; F60-Y64 AromaticContact CZ-CZ 3.97Å; R61-Y64 PolarHBondContact O-N 2.97Å; G62-Y64 VanDerWaalsContact C-N 3.32Å; G62-Y64 PolarHBondContact O-N 2.89Å; Y64-G66 PolarHBondContact O-N 3.5Å; Y64-T67 PolarHBondContact O-N 3.26Å; Y64-T67 PolarHBondContact O-OG1 2.86Å
65K86.6Confident89.4Confident37 Ų3759.8 Ų59.816%0.16130%0.299CS..THydrogen-bonded Turntrans-63.6126.3168.3-77.1-169.5177.5-177.60108.8Q28 R61 G62 L134 Q135 N151Q28-K65 PolarHBondContact NE2-O 3.04Å; R61-K65 PolarHBondContact O-N 3.44Å; G62-K65 PolarHBondContact O-N 3.4Å; K65-L134 WeakPolarHBondContact CD-O 3.35Å; K65-Q135 VanDerWaalsContact O-CG 3.23Å; K65-Q135 WeakPolarHBondContact O-CG 2.82Å; K65-N151 VanDerWaalsContact NZ-CG 3.27Å; K65-N151 PolarHBondContact NZ-OD1 3.27Å
66G86.3Confident89.3Confident6 Ų653.9 Ų53.96%0.06228%0.28CS..THydrogen-bonded Turntrans915.9-178.100000115.5Q28 Y64 S68 P69 A70Q28-G66 PolarHBondContact NE2-O 3.27Å; Y64-G66 PolarHBondContact O-N 3.5Å; G66-S68 PolarHBondContact O-N 2.98Å; G66-P69 VanDerWaalsContact O-CD 3.28Å; G66-P69 WeakPolarHBondContact O-CD 3.3Å; G66-P69 VanDerWaalsContact O-CG 3.27Å; G66-P69 WeakPolarHBondContact O-CG 3.08Å; G66-A70 VanDerWaalsContact O-CB 3.31Å; G66-A70 WeakPolarHBondContact O-CB 3.28Å; G66-A70 PolarHBondContact O-N 3.34Å
67T90.3Very high89.2Confident18 Ų1851.8 Ų51.811%0.1126%0.261CS..Hα-helixtrans-58.7-46.3175.2-560000112V24 L25 Q28 Y64 A70 L71V24-T67 HydrophobicContact CG1-CG2 4.3Å; L25-T67 HydrophobicContact CD2-CG2 3.7Å; Q28-T67 WeakPolarHBondContact CG-OG1 3.38Å; Y64-T67 PolarHBondContact O-N 3.26Å; Y64-T67 PolarHBondContact O-OG1 2.86Å; T67-A70 WeakPolarHBondContact O-CB 3.32Å; T67-A70 PolarHBondContact O-N 2.99Å; T67-A70 VanDerWaalsContact O-N 3.17Å; T67-L71 HydrophobicContact CG2-CD1 4.04Å; T67-L71 HydrophobicContact CG2-CG 4.37Å; T67-L71 WeakPolarHBondContact O-CG 3.4Å; T67-L71 PolarHBondContact O-N 3.09Å
68S91.6Very high89.1Confident69 Ų6951.5 Ų51.548%0.48326%0.262SS..Hα-helixtrans-59.7-52.5-179.4-47.80000113G66 A70 L71 I72G66-S68 PolarHBondContact O-N 2.98Å; S68-A70 VanDerWaalsContact C-N 3.25Å; S68-A70 PolarHBondContact O-N 3.29Å; S68-L71 PolarHBondContact O-N 3.3Å; S68-I72 WeakPolarHBondContact O-CG1 3.42Å; S68-I72 PolarHBondContact O-N 2.79Å
69P90.9Very high89.1Confident5 Ų553.2 Ų53.23%0.03228%0.275CS..Hα-helixtrans-64.2-29.517522.9-31.9000112.8G66 A73 V130 K131 L134G66-P69 VanDerWaalsContact O-CD 3.28Å; G66-P69 WeakPolarHBondContact O-CD 3.3Å; G66-P69 VanDerWaalsContact O-CG 3.27Å; G66-P69 WeakPolarHBondContact O-CG 3.08Å; P69-A73 WeakPolarHBondContact O-CB 3.22Å; P69-A73 PolarHBondContact O-N 3.26Å; P69-V130 HydrophobicContact CB-CB 4.45Å; P69-V130 HydrophobicContact CB-CG1 4.3Å; P69-V130 HydrophobicContact CG-CG1 4.29Å; P69-K131 HydrophobicContact CB-CB 4.25Å; P69-K131 HydrophobicContact CG-CB 4.04Å; P69-L134 HydrophobicContact CG-CD1 4.03Å
70A90.9Very high89Confident8 Ų853 Ų537%0.06627%0.269CS..Hα-helixtrans-66.2-41.8174.200000112.8V24 G66 T67 S68 A73 N74 K131V24-A70 HydrophobicContact CG1-CB 3.81Å; G66-A70 VanDerWaalsContact O-CB 3.31Å; G66-A70 WeakPolarHBondContact O-CB 3.28Å; G66-A70 PolarHBondContact O-N 3.34Å; T67-A70 WeakPolarHBondContact O-CB 3.32Å; T67-A70 PolarHBondContact O-N 2.99Å; T67-A70 VanDerWaalsContact O-N 3.17Å; S68-A70 VanDerWaalsContact C-N 3.25Å; S68-A70 PolarHBondContact O-N 3.29Å; A70-A73 WeakPolarHBondContact O-CB 3.32Å; A70-A73 PolarHBondContact O-N 3.33Å; A70-N74 PolarHBondContact O-N 2.86Å; A70-K131 HydrophobicContact CB-CD 3.98Å
71L91.9Very high88.8Confident43 Ų4348.5 Ų48.523%0.22525%0.251CS..Hα-helixtrans-64.4-45.8174.9-72.2170000111.2T21 V24 T67 S68 A73 N74 I75T21-L71 HydrophobicContact CG2-CD2 4.19Å; V24-L71 HydrophobicContact CB-CD2 3.65Å; V24-L71 HydrophobicContact CB-CG 4.32Å; V24-L71 HydrophobicContact CG1-CD2 3.79Å; V24-L71 HydrophobicContact CG1-CG 3.88Å; V24-L71 HydrophobicContact CG2-CD2 3.93Å; T67-L71 HydrophobicContact CG2-CD1 4.04Å; T67-L71 HydrophobicContact CG2-CG 4.37Å; T67-L71 WeakPolarHBondContact O-CG 3.4Å; T67-L71 PolarHBondContact O-N 3.09Å; S68-L71 PolarHBondContact O-N 3.3Å; L71-A73 VanDerWaalsContact C-N 3.32Å; L71-A73 PolarHBondContact O-N 3.03Å; L71-N74 PolarHBondContact O-N 3.21Å; L71-I75 WeakPolarHBondContact O-CG1 3.37Å; L71-I75 PolarHBondContact O-N 3.01Å
72I92Very high88.6Confident97 Ų9745.9 Ų45.950%0.49725%0.246SC..Hα-helixtrans-61.4-44177-65167.3000110.3S68 N74 I75 A76 T127S68-I72 WeakPolarHBondContact O-CG1 3.42Å; S68-I72 PolarHBondContact O-N 2.79Å; I72-N74 VanDerWaalsContact C-N 3.33Å; I72-N74 PolarHBondContact O-N 2.8Å; I72-I75 PolarHBondContact O-N 3.48Å; I72-A76 WeakPolarHBondContact O-CB 3.41Å; I72-A76 PolarHBondContact O-N 3.19Å; I72-T127 HydrophobicContact CG2-CG2 3.94Å
73A90.8Very high88.6Confident10 Ų1052.5 Ų52.58%0.08328%0.278CS..Hα-helixtrans-56.1-48.7176.400000111.1P69 A70 L71 A76 E77 L124 T127P69-A73 WeakPolarHBondContact O-CB 3.22Å; P69-A73 PolarHBondContact O-N 3.26Å; A70-A73 WeakPolarHBondContact O-CB 3.32Å; A70-A73 PolarHBondContact O-N 3.33Å; L71-A73 VanDerWaalsContact C-N 3.32Å; L71-A73 PolarHBondContact O-N 3.03Å; A73-A76 PolarHBondContact O-N 3.44Å; A73-E77 WeakPolarHBondContact O-CB 3.34Å; A73-E77 PolarHBondContact O-N 3.21Å; A73-L124 HydrophobicContact CB-CD2 3.97Å; A73-T127 HydrophobicContact CB-CG2 4.46Å; A73-T127 VanDerWaalsContact CB-OG1 3.25Å; A73-T127 WeakPolarHBondContact CB-OG1 3.34Å
74N87.9Confident88.4Confident53 Ų5352.6 Ų52.628%0.28328%0.28SS..Hα-helixtrans-63.5-44-178.6-172.8-88.6000112.6V24 A70 L71 I72 N78V24-N74 HydrophobicContact CG2-CB 4.47Å; A70-N74 PolarHBondContact O-N 2.86Å; L71-N74 PolarHBondContact O-N 3.21Å; I72-N74 VanDerWaalsContact C-N 3.33Å; I72-N74 PolarHBondContact O-N 2.8Å; N74-N78 PolarHBondContact O-N 3.26Å; N74-N78 VanDerWaalsContact O-N 3.11Å; N74-N78 PolarHBondContact O-ND2 3.02Å; N74-N78 PolarHBondContact OD1-ND2 3.45Å
75I88.1Confident88Confident110 Ų11052.4 Ų52.456%0.56428%0.28SS*.Hα-helixtrans-64-44.6177.6-66.8166.2000110.5L71 I72 S79L71-I75 WeakPolarHBondContact O-CG1 3.37Å; L71-I75 PolarHBondContact O-N 3.01Å; I72-I75 PolarHBondContact O-N 3.48Å; I75-S79 WeakPolarHBondContact O-CB 3.49Å; I75-S79 PolarHBondContact O-N 3.01Å; I75-S79 PolarHBondContact O-OG 3.31Å
76A89.4Confident87.7Confident19 Ų1952.3 Ų52.316%0.15729%0.289CS..Hα-helixtrans-71.9-39.5-175.500000111.7I72 A73 S79 V80 V123I72-A76 WeakPolarHBondContact O-CB 3.41Å; I72-A76 PolarHBondContact O-N 3.19Å; A73-A76 PolarHBondContact O-N 3.44Å; A76-S79 PolarHBondContact O-N 3.16Å; A76-V80 WeakPolarHBondContact O-CB 3.33Å; A76-V80 VanDerWaalsContact O-CG2 3.26Å; A76-V80 WeakPolarHBondContact O-CG2 3.32Å; A76-V80 PolarHBondContact O-N 3.12Å; A76-V123 HydrophobicContact CB-CG1 3.43Å; A76-V123 VanDerWaalsContact CB-CG1 3.43Å
77E88.7Confident87.7Confident44 Ų4458 Ų5821%0.20631%0.312CS..Hα-helixtrans-57.2-53.1172.4179.2177.6-157.100111.4A73 S79 V80 L81 A120 L124A73-E77 WeakPolarHBondContact O-CB 3.34Å; A73-E77 PolarHBondContact O-N 3.21Å; E77-S79 VanDerWaalsContact C-N 3.33Å; E77-S79 PolarHBondContact O-N 3.47Å; E77-V80 PolarHBondContact O-N 3.48Å; E77-L81 WeakPolarHBondContact O-CB 3.17Å; E77-L81 PolarHBondContact O-N 3.38Å; E77-A120 HydrophobicContact CG-CB 4.39Å; E77-L124 HydrophobicContact CB-CD1 4.44Å; E77-L124 HydrophobicContact CB-CD2 3.85Å; E77-L124 HydrophobicContact CB-CG 4.2Å; E77-L124 HydrophobicContact CG-CD1 4.06Å; E77-L124 HydrophobicContact CG-CD2 4.28Å; E77-L124 HydrophobicContact CG-CG 4.37Å
78N85.3Confident87.4Confident67 Ų6757.3 Ų57.336%0.35831%0.308SS..Hα-helixtrans-61.2-43.1178.8-77.5-61.6000111.6N74 V80 L81 F82N74-N78 PolarHBondContact O-N 3.26Å; N74-N78 VanDerWaalsContact O-N 3.11Å; N74-N78 PolarHBondContact O-ND2 3.02Å; N74-N78 PolarHBondContact OD1-ND2 3.45Å; N78-V80 PolarHBondContact O-N 2.8Å; N78-L81 PolarHBondContact O-N 3.36Å; N78-F82 HydrophobicContact CB-CE2 4.46Å; N78-F82 WeakPolarHBondContact O-CD2 3.36Å; N78-F82 PolarHBondContact O-N 3.23Å
79S87.3Confident87Confident70 Ų7055.8 Ų55.849%0.4929%0.293SS..Hα-helixtrans-58.6-47.4177.1-610000112.3I75 A76 E77 M83I75-S79 WeakPolarHBondContact O-CB 3.49Å; I75-S79 PolarHBondContact O-N 3.01Å; I75-S79 PolarHBondContact O-OG 3.31Å; A76-S79 PolarHBondContact O-N 3.16Å; E77-S79 VanDerWaalsContact C-N 3.33Å; E77-S79 PolarHBondContact O-N 3.47Å; S79-M83 WeakPolarHBondContact O-CB 3.46Å; S79-M83 PolarHBondContact O-N 2.89Å
80V87.8Confident86.7Confident18 Ų1861.6 Ų61.611%0.10932%0.32CS..Hα-helixtrans-67.1-40.6179.1173.50000110.8A76 E77 N78 M83 C84 F119 A120 V123A76-V80 WeakPolarHBondContact O-CB 3.33Å; A76-V80 VanDerWaalsContact O-CG2 3.26Å; A76-V80 WeakPolarHBondContact O-CG2 3.32Å; A76-V80 PolarHBondContact O-N 3.12Å; E77-V80 PolarHBondContact O-N 3.48Å; N78-V80 PolarHBondContact O-N 2.8Å; V80-M83 PolarHBondContact O-N 3.34Å; V80-C84 VanDerWaalsContact O-CB 3.28Å; V80-C84 WeakPolarHBondContact O-CB 3.47Å; V80-C84 PolarHBondContact O-N 2.99Å; V80-F119 HydrophobicContact CG1-CB 3.82Å; V80-A120 HydrophobicContact CG1-CB 4.3Å; V80-V123 HydrophobicContact CG2-CB 4.24Å; V80-V123 HydrophobicContact CG2-CG2 3.74Å
81L84.3Confident86.4Confident37 Ų3764.3 Ų64.319%0.19434%0.336CS..Hα-helixtrans-60.4-51.2177.3-165.1118000110.3E77 N78 M83 C84 Y85E77-L81 WeakPolarHBondContact O-CB 3.17Å; E77-L81 PolarHBondContact O-N 3.38Å; N78-L81 PolarHBondContact O-N 3.36Å; L81-M83 VanDerWaalsContact C-N 3.31Å; L81-M83 PolarHBondContact O-N 3.36Å; L81-C84 PolarHBondContact O-N 3.16Å; L81-Y85 WeakPolarHBondContact O-CA 3.32Å; L81-Y85 WeakPolarHBondContact O-CB 3.4Å; L81-Y85 PolarHBondContact O-N 2.94Å
82F82.9Confident86Confident161 Ų16163 Ų6371%0.70633%0.33SS*.Hα-helixtrans-60.4-39177.6-77-62000113.2N78N78-F82 HydrophobicContact CB-CE2 4.46Å; N78-F82 WeakPolarHBondContact O-CD2 3.36Å; N78-F82 PolarHBondContact O-N 3.23Å
83M86.3Confident85.5Confident142 Ų14260.9 Ų60.970%0.732%0.315SS*.Hα-helixtrans-68.8-46179-174.71807000112.4S79 V80 L81S79-M83 WeakPolarHBondContact O-CB 3.46Å; S79-M83 PolarHBondContact O-N 2.89Å; V80-M83 PolarHBondContact O-N 3.34Å; L81-M83 VanDerWaalsContact C-N 3.31Å; L81-M83 PolarHBondContact O-N 3.36Å
84C86.7Confident85.2Confident16 Ų1669 Ų6911%0.10835%0.349CS..Hα-helixtrans-88.9-23.3-172.4-670000113.3V80 L81 G86 F87 C88 F119V80-C84 VanDerWaalsContact O-CB 3.28Å; V80-C84 WeakPolarHBondContact O-CB 3.47Å; V80-C84 PolarHBondContact O-N 2.99Å; L81-C84 PolarHBondContact O-N 3.16Å; C84-G86 PolarHBondContact O-N 2.93Å; C84-F87 PolarHBondContact O-N 3.43Å; C84-C88 WeakPolarHBondContact O-CB 3.34Å; C84-C88 PolarHBondContact O-N 3.38Å; C84-C88 PolarHBondContact O-SG 2.81Å; C84-F119 HydrophobicContact CB-CB 4.4Å; C84-F119 HydrophobicContact CB-CD2 4.27Å; C84-F119 HydrophobicContact CB-CG 4.44Å
85Y81.5Confident85Confident71 Ų7172.4 Ų72.428%0.27837%0.371SS..Hα-helixtrans-61.8-46.6-173.6-174-109.3000112.3L81 F87 C88 Q89 A116L81-Y85 WeakPolarHBondContact O-CA 3.32Å; L81-Y85 WeakPolarHBondContact O-CB 3.4Å; L81-Y85 PolarHBondContact O-N 2.94Å; Y85-F87 VanDerWaalsContact C-N 3.32Å; Y85-F87 PolarHBondContact O-N 3.37Å; Y85-C88 PolarHBondContact O-N 3.39Å; Y85-Q89 HydrophobicContact CD1-CG 4.32Å; Y85-Q89 HydrophobicContact CE1-CG 4.08Å; Y85-Q89 HydrophobicContact CE2-CG 4.49Å; Y85-Q89 WeakPolarHBondContact O-CG 3.38Å; Y85-Q89 PolarHBondContact O-N 3.42Å; Y85-Q89 PolarHBondContact OH-NE2 3.11Å; Y85-A116 HydrophobicContact CD2-CB 4.41Å
86G81.8Confident84.6Confident34 Ų3469.4 Ų69.435%0.35136%0.363SS..Hα-helixtrans-60.7-40.5177.300000112.8C84 Q90C84-G86 PolarHBondContact O-N 2.93Å; G86-Q90 WeakPolarHBondContact O-CG 3.32Å; G86-Q90 PolarHBondContact O-N 3.1Å
87F85.1Confident84.2Confident125 Ų12571.8 Ų71.855%0.54839%0.389SS..Hα-helixtrans-64.7-46.6174.4175.1-100.8000111.7C84 Y85 Q89 Q90 V91C84-F87 PolarHBondContact O-N 3.43Å; Y85-F87 VanDerWaalsContact C-N 3.32Å; Y85-F87 PolarHBondContact O-N 3.37Å; F87-Q89 VanDerWaalsContact C-N 3.32Å; F87-Q89 PolarHBondContact O-N 3.49Å; F87-Q90 WeakPolarHBondContact O-CB 3.49Å; F87-Q90 PolarHBondContact O-N 3.24Å; F87-Q90 VanDerWaalsContact O-N 3.11Å; F87-V91 HydrophobicContact CD1-CG2 4.31Å; F87-V91 HydrophobicContact CE1-CG2 3.86Å; F87-V91 HydrophobicContact CE2-CG2 4.33Å; F87-V91 HydrophobicContact CZ-CG2 3.88Å; F87-V91 WeakPolarHBondContact O-CG2 3.42Å; F87-V91 PolarHBondContact O-N 3.3Å
88C84.8Confident83.6Confident5 Ų572.7 Ų72.73%0.03440%0.395CS..Hα-helixtrans-63.7-37.1179.6-65.60000111.9C84 Y85 Q90 V91 V92 A112 F115 A116C84-C88 WeakPolarHBondContact O-CB 3.34Å; C84-C88 PolarHBondContact O-N 3.38Å; C84-C88 PolarHBondContact O-SG 2.81Å; Y85-C88 PolarHBondContact O-N 3.39Å; C88-Q90 VanDerWaalsContact C-N 3.34Å; C88-Q90 PolarHBondContact O-N 3.06Å; C88-V91 PolarHBondContact O-N 2.79Å; C88-V92 WeakPolarHBondContact O-CG2 3.18Å; C88-V92 PolarHBondContact O-N 2.91Å; C88-A112 HydrophobicContact CB-CB 4.36Å; C88-A112 WeakPolarHBondContact CB-O 3.22Å; C88-F115 HydrophobicContact CB-CB 4.43Å; C88-A116 HydrophobicContact CB-CB 4.29Å
89Q83Confident83.1Confident37 Ų3775.8 Ų75.817%0.17341%0.412CS..Hα-helixtrans-61.2-41.3172.8-75.4-175.1-41.800111.9Y85 F87 V92 R93 L104 N109 A112Y85-Q89 HydrophobicContact CD1-CG 4.32Å; Y85-Q89 HydrophobicContact CE1-CG 4.08Å; Y85-Q89 HydrophobicContact CE2-CG 4.49Å; Y85-Q89 WeakPolarHBondContact O-CG 3.38Å; Y85-Q89 PolarHBondContact O-N 3.42Å; Y85-Q89 PolarHBondContact OH-NE2 3.11Å; F87-Q89 VanDerWaalsContact C-N 3.32Å; F87-Q89 PolarHBondContact O-N 3.49Å; Q89-V92 PolarHBondContact O-N 3.36Å; Q89-R93 VanDerWaalsContact O-CG 3.31Å; Q89-R93 WeakPolarHBondContact O-CG 3.32Å; Q89-R93 PolarHBondContact O-N 3.42Å; Q89-L104 HydrophobicContact CB-CD1 3.88Å; Q89-L104 HydrophobicContact CG-CD1 3.87Å; Q89-N109 PolarHBondContact NE2-OD1 3.12Å; Q89-A112 HydrophobicContact CB-CB 4.48Å; Q89-A112 HydrophobicContact CG-CB 3.84Å
90Q84.5Confident82.2Confident127 Ų12780.8 Ų80.859%0.59343%0.425SS*.Hα-helixtrans-65.3-40.3176.4-69.5-178.414.100112.3G86 F87 C88 R93 K94G86-Q90 WeakPolarHBondContact O-CG 3.32Å; G86-Q90 PolarHBondContact O-N 3.1Å; F87-Q90 WeakPolarHBondContact O-CB 3.49Å; F87-Q90 PolarHBondContact O-N 3.24Å; F87-Q90 VanDerWaalsContact O-N 3.11Å; C88-Q90 VanDerWaalsContact C-N 3.34Å; C88-Q90 PolarHBondContact O-N 3.06Å; Q90-R93 PolarHBondContact O-N 3.26Å; Q90-K94 PolarHBondContact O-N 2.99Å
91V85.2Confident81.3Confident65 Ų6588.8 Ų88.839%0.39446%0.461SS..Hα-helixtrans-61.2-47.6175.11740000110.4F87 C88 R93 K94 V95F87-V91 HydrophobicContact CD1-CG2 4.31Å; F87-V91 HydrophobicContact CE1-CG2 3.86Å; F87-V91 HydrophobicContact CE2-CG2 4.33Å; F87-V91 HydrophobicContact CZ-CG2 3.88Å; F87-V91 WeakPolarHBondContact O-CG2 3.42Å; F87-V91 PolarHBondContact O-N 3.3Å; C88-V91 PolarHBondContact O-N 2.79Å; V91-R93 PolarHBondContact O-N 2.88Å; V91-K94 PolarHBondContact O-N 3.43Å; V91-V95 HydrophobicContact CG1-CG2 4.46Å; V91-V95 WeakPolarHBondContact O-CG2 3.43Å; V91-V95 PolarHBondContact O-N 2.86Å
92V82.4Confident80.6Confident16 Ų1688.4 Ų88.410%0.09746%0.463CS..Hα-helixtrans-62.8-40.8178.1173.20000111.8C88 Q89 K94 V95 A96 Q108 A111 A112C88-V92 WeakPolarHBondContact O-CG2 3.18Å; C88-V92 PolarHBondContact O-N 2.91Å; Q89-V92 PolarHBondContact O-N 3.36Å; V92-K94 VanDerWaalsContact C-N 3.35Å; V92-K94 PolarHBondContact O-N 2.92Å; V92-V95 PolarHBondContact O-N 3.16Å; V92-A96 VanDerWaalsContact O-CB 3.28Å; V92-A96 WeakPolarHBondContact O-CB 3.32Å; V92-A96 PolarHBondContact O-N 3.24Å; V92-Q108 HydrophobicContact CG1-CB 3.84Å; V92-Q108 HydrophobicContact CG1-CG 4.29Å; V92-A111 HydrophobicContact CG2-CB 4.43Å; V92-A112 HydrophobicContact CB-CB 4.38Å; V92-A112 HydrophobicContact CG2-CB 3.88Å
93R81.3Confident80.1Confident51 Ų5190.5 Ų90.519%0.19247%0.472CS..Hα-helixtrans-57.4-47.5173.8-75.3178.3-172.5146.214.8111.7Q89 Q90 V91 V95 A96 G97 L98 K100 A102 L104Q89-R93 VanDerWaalsContact O-CG 3.31Å; Q89-R93 WeakPolarHBondContact O-CG 3.32Å; Q89-R93 PolarHBondContact O-N 3.42Å; Q90-R93 PolarHBondContact O-N 3.26Å; V91-R93 PolarHBondContact O-N 2.88Å; R93-V95 PolarHBondContact O-N 3.06Å; R93-A96 PolarHBondContact O-N 3.02Å; R93-G97 PolarHBondContact O-N 3.45Å; R93-G97 VanDerWaalsContact O-N 3.16Å; R93-L98 HydrophobicContact CB-CB 4.5Å; R93-L98 PolarHBondContact O-N 2.78Å; R93-K100 WeakPolarHBondContact CD-O 3.27Å; R93-K100 PolarHBondContact NH1-O 3.1Å; R93-A102 PolarHBondContact NE-O 3.22Å; R93-L104 HydrophobicContact CG-CD1 4.24Å; R93-L104 HydrophobicContact CG-CD2 3.43Å; R93-L104 VanDerWaalsContact CG-CD2 3.43Å; R93-L104 HydrophobicContact CG-CG 4.01Å
94K84.5Confident79.3Confident181 Ų18184.4 Ų84.479%0.78744%0.442SS*.Hα-helixtrans-62.9-42.5179.9-173.6177179.9-178.10111.9Q90 V91 V92 G97Q90-K94 PolarHBondContact O-N 2.99Å; V91-K94 PolarHBondContact O-N 3.43Å; V92-K94 VanDerWaalsContact C-N 3.35Å; V92-K94 PolarHBondContact O-N 2.92Å; K94-G97 PolarHBondContact O-N 3.27Å
95V84Confident78.8Confident124 Ų12487 Ų8775%0.75246%0.46SS*.Hα-helixtrans-68.5-36.6178.3173.20000111.6V91 V92 R93 G97V91-V95 HydrophobicContact CG1-CG2 4.46Å; V91-V95 WeakPolarHBondContact O-CG2 3.43Å; V91-V95 PolarHBondContact O-N 2.86Å; V92-V95 PolarHBondContact O-N 3.16Å; R93-V95 PolarHBondContact O-N 3.06Å; V95-G97 PolarHBondContact O-N 3.33Å
96A80.4Confident78.5Confident48 Ų4886.3 Ų86.340%0.39746%0.462SS..THydrogen-bonded Turntrans-78.5-1.2177.700000114.1V92 R93 L98 Q108V92-A96 VanDerWaalsContact O-CB 3.28Å; V92-A96 WeakPolarHBondContact O-CB 3.32Å; V92-A96 PolarHBondContact O-N 3.24Å; R93-A96 PolarHBondContact O-N 3.02Å; A96-L98 HydrophobicContact CB-CD1 4.16Å; A96-L98 HydrophobicContact CB-CG 3.96Å; A96-L98 PolarHBondContact O-N 3.33Å; A96-Q108 VanDerWaalsContact CB-NE2 3.35Å
97G79.5Confident78.1Confident69 Ų6990 Ų9071%0.71147%0.473SS*.THydrogen-bonded Turntrans65.122.8-175.900000113.7R93 K94 V95R93-G97 PolarHBondContact O-N 3.45Å; R93-G97 VanDerWaalsContact O-N 3.16Å; K94-G97 PolarHBondContact O-N 3.27Å; V95-G97 PolarHBondContact O-N 3.33Å
98L77Confident77.9Confident62 Ų6286.2 Ų86.233%0.32546%0.456SS..  trans-89.1150.9-178.7-68.9-179.4000111.9R93 A96 A102 L104 Q108R93-L98 HydrophobicContact CB-CB 4.5Å; R93-L98 PolarHBondContact O-N 2.78Å; A96-L98 HydrophobicContact CB-CD1 4.16Å; A96-L98 HydrophobicContact CB-CG 3.96Å; A96-L98 PolarHBondContact O-N 3.33Å; L98-A102 HydrophobicContact CB-CB 4.12Å; L98-L104 HydrophobicContact CD1-CD2 3.88Å; L98-Q108 VanDerWaalsContact CD1-NE2 3.26Å; L98-Q108 VanDerWaalsContact CD1-OE1 3.23Å
99D75.1Confident77.6Confident132 Ų13287.7 Ų87.771%0.70646%0.464SS*.  trans-64.5152.9176.3-139.8-21.4000111.8Q101 A102D99-Q101 PolarHBondContact O-N 3.49Å; D99-A102 HydrophobicContact CB-CB 4.36Å; D99-A102 WeakPolarHBondContact O-CB 3.45Å; D99-A102 PolarHBondContact O-N 2.96Å
100K68.2Low77.3Confident176 Ų17686 Ų8677%0.76546%0.457SS*.THydrogen-bonded Turntrans-58.4-27.1-169.9-76.1-176.5-179.9176.40113.9R93R93-K100 WeakPolarHBondContact CD-O 3.27Å; R93-K100 PolarHBondContact NH1-O 3.1Å
101Q68.3Low77.1Confident186 Ų18681.8 Ų81.887%0.86944%0.443SS*.THydrogen-bonded Turntrans-1094.5-178.7-65-176.8-13.900113.6D99 K103D99-Q101 PolarHBondContact O-N 3.49Å; Q101-K103 PolarHBondContact O-N 3Å
102A69.4Low77.1Confident29 Ų2978.7 Ų78.724%0.2442%0.424CS..PPolyproline II helixtrans-61.4134.5178.300000110.4R93 L98 D99 L104R93-A102 PolarHBondContact NE-O 3.22Å; L98-A102 HydrophobicContact CB-CB 4.12Å; D99-A102 HydrophobicContact CB-CB 4.36Å; D99-A102 WeakPolarHBondContact O-CB 3.45Å; D99-A102 PolarHBondContact O-N 2.96Å; A102-L104 PolarHBondContact O-N 3.16Å; A102-L104 VanDerWaalsContact O-N 3.17Å
103K72.1Confident77.1Confident205 Ų20578 Ų7889%0.89142%0.421SS*.PPolyproline II helixtrans-60.9120.1170.2-76.4-174.4178.4-1790107.8Q101Q101-K103 PolarHBondContact O-N 3Å
104L70.3Confident77.2Confident14 Ų1476.3 Ų76.37%0.07342%0.417CS..PPolyproline II helixtrans-69.1136.9175.4-73.4178.4000109Q89 R93 L98 A102 Q108 N109Q89-L104 HydrophobicContact CB-CD1 3.88Å; Q89-L104 HydrophobicContact CG-CD1 3.87Å; R93-L104 HydrophobicContact CG-CD1 4.24Å; R93-L104 HydrophobicContact CG-CD2 3.43Å; R93-L104 VanDerWaalsContact CG-CD2 3.43Å; R93-L104 HydrophobicContact CG-CG 4.01Å; L98-L104 HydrophobicContact CD1-CD2 3.88Å; A102-L104 PolarHBondContact O-N 3.16Å; A102-L104 VanDerWaalsContact O-N 3.17Å; L104-Q108 HydrophobicContact CB-CB 4.09Å; L104-Q108 HydrophobicContact CD2-CB 3.9Å; L104-Q108 HydrophobicContact CG-CB 4.46Å; L104-N109 WeakPolarHBondContact CB-OD1 3.28Å; L104-N109 WeakPolarHBondContact CD1-OD1 3.44Å; L104-N109 PolarHBondContact O-ND2 3.27Å
105S76.2Confident77.2Confident70 Ų7074 Ų7449%0.4941%0.407SS..PPolyproline II helixtrans-59.6153167.5175.80000110L107 Q108 N109S105-L107 PolarHBondContact O-N 2.82Å; S105-L107 VanDerWaalsContact O-N 3.15Å; S105-Q108 WeakPolarHBondContact O-CA 3.36Å; S105-Q108 WeakPolarHBondContact O-CB 3.31Å; S105-Q108 PolarHBondContact O-N 3.45Å; S105-N109 PolarHBondContact O-N 3.1Å
106D74.3Confident77.4Confident57 Ų5768.1 Ų68.131%0.30537%0.371SS..Hα-helixtrans-51.7-39.3177.6-62.8-43.5000112Q108 N109 A110 E192 R195D106-Q108 PolarHBondContact O-N 3.18Å; D106-N109 PolarHBondContact O-N 3.28Å; D106-A110 WeakPolarHBondContact O-CB 3.44Å; D106-A110 PolarHBondContact O-N 3.43Å; D106-E192 HydrophobicContact CB-CG 3.85Å; D106-E192 WeakPolarHBondContact CB-OE1 3.44Å; D106-E192 VanDerWaalsContact CG-OE1 3.29Å; D106-R195 IonicContact OD1-NH1 3.94Å; D106-R195 IonicContact OD2-NH1 3.11Å; D106-R195 PolarHBondContact OD2-NH1 3.48Å
107L75Confident77.6Confident112 Ų11265.9 Ų65.959%0.58635%0.353SS*.Hα-helixtrans-67.5-33.1176.5-172.965.1000113S105 A110 A111S105-L107 PolarHBondContact O-N 2.82Å; S105-L107 VanDerWaalsContact O-N 3.15Å; L107-A110 WeakPolarHBondContact O-CB 3.45Å; L107-A110 PolarHBondContact O-N 3.46Å; L107-A111 WeakPolarHBondContact O-CB 3.42Å; L107-A111 PolarHBondContact O-N 2.89Å
108Q80.3Confident78.1Confident44 Ų4463.9 Ų63.921%0.20633%0.33CS..Hα-helixtrans-75.6-38.5177.1-67.4171.2-33.100111.4V92 A96 L98 L104 S105 D106 A110 A111 A112V92-Q108 HydrophobicContact CG1-CB 3.84Å; V92-Q108 HydrophobicContact CG1-CG 4.29Å; A96-Q108 VanDerWaalsContact CB-NE2 3.35Å; L98-Q108 VanDerWaalsContact CD1-NE2 3.26Å; L98-Q108 VanDerWaalsContact CD1-OE1 3.23Å; L104-Q108 HydrophobicContact CB-CB 4.09Å; L104-Q108 HydrophobicContact CD2-CB 3.9Å; L104-Q108 HydrophobicContact CG-CB 4.46Å; S105-Q108 WeakPolarHBondContact O-CA 3.36Å; S105-Q108 WeakPolarHBondContact O-CB 3.31Å; S105-Q108 PolarHBondContact O-N 3.45Å; D106-Q108 PolarHBondContact O-N 3.18Å; Q108-A110 VanDerWaalsContact C-N 3.28Å; Q108-A111 PolarHBondContact O-N 2.86Å; Q108-A112 WeakPolarHBondContact O-CB 3.23Å; Q108-A112 PolarHBondContact O-N 3.37Å
109N78.7Confident78.7Confident37 Ų3765.1 Ų65.120%0.19833%0.333CS..Hα-helixtrans-62-39.2169.1-77.2-39.4000110.9Q89 L104 S105 D106 A112 G113Q89-N109 PolarHBondContact NE2-OD1 3.12Å; L104-N109 WeakPolarHBondContact CB-OD1 3.28Å; L104-N109 WeakPolarHBondContact CD1-OD1 3.44Å; L104-N109 PolarHBondContact O-ND2 3.27Å; S105-N109 PolarHBondContact O-N 3.1Å; D106-N109 PolarHBondContact O-N 3.28Å; N109-A112 PolarHBondContact O-N 3.32Å; N109-G113 PolarHBondContact O-N 3.06Å
110A77.5Confident79.4Confident2 Ų258.9 Ų58.92%0.01730%0.299CS..Hα-helixtrans-62.1-45.4174.300000112.2D106 L107 Q108 G113 S114 F188D106-A110 WeakPolarHBondContact O-CB 3.44Å; D106-A110 PolarHBondContact O-N 3.43Å; L107-A110 WeakPolarHBondContact O-CB 3.45Å; L107-A110 PolarHBondContact O-N 3.46Å; Q108-A110 VanDerWaalsContact C-N 3.28Å; A110-G113 PolarHBondContact O-N 3.11Å; A110-S114 WeakPolarHBondContact O-CB 3.4Å; A110-S114 PolarHBondContact O-N 3.42Å; A110-F188 HydrophobicContact CB-CB 3.42Å; A110-F188 VanDerWaalsContact CB-CB 3.42Å; A110-F188 HydrophobicContact CB-CD1 4.19Å; A110-F188 HydrophobicContact CB-CD2 3.37Å; A110-F188 HydrophobicContact CB-CE2 4.11Å; A110-F188 HydrophobicContact CB-CG 3.41Å; A110-F188 VanDerWaalsContact CB-CG 3.41Å
111A80.1Confident80.4Confident37 Ų3750.5 Ų50.531%0.30626%0.263SS..Hα-helixtrans-60.8-45.4174.100000111.2V92 L107 Q108 G113 S114 F115V92-A111 HydrophobicContact CG2-CB 4.43Å; L107-A111 WeakPolarHBondContact O-CB 3.42Å; L107-A111 PolarHBondContact O-N 2.89Å; Q108-A111 PolarHBondContact O-N 2.86Å; A111-G113 PolarHBondContact O-N 2.79Å; A111-S114 PolarHBondContact O-N 3.24Å; A111-F115 VanDerWaalsContact O-CD2 3.25Å; A111-F115 WeakPolarHBondContact O-CD2 3.18Å; A111-F115 PolarHBondContact O-N 3.33Å
112A83.5Confident81.5Confident0 Ų045.1 Ų45.10%024%0.24CC..Hα-helixtrans-61.4-43177.200000111.9C88 Q89 V92 Q108 N109 F115 A116C88-A112 HydrophobicContact CB-CB 4.36Å; C88-A112 WeakPolarHBondContact CB-O 3.22Å; Q89-A112 HydrophobicContact CB-CB 4.48Å; Q89-A112 HydrophobicContact CG-CB 3.84Å; V92-A112 HydrophobicContact CB-CB 4.38Å; V92-A112 HydrophobicContact CG2-CB 3.88Å; Q108-A112 WeakPolarHBondContact O-CB 3.23Å; Q108-A112 PolarHBondContact O-N 3.37Å; N109-A112 PolarHBondContact O-N 3.32Å; A112-F115 PolarHBondContact O-N 3.32Å; A112-A116 WeakPolarHBondContact O-CB 3.34Å; A112-A116 PolarHBondContact O-N 3.37Å
113G83Confident82.5Confident3 Ų346.3 Ų46.33%0.03124%0.244CC..Hα-helixtrans-63.3-41.6174.400000112.5N109 A110 A111 F115 A116 S117N109-G113 PolarHBondContact O-N 3.06Å; A110-G113 PolarHBondContact O-N 3.11Å; A111-G113 PolarHBondContact O-N 2.79Å; G113-F115 VanDerWaalsContact C-N 3.35Å; G113-F115 PolarHBondContact O-N 3.49Å; G113-A116 PolarHBondContact O-N 2.94Å; G113-S117 WeakPolarHBondContact O-CB 3.47Å; G113-S117 PolarHBondContact O-N 3.39Å
114S83.6Confident83.4Confident15 Ų1536.8 Ų36.811%0.10520%0.203CC..Hα-helixtrans-66.2-32.9175-177.60000113.1A110 A111 S117 V181A110-S114 WeakPolarHBondContact O-CB 3.4Å; A110-S114 PolarHBondContact O-N 3.42Å; A111-S114 PolarHBondContact O-N 3.24Å; S114-S117 PolarHBondContact O-OG 2.84Å; S114-V181 WeakPolarHBondContact OG-CG1 3.45Å; S114-V181 PolarHBondContact OG-O 3.02Å; S114-V181 VanDerWaalsContact OG-O 3.07Å
115F84.9Confident84.4Confident132 Ų13236.1 Ų36.158%0.57920%0.199SC*.Hα-helixtrans-73.6-41.1171.6-86.7-74.1000111.3C88 A111 A112 G113 S117 A118 F119C88-F115 HydrophobicContact CB-CB 4.43Å; A111-F115 VanDerWaalsContact O-CD2 3.25Å; A111-F115 WeakPolarHBondContact O-CD2 3.18Å; A111-F115 PolarHBondContact O-N 3.33Å; A112-F115 PolarHBondContact O-N 3.32Å; G113-F115 VanDerWaalsContact C-N 3.35Å; G113-F115 PolarHBondContact O-N 3.49Å; F115-S117 VanDerWaalsContact C-N 3.27Å; F115-S117 PolarHBondContact O-N 3.09Å; F115-A118 WeakPolarHBondContact O-CB 3.43Å; F115-A118 PolarHBondContact O-N 3.27Å; F115-F119 WeakPolarHBondContact O-CD2 3.23Å
116A87Confident85.2Confident0 Ų034.1 Ų34.10%018%0.184CC..Hα-helixtrans-61.7-36175.900000112Y85 C88 A112 G113 A118 F119 A120Y85-A116 HydrophobicContact CD2-CB 4.41Å; C88-A116 HydrophobicContact CB-CB 4.29Å; A112-A116 WeakPolarHBondContact O-CB 3.34Å; A112-A116 PolarHBondContact O-N 3.37Å; G113-A116 PolarHBondContact O-N 2.94Å; A116-A118 PolarHBondContact O-N 3.06Å; A116-F119 WeakPolarHBondContact O-CB 3.41Å; A116-F119 PolarHBondContact O-N 2.81Å; A116-A120 PolarHBondContact O-N 3.08Å; A116-A120 VanDerWaalsContact O-N 3.15Å
117S86.3Confident86Confident1 Ų132.3 Ų32.31%0.00718%0.176CC..Hα-helixtrans-66.4-24.8178.973.70000112.9G113 S114 F115 F119 A120 A121 E180 Y184G113-S117 WeakPolarHBondContact O-CB 3.47Å; G113-S117 PolarHBondContact O-N 3.39Å; S114-S117 PolarHBondContact O-OG 2.84Å; F115-S117 VanDerWaalsContact C-N 3.27Å; F115-S117 PolarHBondContact O-N 3.09Å; S117-F119 VanDerWaalsContact C-N 3.31Å; S117-F119 PolarHBondContact O-N 2.99Å; S117-A120 PolarHBondContact O-N 3.13Å; S117-A121 WeakPolarHBondContact O-CB 2.88Å; S117-A121 PolarHBondContact O-N 3.04Å; S117-E180 PolarHBondContact OG-O 3.07Å; S117-Y184 VanDerWaalsContact CB-CD2 3.43Å
118A88.6Confident86.7Confident28 Ų2828.2 Ų28.223%0.23115%0.154CC..Hα-helixtrans-64.5-35.5171.300000112.3F115 A116 A121 L177 V181F115-A118 WeakPolarHBondContact O-CB 3.43Å; F115-A118 PolarHBondContact O-N 3.27Å; A116-A118 PolarHBondContact O-N 3.06Å; A118-A121 WeakPolarHBondContact O-CB 3.5Å; A118-L177 HydrophobicContact CB-CD2 3.86Å; A118-V181 HydrophobicContact CB-CG2 4.18Å
119F89.6Confident87.2Confident88 Ų8826.1 Ų26.139%0.38614%0.144SC..Hα-helixtrans-72.2-41.1173.1-62.9-83.3000111.2V80 C84 F115 A116 S117 A121 L122V80-F119 HydrophobicContact CG1-CB 3.82Å; C84-F119 HydrophobicContact CB-CB 4.4Å; C84-F119 HydrophobicContact CB-CD2 4.27Å; C84-F119 HydrophobicContact CB-CG 4.44Å; F115-F119 WeakPolarHBondContact O-CD2 3.23Å; A116-F119 WeakPolarHBondContact O-CB 3.41Å; A116-F119 PolarHBondContact O-N 2.81Å; S117-F119 VanDerWaalsContact C-N 3.31Å; S117-F119 PolarHBondContact O-N 2.99Å; F119-A121 PolarHBondContact O-N 2.62Å; F119-L122 WeakPolarHBondContact O-CB 3.12Å; F119-L122 PolarHBondContact O-N 3.26Å; F119-L122 VanDerWaalsContact O-N 3.14Å
120A89.6Confident87.9Confident0 Ų024.7 Ų24.70%014%0.136CC..Hα-helixtrans-59.5-37.8175.100000111.6E77 V80 A116 S117 L122 V123 L124E77-A120 HydrophobicContact CG-CB 4.39Å; V80-A120 HydrophobicContact CG1-CB 4.3Å; A116-A120 PolarHBondContact O-N 3.08Å; A116-A120 VanDerWaalsContact O-N 3.15Å; S117-A120 PolarHBondContact O-N 3.13Å; A120-L122 PolarHBondContact O-N 2.93Å; A120-V123 PolarHBondContact O-N 3.19Å; A120-L124 HydrophobicContact CB-CD1 4.36Å; A120-L124 WeakPolarHBondContact O-CB 3.21Å; A120-L124 WeakPolarHBondContact O-CG 3.35Å; A120-L124 PolarHBondContact O-N 3.23Å
121A90.3Very high88.6Confident0 Ų026.2 Ų26.20%014%0.142CC..Hα-helixtrans-56.7-33176.500000113.5S117 A118 F119 V123 C125 T176 L177 E180S117-A121 WeakPolarHBondContact O-CB 2.88Å; S117-A121 PolarHBondContact O-N 3.04Å; A118-A121 WeakPolarHBondContact O-CB 3.5Å; F119-A121 PolarHBondContact O-N 2.62Å; A121-V123 VanDerWaalsContact C-N 3.28Å; A121-V123 PolarHBondContact O-N 3.25Å; A121-C125 VanDerWaalsContact O-CB 3.24Å; A121-C125 WeakPolarHBondContact O-CB 3.43Å; A121-C125 PolarHBondContact O-N 3.24Å; A121-T176 HydrophobicContact CB-CG2 3.77Å; A121-L177 HydrophobicContact CB-CD2 3.62Å; A121-L177 HydrophobicContact CB-CG 4.17Å; A121-E180 HydrophobicContact CB-CG 3.9Å
122L90.8Very high89.1Confident73 Ų7325 Ų2538%0.38213%0.131SC..Hα-helixtrans-65.7-33.1178.6-61.9175.3000112F119 A120 P126 Y170 L173F119-L122 WeakPolarHBondContact O-CB 3.12Å; F119-L122 PolarHBondContact O-N 3.26Å; F119-L122 VanDerWaalsContact O-N 3.14Å; A120-L122 PolarHBondContact O-N 2.93Å; L122-P126 WeakPolarHBondContact O-CD 3.14Å; L122-Y170 WeakPolarHBondContact O-CE1 3.49Å; L122-L173 HydrophobicContact CD2-CD1 3.97Å; L122-L173 HydrophobicContact CD2-CD2 4.05Å
123V89.9Confident89.5Confident55 Ų5525.1 Ų25.133%0.33313%0.132SC..Hα-helixtrans-93.7-29.1-178.8-175.10000111.8A76 V80 A120 A121 T127A76-V123 HydrophobicContact CB-CG1 3.43Å; A76-V123 VanDerWaalsContact CB-CG1 3.43Å; V80-V123 HydrophobicContact CG2-CB 4.24Å; V80-V123 HydrophobicContact CG2-CG2 3.74Å; A120-V123 PolarHBondContact O-N 3.19Å; A121-V123 VanDerWaalsContact C-N 3.28Å; A121-V123 PolarHBondContact O-N 3.25Å; V123-T127 PolarHBondContact O-OG1 3.01Å
124L91.7Very high89.9Confident4 Ų425.2 Ų25.22%0.02113%0.132CC..Hα-helixtrans-69.6-39.2172.7-76.2172.4000112.5A73 E77 A120 T127 E128A73-L124 HydrophobicContact CB-CD2 3.97Å; E77-L124 HydrophobicContact CB-CD1 4.44Å; E77-L124 HydrophobicContact CB-CD2 3.85Å; E77-L124 HydrophobicContact CB-CG 4.2Å; E77-L124 HydrophobicContact CG-CD1 4.06Å; E77-L124 HydrophobicContact CG-CD2 4.28Å; E77-L124 HydrophobicContact CG-CG 4.37Å; A120-L124 HydrophobicContact CB-CD1 4.36Å; A120-L124 WeakPolarHBondContact O-CB 3.21Å; A120-L124 WeakPolarHBondContact O-CG 3.35Å; A120-L124 PolarHBondContact O-N 3.23Å; L124-T127 WeakPolarHBondContact CA-OG1 3.18Å; L124-T127 PolarHBondContact O-N 3.35Å; L124-T127 PolarHBondContact O-OG1 3.44Å; L124-E128 WeakPolarHBondContact O-CB 3.5Å; L124-E128 WeakPolarHBondContact O-CG 3.3Å; L124-E128 PolarHBondContact O-N 3.47Å
125C91.5Very high90.2Very high0 Ų024.6 Ų24.60%013%0.127CC..Hα-helixtrans-57.1-49.8-173.5-177.60000113.1A121 T127 L129 F169 L173A121-C125 VanDerWaalsContact O-CB 3.24Å; A121-C125 WeakPolarHBondContact O-CB 3.43Å; A121-C125 PolarHBondContact O-N 3.24Å; C125-T127 PolarHBondContact O-N 2.88Å; C125-L129 VanDerWaalsContact O-CB 3.23Å; C125-L129 WeakPolarHBondContact O-CB 3.45Å; C125-L129 PolarHBondContact O-N 2.59Å; C125-F169 PolarHBondContact SG-O 3.03Å; C125-L173 HydrophobicContact CB-CD1 4.14Å
126P92.3Very high90.3Very high28 Ų2818.3 Ų18.318%0.18210%0.1CC..Hα-helixtrans-60.7-42.4176.4-25.835.6000113.6L122 V130 F169 Y170L122-P126 WeakPolarHBondContact O-CD 3.14Å; P126-V130 WeakPolarHBondContact O-CG2 3.43Å; P126-V130 PolarHBondContact O-N 2.83Å; P126-V130 VanDerWaalsContact O-N 3.14Å; P126-F169 WeakPolarHBondContact CA-O 3.5Å; P126-F169 HydrophobicContact CB-CB 3.98Å; P126-F169 HydrophobicContact CB-CD1 4.22Å; P126-F169 HydrophobicContact CB-CG 4.44Å; P126-F169 HydrophobicContact CG-CB 4.12Å; P126-Y170 HydrophobicContact CG-CE1 4.36Å
127T92.1Very high90.4Very high19 Ų1918.7 Ų18.712%0.11710%0.101CC..Hα-helixtrans-72.3-42.4-175.152.60000111.3I72 A73 V123 L124 C125 V130 K131I72-T127 HydrophobicContact CG2-CG2 3.94Å; A73-T127 HydrophobicContact CB-CG2 4.46Å; A73-T127 VanDerWaalsContact CB-OG1 3.25Å; A73-T127 WeakPolarHBondContact CB-OG1 3.34Å; V123-T127 PolarHBondContact O-OG1 3.01Å; L124-T127 WeakPolarHBondContact CA-OG1 3.18Å; L124-T127 PolarHBondContact O-N 3.35Å; L124-T127 PolarHBondContact O-OG1 3.44Å; C125-T127 PolarHBondContact O-N 2.88Å; T127-V130 PolarHBondContact O-N 3.3Å; T127-K131 WeakPolarHBondContact O-CB 3.22Å; T127-K131 PolarHBondContact O-N 3.49Å
128E90.3Very high90.3Very high27 Ų2721.6 Ų21.613%0.12611%0.113CC..Hα-helixtrans-67.4-37.2174.3-72.5-177.7122.600112.6L124 V130 K131 C132 R179 K234L124-E128 WeakPolarHBondContact O-CB 3.5Å; L124-E128 WeakPolarHBondContact O-CG 3.3Å; L124-E128 PolarHBondContact O-N 3.47Å; E128-V130 VanDerWaalsContact C-N 3.35Å; E128-V130 PolarHBondContact O-N 2.94Å; E128-K131 WeakPolarHBondContact O-CB 3.48Å; E128-K131 PolarHBondContact O-N 2.73Å; E128-C132 WeakPolarHBondContact O-CB 3.31Å; E128-C132 PolarHBondContact O-N 3.32Å; E128-C132 PolarHBondContact O-SG 3.44Å; E128-R179 IonicContact OE1-CZ 2.63Å; E128-R179 IonicContact OE1-NH1 3.51Å; E128-R179 PolarHBondContact OE1-NH1 2.9Å; E128-R179 IonicContact OE1-NH2 3.05Å; E128-R179 PolarHBondContact OE1-NH2 3.06Å; E128-K234 IonicContact OE1-NZ 2.68Å; E128-K234 PolarHBondContact OE1-NZ 3.49Å; E128-K234 VanDerWaalsContact OE2-CE 3.3Å; E128-K234 WeakPolarHBondContact OE2-CE 3.34Å; E128-K234 IonicContact OE2-NZ 3.65Å; E128-K234 PolarHBondContact OE2-NZ 2.86Å
129L91Very high90.2Very high0 Ų020.4 Ų20.40%010%0.103CC..Hα-helixtrans-58.3-50174177.570000110.3C125 K131 C132 R133 I160 G168 H171 Q238C125-L129 VanDerWaalsContact O-CB 3.23Å; C125-L129 WeakPolarHBondContact O-CB 3.45Å; C125-L129 PolarHBondContact O-N 2.59Å; L129-K131 VanDerWaalsContact C-N 3.35Å; L129-K131 PolarHBondContact O-N 3.22Å; L129-C132 PolarHBondContact O-N 2.94Å; L129-R133 HydrophobicContact CD1-CG 4.43Å; L129-R133 WeakPolarHBondContact O-CB 3.31Å; L129-R133 VanDerWaalsContact O-CG 3.32Å; L129-R133 WeakPolarHBondContact O-CG 3.36Å; L129-R133 PolarHBondContact O-N 3.47Å; L129-I160 HydrophobicContact CD2-CD1 3.98Å; L129-I160 HydrophobicContact CG-CD1 4.4Å; L129-G168 VanDerWaalsContact CD2-O 3.22Å; L129-G168 WeakPolarHBondContact CD2-O 3.21Å; L129-H171 HydrophobicContact CD1-CB 4.39Å; L129-Q238 HydrophobicContact CD1-CB 3.75Å; L129-Q238 HydrophobicContact CD1-CG 3.81Å
130V92.5Very high90Very high7 Ų716.2 Ų16.24%0.0428%0.084CC..Hα-helixtrans-63.9-41.4178.5175.60000111P69 P126 T127 E128 L134 V153 V156 I157 I160 F169P69-V130 HydrophobicContact CB-CB 4.45Å; P69-V130 HydrophobicContact CB-CG1 4.3Å; P69-V130 HydrophobicContact CG-CG1 4.29Å; P126-V130 WeakPolarHBondContact O-CG2 3.43Å; P126-V130 PolarHBondContact O-N 2.83Å; P126-V130 VanDerWaalsContact O-N 3.14Å; T127-V130 PolarHBondContact O-N 3.3Å; E128-V130 VanDerWaalsContact C-N 3.35Å; E128-V130 PolarHBondContact O-N 2.94Å; V130-L134 HydrophobicContact CG1-CD1 3.91Å; V130-L134 HydrophobicContact CG1-CG 4.48Å; V130-L134 WeakPolarHBondContact O-CB 3.48Å; V130-L134 VanDerWaalsContact O-CG 3.31Å; V130-L134 WeakPolarHBondContact O-CG 3.3Å; V130-L134 PolarHBondContact O-N 3.43Å; V130-V153 HydrophobicContact CG1-CG1 4.02Å; V130-V156 HydrophobicContact CB-CG1 4.49Å; V130-V156 HydrophobicContact CG1-CB 4.42Å; V130-V156 HydrophobicContact CG1-CG1 4.13Å; V130-V156 HydrophobicContact CG2-CG1 4.4Å; V130-I157 HydrophobicContact CG2-CG1 4.08Å; V130-I160 HydrophobicContact CG2-CD1 3.89Å; V130-F169 HydrophobicContact CG2-CE1 4.22Å
131K92.6Very high89.9Confident33 Ų3317.6 Ų17.614%0.1439%0.09CC..Hα-helixtrans-57.1-54.4174.9179.9-175.2177176.70111.4D31 P69 A70 T127 E128 L129 R133 L134 Q135D31-K131 IonicContact OD2-NZ 3.86Å; D31-K131 PolarHBondContact OD2-NZ 3.49Å; P69-K131 HydrophobicContact CB-CB 4.25Å; P69-K131 HydrophobicContact CG-CB 4.04Å; A70-K131 HydrophobicContact CB-CD 3.98Å; T127-K131 WeakPolarHBondContact O-CB 3.22Å; T127-K131 PolarHBondContact O-N 3.49Å; E128-K131 WeakPolarHBondContact O-CB 3.48Å; E128-K131 PolarHBondContact O-N 2.73Å; L129-K131 VanDerWaalsContact C-N 3.35Å; L129-K131 PolarHBondContact O-N 3.22Å; K131-R133 PolarHBondContact O-N 2.85Å; K131-L134 PolarHBondContact O-N 3.14Å; K131-Q135 HydrophobicContact CG-CG 4.5Å; K131-Q135 VanDerWaalsContact O-CG 3.31Å; K131-Q135 WeakPolarHBondContact O-CG 3.3Å; K131-Q135 PolarHBondContact O-N 3.41Å
132C91.1Very high89.6Confident11 Ų1121.9 Ų21.97%0.07412%0.117CC..Hα-helixtrans-63.6-42.1-176.7-66.70000112V35 E128 L129 L134 Q135 T136 Q238 V239V35-C132 HydrophobicContact CG1-CB 4.14Å; E128-C132 WeakPolarHBondContact O-CB 3.31Å; E128-C132 PolarHBondContact O-N 3.32Å; E128-C132 PolarHBondContact O-SG 3.44Å; L129-C132 PolarHBondContact O-N 2.94Å; C132-L134 PolarHBondContact O-N 3.43Å; C132-Q135 PolarHBondContact O-N 3Å; C132-T136 PolarHBondContact O-N 2.88Å; C132-T136 PolarHBondContact O-OG1 3.41Å; C132-Q238 HydrophobicContact CB-CB 4.19Å; C132-Q238 PolarHBondContact SG-OE1 3.2Å; C132-Q238 VanDerWaalsContact SG-OE1 3.33Å; C132-V239 HydrophobicContact CB-CG2 4.13Å
133R91.3Very high89.2Confident4 Ų421.4 Ų21.42%0.01512%0.119CC..Hα-helixtrans-61.2-42.7175.4-71.5-170.2172.6-1668.6111.6L129 K131 M137 V156 D164 Q238 S241 M242L129-R133 HydrophobicContact CD1-CG 4.43Å; L129-R133 WeakPolarHBondContact O-CB 3.31Å; L129-R133 VanDerWaalsContact O-CG 3.32Å; L129-R133 WeakPolarHBondContact O-CG 3.36Å; L129-R133 PolarHBondContact O-N 3.47Å; K131-R133 PolarHBondContact O-N 2.85Å; R133-M137 WeakPolarHBondContact O-CA 3.5Å; R133-M137 WeakPolarHBondContact O-CB 3.34Å; R133-M137 PolarHBondContact O-N 2.98Å; R133-V156 HydrophobicContact CB-CG1 3.84Å; R133-D164 IonicContact CZ-OD2 2.78Å; R133-D164 IonicContact NH1-OD2 3.44Å; R133-D164 IonicContact NH2-OD2 3.25Å; R133-D164 PolarHBondContact NH2-OD2 3.39Å; R133-D164 VanDerWaalsContact NH2-OD2 3.11Å; R133-Q238 PolarHBondContact NE-O 2.9Å; R133-S241 PolarHBondContact NE-OG 3.49Å; R133-S241 PolarHBondContact NH2-OG 3.45Å; R133-M242 HydrophobicContact CB-CE 4.24Å; R133-M242 HydrophobicContact CB-CG 4.21Å; R133-M242 HydrophobicContact CB-SD 3.71Å; R133-M242 HydrophobicContact CG-CG 3.53Å; R133-M242 HydrophobicContact CG-SD 3.62Å
134L91.2Very high88.9Confident4 Ų421.8 Ų21.82%0.02114%0.135CC..Hα-helixtrans-65.7-39.9176.4-76.4168.2000113.1K65 P69 V130 K131 C132 T136 V153 V156K65-L134 WeakPolarHBondContact CD-O 3.35Å; P69-L134 HydrophobicContact CG-CD1 4.03Å; V130-L134 HydrophobicContact CG1-CD1 3.91Å; V130-L134 HydrophobicContact CG1-CG 4.48Å; V130-L134 WeakPolarHBondContact O-CB 3.48Å; V130-L134 VanDerWaalsContact O-CG 3.31Å; V130-L134 WeakPolarHBondContact O-CG 3.3Å; V130-L134 PolarHBondContact O-N 3.43Å; K131-L134 PolarHBondContact O-N 3.14Å; C132-L134 PolarHBondContact O-N 3.43Å; L134-T136 PolarHBondContact O-N 3.17Å; L134-V153 HydrophobicContact CD1-CB 4.34Å; L134-V153 HydrophobicContact CD1-CG2 3.7Å; L134-V156 HydrophobicContact CD2-CB 4.47Å; L134-V156 HydrophobicContact CD2-CG2 3.52Å; L134-V156 HydrophobicContact CG-CG2 3.88Å
135Q89.5Confident88.4Confident2 Ų226.2 Ų26.21%0.00915%0.154CC..Hα-helixtrans-66.9-24.9-177.9-76.3175-38.800113.4T32 V35 K36 K65 K131 C132T32-Q135 HydrophobicContact CG2-CB 4.35Å; T32-Q135 HydrophobicContact CG2-CG 4.28Å; T32-Q135 PolarHBondContact OG1-NE2 2.89Å; T32-Q135 VanDerWaalsContact OG1-NE2 3.11Å; V35-Q135 HydrophobicContact CG1-CB 4.44Å; V35-Q135 VanDerWaalsContact CG2-OE1 3.3Å; K36-Q135 WeakPolarHBondContact CE-O 3.48Å; K65-Q135 VanDerWaalsContact O-CG 3.23Å; K65-Q135 WeakPolarHBondContact O-CG 2.82Å; K131-Q135 HydrophobicContact CG-CG 4.5Å; K131-Q135 VanDerWaalsContact O-CG 3.31Å; K131-Q135 WeakPolarHBondContact O-CG 3.3Å; K131-Q135 PolarHBondContact O-N 3.41Å; C132-Q135 PolarHBondContact O-N 3Å
136T88Confident88Confident0 Ų027.3 Ų27.30%016%0.159CC..Hα-helixtrans-115.22.6-176.354.60000113.5V35 K36 F40 C132 L134 Y138 E139 M140 V239V35-T136 HydrophobicContact CG1-CG2 3.77Å; K36-T136 HydrophobicContact CG-CG2 4.41Å; F40-T136 HydrophobicContact CE2-CG2 3.85Å; C132-T136 PolarHBondContact O-N 2.88Å; C132-T136 PolarHBondContact O-OG1 3.41Å; L134-T136 PolarHBondContact O-N 3.17Å; T136-Y138 VanDerWaalsContact C-N 3.27Å; T136-Y138 PolarHBondContact O-N 3.33Å; T136-E139 WeakPolarHBondContact CA-OE2 3.26Å; T136-E139 PolarHBondContact O-N 3.44Å; T136-M140 WeakPolarHBondContact O-CG 3.45Å; T136-M140 PolarHBondContact O-N 2.9Å; T136-V239 HydrophobicContact CG2-CG1 4.3Å; T136-V239 HydrophobicContact CG2-CG2 3.85Å; T136-V239 WeakPolarHBondContact OG1-CG1 3.35Å; T136-V239 WeakPolarHBondContact OG1-CG2 3.23Å
137M87.3Confident87.4Confident8 Ų830 Ų304%0.03919%0.185CC..Hα-helixtrans-56.2-43.4-174.9-161.894.6-156.300111.6R133 M140 E141 I146 N151 V156 M242R133-M137 WeakPolarHBondContact O-CA 3.5Å; R133-M137 WeakPolarHBondContact O-CB 3.34Å; R133-M137 PolarHBondContact O-N 2.98Å; M137-M140 PolarHBondContact O-N 3.24Å; M137-E141 WeakPolarHBondContact O-CG 3.34Å; M137-E141 PolarHBondContact O-N 3.27Å; M137-I146 HydrophobicContact CE-CD1 3.59Å; M137-I146 HydrophobicContact SD-CD1 4.48Å; M137-N151 VanDerWaalsContact CB-OD1 3.32Å; M137-N151 WeakPolarHBondContact CB-OD1 3.27Å; M137-N151 WeakPolarHBondContact CG-OD1 3.44Å; M137-V156 HydrophobicContact SD-CG2 3.87Å; M137-M242 HydrophobicContact CE-CE 3.59Å; M137-M242 HydrophobicContact CG-CE 4.3Å; M137-M242 HydrophobicContact SD-CE 3.28Å; M137-M242 WeakPolarHBondContact SD-CE 3.18Å
138Y85.5Confident86.7Confident62 Ų6238.4 Ų38.424%0.24322%0.219CC..Hα-helixtrans-64.3-48.3-178.5177.2-92.6000111.3Q57 V58 T136 M140 E141 T142Q57-Y138 HydrophobicContact CB-CD1 4.42Å; Q57-Y138 HydrophobicContact CB-CE1 3.55Å; Q57-Y138 HydrophobicContact CG-CE1 4.05Å; V58-Y138 HydrophobicContact CG2-CD1 3.63Å; V58-Y138 HydrophobicContact CG2-CD2 3.7Å; V58-Y138 HydrophobicContact CG2-CE1 4.02Å; V58-Y138 HydrophobicContact CG2-CE2 4.03Å; V58-Y138 HydrophobicContact CG2-CG 3.47Å; V58-Y138 VanDerWaalsContact CG2-CG 3.47Å; T136-Y138 VanDerWaalsContact C-N 3.27Å; T136-Y138 PolarHBondContact O-N 3.33Å; Y138-M140 VanDerWaalsContact C-N 3.27Å; Y138-M140 PolarHBondContact O-N 2.91Å; Y138-E141 PolarHBondContact O-N 3.08Å; Y138-E141 VanDerWaalsContact O-N 3.15Å; Y138-T142 PolarHBondContact O-N 3.28Å; Y138-T142 PolarHBondContact O-OG1 3.44Å; Y138-T142 VanDerWaalsContact O-OG1 3.13Å
139E85.7Confident85.9Confident4 Ų439.5 Ų39.52%0.01923%0.23CC..Hα-helixtrans-62.9-36.8179.5-67.969.9-156.500111.4K36 F40 L43 Y44 T136 S143K36-E139 WeakPolarHBondContact CE-OE1 3.26Å; K36-E139 IonicContact NZ-OE1 2.59Å; K36-E139 PolarHBondContact NZ-OE1 2.93Å; K36-E139 IonicContact NZ-OE2 3.22Å; F40-E139 HydrophobicContact CD2-CB 3.89Å; F40-E139 HydrophobicContact CD2-CG 4.1Å; F40-E139 HydrophobicContact CE1-CB 4.21Å; F40-E139 HydrophobicContact CE2-CB 3.38Å; F40-E139 HydrophobicContact CE2-CG 3.99Å; F40-E139 HydrophobicContact CG-CB 4.49Å; F40-E139 HydrophobicContact CZ-CB 3.56Å; L43-E139 HydrophobicContact CD2-CG 4.07Å; Y44-E139 VanDerWaalsContact OH-CG 3.24Å; Y44-E139 WeakPolarHBondContact OH-CG 3.41Å; Y44-E139 PolarHBondContact OH-OE1 3.34Å; Y44-E139 VanDerWaalsContact OH-OE1 3.07Å; T136-E139 WeakPolarHBondContact CA-OE2 3.26Å; T136-E139 PolarHBondContact O-N 3.44Å; E139-S143 WeakPolarHBondContact O-CB 3.38Å; E139-S143 PolarHBondContact O-N 3.05Å; E139-S143 PolarHBondContact O-OG 3.38Å
140M85.3Confident84.9Confident0 Ų045.8 Ų45.80%026%0.259CS..Hα-helixtrans-66.6-39.4175.1-69.3-65.3-83.300112.3F40 T136 M137 Y138 K145 I146 V239 M242F40-M140 HydrophobicContact CE1-SD 3.91Å; F40-M140 HydrophobicContact CZ-CG 3.9Å; F40-M140 HydrophobicContact CZ-SD 3.65Å; T136-M140 WeakPolarHBondContact O-CG 3.45Å; T136-M140 PolarHBondContact O-N 2.9Å; M137-M140 PolarHBondContact O-N 3.24Å; Y138-M140 VanDerWaalsContact C-N 3.27Å; Y138-M140 PolarHBondContact O-N 2.91Å; M140-K145 HydrophobicContact CE-CB 3.92Å; M140-K145 HydrophobicContact CE-CD 4.17Å; M140-K145 PolarHBondContact O-N 2.73Å; M140-K145 HydrophobicContact SD-CB 4.15Å; M140-K145 HydrophobicContact SD-CD 3.79Å; M140-I146 HydrophobicContact CB-CD1 3.48Å; M140-I146 VanDerWaalsContact CB-CD1 3.48Å; M140-I146 HydrophobicContact CB-CG1 3.74Å; M140-I146 HydrophobicContact CB-CG2 4.41Å; M140-I146 HydrophobicContact CE-CG2 4.23Å; M140-I146 PolarHBondContact O-N 3.47Å; M140-V239 HydrophobicContact CE-CG1 4.29Å; M140-V239 HydrophobicContact CG-CG1 3.88Å; M140-V239 HydrophobicContact SD-CG1 3.91Å; M140-M242 HydrophobicContact CE-CB 4.08Å; M140-M242 HydrophobicContact CG-SD 4.23Å
141E87.3Confident84.2Confident28 Ų2848.1 Ų48.113%0.13127%0.271CS..Hα-helixtrans-67.1-49.3175.8-72.6176.3168.900111.3M137 Y138 S143 G144 I146 S149M137-E141 WeakPolarHBondContact O-CG 3.34Å; M137-E141 PolarHBondContact O-N 3.27Å; Y138-E141 PolarHBondContact O-N 3.08Å; Y138-E141 VanDerWaalsContact O-N 3.15Å; E141-S143 VanDerWaalsContact C-N 3.32Å; E141-S143 PolarHBondContact O-N 3.24Å; E141-G144 PolarHBondContact O-N 3.15Å; E141-I146 HydrophobicContact CB-CG1 4.49Å; E141-I146 HydrophobicContact CG-CD1 3.94Å; E141-I146 HydrophobicContact CG-CG1 3.82Å; E141-S149 PolarHBondContact OE1-N 3.47Å; E141-S149 VanDerWaalsContact OE1-O 3.14Å
142T84.6Confident84Confident91 Ų9149.8 Ų49.856%0.55829%0.285SS*.Hα-helixtrans-67.8-32-179.3-54.80000112.3Y138 G144Y138-T142 PolarHBondContact O-N 3.28Å; Y138-T142 PolarHBondContact O-OG1 3.44Å; Y138-T142 VanDerWaalsContact O-OG1 3.13Å; T142-G144 PolarHBondContact O-N 3.44Å
143S83.4Confident83.9Confident62 Ų6251.6 Ų51.643%0.43430%0.295SS..THydrogen-bonded Turntrans-75.1-1173.7-56.50000113.4E139 E141 K145E139-S143 WeakPolarHBondContact O-CB 3.38Å; E139-S143 PolarHBondContact O-N 3.05Å; E139-S143 PolarHBondContact O-OG 3.38Å; E141-S143 VanDerWaalsContact C-N 3.32Å; E141-S143 PolarHBondContact O-N 3.24Å; S143-K145 PolarHBondContact O-N 2.87Å
144G82.2Confident83.8Confident64 Ų6459.7 Ų59.766%0.6633%0.326SS*.THydrogen-bonded Turntrans6712.7-177.100000114.4E141 T142 I146E141-G144 PolarHBondContact O-N 3.15Å; T142-G144 PolarHBondContact O-N 3.44Å; G144-I146 VanDerWaalsContact C-N 3.32Å
145K81.9Confident83.7Confident97 Ų9760.3 Ų60.342%0.42233%0.331SS..SBendtrans-77.5-21.2-179.5-70-178.5179.9173.30112.4M140 S143M140-K145 HydrophobicContact CE-CB 3.92Å; M140-K145 HydrophobicContact CE-CD 4.17Å; M140-K145 PolarHBondContact O-N 2.73Å; M140-K145 HydrophobicContact SD-CB 4.15Å; M140-K145 HydrophobicContact SD-CD 3.79Å; S143-K145 PolarHBondContact O-N 2.87Å
146I82.8Confident83.7Confident22 Ų2260.3 Ų60.311%0.11333%0.331CS..SBendtrans-139.1154.5174.566.5-178.8000110.4M137 M140 E141 G144 M242M137-I146 HydrophobicContact CE-CD1 3.59Å; M137-I146 HydrophobicContact SD-CD1 4.48Å; M140-I146 HydrophobicContact CB-CD1 3.48Å; M140-I146 VanDerWaalsContact CB-CD1 3.48Å; M140-I146 HydrophobicContact CB-CG1 3.74Å; M140-I146 HydrophobicContact CB-CG2 4.41Å; M140-I146 HydrophobicContact CE-CG2 4.23Å; M140-I146 PolarHBondContact O-N 3.47Å; E141-I146 HydrophobicContact CB-CG1 4.49Å; E141-I146 HydrophobicContact CG-CD1 3.94Å; E141-I146 HydrophobicContact CG-CG1 3.82Å; G144-I146 VanDerWaalsContact C-N 3.32Å; I146-M242 HydrophobicContact CD1-CE 3.54Å; I146-M242 HydrophobicContact CG2-CB 4.08Å
147A80.8Confident83.9Confident86 Ų8663 Ų6371%0.71135%0.345SS*.  trans-66.4146.4170.300000110.9S149A147-S149 PolarHBondContact O-N 3.03Å
148K77Confident84.1Confident194 Ų19466 Ų6684%0.84336%0.358SS*.  trans-57121.8175.4-163.2174.9-174.9176.90109.7
149S73.1Confident84.3Confident50 Ų5064.7 Ų64.735%0.3536%0.357SS..  trans-133174.2-175.9-155.60000111.1E141 A147E141-S149 PolarHBondContact OE1-N 3.47Å; E141-S149 VanDerWaalsContact OE1-O 3.14Å; A147-S149 PolarHBondContact O-N 3.03Å
150Q70.7Confident84.5Confident133 Ų13364.5 Ų64.562%0.62136%0.356SS*.  trans-72.4133.5175.7-71.7-68.2-29.200109.2T152 S155Q150-T152 PolarHBondContact O-N 3.25Å; Q150-T152 VanDerWaalsContact O-N 3.1Å; Q150-S155 VanDerWaalsContact O-CB 3.22Å; Q150-S155 WeakPolarHBondContact O-CB 3.31Å; Q150-S155 PolarHBondContact O-OG 3.49Å
151N77.9Confident84.8Confident55 Ų5568.6 Ų68.629%0.29438%0.378SS..  trans-8632.1-176.5-80.9-81.3000112.5K65 M137K65-N151 VanDerWaalsContact NZ-CG 3.27Å; K65-N151 PolarHBondContact NZ-OD1 3.27Å; M137-N151 VanDerWaalsContact CB-OD1 3.32Å; M137-N151 WeakPolarHBondContact CB-OD1 3.27Å; M137-N151 WeakPolarHBondContact CG-OD1 3.44Å
152T87.4Confident84.8Confident69 Ų6976.3 Ų76.342%0.42341%0.406SS..SBendtrans-103.6151.8-175.4670000111.6Q150 W154 S155 V156Q150-T152 PolarHBondContact O-N 3.25Å; Q150-T152 VanDerWaalsContact O-N 3.1Å; T152-W154 PolarHBondContact O-N 3.11Å; T152-S155 WeakPolarHBondContact O-CB 3.33Å; T152-S155 PolarHBondContact O-N 3.06Å; T152-S155 WeakPolarHBondContact OG1-CB 3.41Å; T152-S155 PolarHBondContact OG1-N 2.97Å; T152-V156 PolarHBondContact O-N 2.83Å; T152-V156 VanDerWaalsContact O-N 3.08Å
153V88.9Confident84.9Confident49 Ų4978 Ų7830%0.29741%0.406SS..Hα-helixtrans-52.1-46.7176.7-179.70000110.8V130 L134 S155 V156 I157V130-V153 HydrophobicContact CG1-CG1 4.02Å; L134-V153 HydrophobicContact CD1-CB 4.34Å; L134-V153 HydrophobicContact CD1-CG2 3.7Å; V153-S155 PolarHBondContact O-N 3.23Å; V153-V156 PolarHBondContact O-N 3.34Å; V153-I157 HydrophobicContact CG1-CD1 3.86Å; V153-I157 WeakPolarHBondContact O-CG1 3.01Å; V153-I157 PolarHBondContact O-N 2.95Å
154W90.2Very high85Confident173 Ų17377 Ų7766%0.65540%0.395SS*.Hα-helixtrans-65.2-36.3179.5-172.678.3000113.1T152 I157 K158T152-W154 PolarHBondContact O-N 3.11Å; W154-I157 PolarHBondContact O-N 3.41Å; W154-K158 HydrophobicContact CE3-CD 4.39Å; W154-K158 HydrophobicContact CH2-CD 3.7Å; W154-K158 HydrophobicContact CZ2-CD 4.01Å; W154-K158 HydrophobicContact CZ3-CD 3.88Å; W154-K158 VanDerWaalsContact O-CB 3.26Å; W154-K158 WeakPolarHBondContact O-CB 3.31Å; W154-K158 PolarHBondContact O-N 3.43Å
155S89.2Confident85.4Confident17 Ų1774.9 Ų74.912%0.11937%0.373CS..Hα-helixtrans-64.1-42.3175.4-173.20000111.6Q150 T152 V153 K158 S159Q150-S155 VanDerWaalsContact O-CB 3.22Å; Q150-S155 WeakPolarHBondContact O-CB 3.31Å; Q150-S155 PolarHBondContact O-OG 3.49Å; T152-S155 WeakPolarHBondContact O-CB 3.33Å; T152-S155 PolarHBondContact O-N 3.06Å; T152-S155 WeakPolarHBondContact OG1-CB 3.41Å; T152-S155 PolarHBondContact OG1-N 2.97Å; V153-S155 PolarHBondContact O-N 3.23Å; S155-K158 PolarHBondContact O-N 3.31Å; S155-S159 VanDerWaalsContact O-CB 3.26Å; S155-S159 WeakPolarHBondContact O-CB 3.28Å; S155-S159 PolarHBondContact O-N 2.85Å
156V89.6Confident85.7Confident3 Ų374.9 Ų74.92%0.01838%0.383CS..Hα-helixtrans-64.3-45.9176.3175.30000111.3V130 R133 L134 M137 T152 V153 K158 S159 I160V130-V156 HydrophobicContact CB-CG1 4.49Å; V130-V156 HydrophobicContact CG1-CB 4.42Å; V130-V156 HydrophobicContact CG1-CG1 4.13Å; V130-V156 HydrophobicContact CG2-CG1 4.4Å; R133-V156 HydrophobicContact CB-CG1 3.84Å; L134-V156 HydrophobicContact CD2-CB 4.47Å; L134-V156 HydrophobicContact CD2-CG2 3.52Å; L134-V156 HydrophobicContact CG-CG2 3.88Å; M137-V156 HydrophobicContact SD-CG2 3.87Å; T152-V156 PolarHBondContact O-N 2.83Å; T152-V156 VanDerWaalsContact O-N 3.08Å; V153-V156 PolarHBondContact O-N 3.34Å; V156-K158 PolarHBondContact O-N 2.9Å; V156-S159 WeakPolarHBondContact O-CB 3.48Å; V156-S159 PolarHBondContact O-N 3.47Å; V156-I160 HydrophobicContact CG1-CD1 3.97Å; V156-I160 VanDerWaalsContact O-CG1 3.31Å; V156-I160 WeakPolarHBondContact O-CG1 3.42Å; V156-I160 PolarHBondContact O-N 2.86Å
157I91.9Very high85.9Confident57 Ų5780.5 Ų80.529%0.29241%0.413SS..Hα-helixtrans-57.8-49.5175.9-70170.6000110.7V130 V153 W154 S159 I160 L161 F169V130-I157 HydrophobicContact CG2-CG1 4.08Å; V153-I157 HydrophobicContact CG1-CD1 3.86Å; V153-I157 WeakPolarHBondContact O-CG1 3.01Å; V153-I157 PolarHBondContact O-N 2.95Å; W154-I157 PolarHBondContact O-N 3.41Å; I157-S159 VanDerWaalsContact C-N 3.28Å; I157-S159 PolarHBondContact O-N 2.88Å; I157-I160 PolarHBondContact O-N 2.74Å; I157-L161 HydrophobicContact CG2-CD1 4.18Å; I157-L161 PolarHBondContact O-N 3.14Å; I157-F169 HydrophobicContact CB-CZ 4.4Å; I157-F169 HydrophobicContact CG1-CE1 4.32Å; I157-F169 HydrophobicContact CG2-CE1 4.39Å; I157-F169 HydrophobicContact CG2-CZ 3.86Å
158K92.1Very high86.2Confident71 Ų7176.4 Ų76.431%0.30938%0.379SS..Hα-helixtrans-63.7-35.1178.7-172.8173.1-177.9174.30112W154 S155 V156 R162W154-K158 HydrophobicContact CE3-CD 4.39Å; W154-K158 HydrophobicContact CH2-CD 3.7Å; W154-K158 HydrophobicContact CZ2-CD 4.01Å; W154-K158 HydrophobicContact CZ3-CD 3.88Å; W154-K158 VanDerWaalsContact O-CB 3.26Å; W154-K158 WeakPolarHBondContact O-CB 3.31Å; W154-K158 PolarHBondContact O-N 3.43Å; S155-K158 PolarHBondContact O-N 3.31Å; V156-K158 PolarHBondContact O-N 2.9Å; K158-R162 VanDerWaalsContact CE-NH2 3.26Å; K158-R162 WeakPolarHBondContact O-CB 3.13Å; K158-R162 VanDerWaalsContact O-CG 3.31Å; K158-R162 WeakPolarHBondContact O-CG 3.1Å; K158-R162 PolarHBondContact O-N 2.83Å
159S88.8Confident86.8Confident33 Ų3368.7 Ų68.723%0.23135%0.345CS..Hα-helixtrans-65.9-44.1175.6-168.30000111.7S155 V156 I157 R162 K163S155-S159 VanDerWaalsContact O-CB 3.26Å; S155-S159 WeakPolarHBondContact O-CB 3.28Å; S155-S159 PolarHBondContact O-N 2.85Å; V156-S159 WeakPolarHBondContact O-CB 3.48Å; V156-S159 PolarHBondContact O-N 3.47Å; I157-S159 VanDerWaalsContact C-N 3.28Å; I157-S159 PolarHBondContact O-N 2.88Å; S159-R162 PolarHBondContact O-N 2.93Å; S159-K163 WeakPolarHBondContact O-CB 3.42Å; S159-K163 WeakPolarHBondContact O-CG 3.26Å; S159-K163 PolarHBondContact O-N 3.34Å
160I89.1Confident87.5Confident0 Ų071.2 Ų71.20%035%0.348CS..Hα-helixtrans-59.2-54.1174.4-65.7158.7000109.8L129 V130 V156 I157 R162 K163 D164 G165 F169L129-I160 HydrophobicContact CD2-CD1 3.98Å; L129-I160 HydrophobicContact CG-CD1 4.4Å; V130-I160 HydrophobicContact CG2-CD1 3.89Å; V156-I160 HydrophobicContact CG1-CD1 3.97Å; V156-I160 VanDerWaalsContact O-CG1 3.31Å; V156-I160 WeakPolarHBondContact O-CG1 3.42Å; V156-I160 PolarHBondContact O-N 2.86Å; I157-I160 PolarHBondContact O-N 2.74Å; I160-R162 VanDerWaalsContact C-N 3.27Å; I160-R162 PolarHBondContact O-N 3Å; I160-K163 PolarHBondContact O-N 3.29Å; I160-D164 PolarHBondContact O-N 3.15Å; I160-G165 PolarHBondContact O-N 3.04Å; I160-F169 HydrophobicContact CB-CE1 4.08Å; I160-F169 HydrophobicContact CB-CE2 4.43Å; I160-F169 HydrophobicContact CB-CZ 3.95Å; I160-F169 HydrophobicContact CD1-CD1 3.96Å; I160-F169 HydrophobicContact CD1-CE1 3.56Å; I160-F169 HydrophobicContact CD1-CZ 4.28Å; I160-F169 HydrophobicContact CG1-CE1 4.41Å; I160-F169 HydrophobicContact CG2-CD1 4.05Å; I160-F169 HydrophobicContact CG2-CD2 3.99Å; I160-F169 HydrophobicContact CG2-CE1 3.94Å; I160-F169 HydrophobicContact CG2-CE2 3.87Å; I160-F169 HydrophobicContact CG2-CG 4.07Å; I160-F169 HydrophobicContact CG2-CZ 3.82Å
161L91.3Very high88.1Confident86 Ų8666.8 Ų66.845%0.4533%0.327SS..Hα-helixtrans-57.8-38.5-178.6-77.8171.2000113.1I157 G165 P166 F169I157-L161 HydrophobicContact CG2-CD1 4.18Å; I157-L161 PolarHBondContact O-N 3.14Å; L161-G165 VanDerWaalsContact O-CA 3.28Å; L161-G165 WeakPolarHBondContact O-CA 3.49Å; L161-G165 PolarHBondContact O-N 3.17Å; L161-P166 HydrophobicContact CD2-CB 4.36Å; L161-F169 HydrophobicContact CD2-CE2 3.65Å; L161-F169 HydrophobicContact CD2-CZ 4.43Å; L161-F169 HydrophobicContact CG-CE2 3.72Å; L161-F169 HydrophobicContact CG-CZ 4.01Å
162R89.1Confident88.3Confident190 Ų19064.6 Ų64.672%0.71732%0.317SS*.Hα-helixtrans-76.4-36.1-179.6-77.3-179.7170.7-171.8-7.5113.8K158 S159 I160K158-R162 VanDerWaalsContact CE-NH2 3.26Å; K158-R162 WeakPolarHBondContact O-CB 3.13Å; K158-R162 VanDerWaalsContact O-CG 3.31Å; K158-R162 WeakPolarHBondContact O-CG 3.1Å; K158-R162 PolarHBondContact O-N 2.83Å; S159-R162 PolarHBondContact O-N 2.93Å; I160-R162 VanDerWaalsContact C-N 3.27Å; I160-R162 PolarHBondContact O-N 3Å
163K86.6Confident88.3Confident128 Ų12863.2 Ų63.256%0.55731%0.307SS*.Hα-helixtrans-89.1-47.7-175.4-74-176.6170.8-175.70112.9S159 I160 M242S159-K163 WeakPolarHBondContact O-CB 3.42Å; S159-K163 WeakPolarHBondContact O-CG 3.26Å; S159-K163 PolarHBondContact O-N 3.34Å; I160-K163 PolarHBondContact O-N 3.29Å; K163-M242 PolarHBondContact NZ-O 3.38Å
164D85.5Confident88.3Confident41 Ų4164.6 Ų64.622%0.21932%0.319CS..THydrogen-bonded Turntrans-111.3-8.1-168.7-56.8-44.1000111.7R133 I160 H171 Q246R133-D164 IonicContact CZ-OD2 2.78Å; R133-D164 IonicContact NH1-OD2 3.44Å; R133-D164 IonicContact NH2-OD2 3.25Å; R133-D164 PolarHBondContact NH2-OD2 3.39Å; R133-D164 VanDerWaalsContact NH2-OD2 3.11Å; I160-D164 PolarHBondContact O-N 3.15Å; D164-H171 IonicContact OD1-NE2 3.23Å; D164-H171 IonicContact OD2-CD2 3.22Å; D164-Q246 PolarHBondContact OD1-NE2 2.81Å
165G89.1Confident88Confident19 Ų1956.4 Ų56.420%0.19629%0.288CS..  trans72.2-170.7-17300000113.3I160 L161 L167 G168I160-G165 PolarHBondContact O-N 3.04Å; L161-G165 VanDerWaalsContact O-CA 3.28Å; L161-G165 WeakPolarHBondContact O-CA 3.49Å; L161-G165 PolarHBondContact O-N 3.17Å; G165-L167 VanDerWaalsContact C-N 3.29Å; G165-L167 PolarHBondContact O-N 3.41Å; G165-G168 PolarHBondContact O-N 2.85Å; G165-G168 VanDerWaalsContact O-N 3.15Å
166P88.2Confident88Confident96 Ų9655.6 Ų55.662%0.62328%0.282SS*.G310 helixtrans-67-28.2179.826.7-34.2000113.2L161 G168 F169L161-P166 HydrophobicContact CD2-CB 4.36Å; P166-G168 PolarHBondContact O-N 3.2Å; P166-F169 WeakPolarHBondContact O-CD2 3.2Å; P166-F169 PolarHBondContact O-N 2.93Å
167L87.9Confident88Confident141 Ų14158 Ų5874%0.73830%0.295SS*.G310 helixtrans-70.5-18.1175.3-65.8176.1000112.5G165 F169 Y170G165-L167 VanDerWaalsContact C-N 3.29Å; G165-L167 PolarHBondContact O-N 3.41Å; L167-F169 PolarHBondContact O-N 3.27Å; L167-Y170 PolarHBondContact O-N 3.31Å
168G86.6Confident87.8Confident0 Ų058.7 Ų58.70%030%0.299CS..G310 helixtrans-59.2-25.6176.100000114.5L129 G165 P166 Y170 H171L129-G168 VanDerWaalsContact CD2-O 3.22Å; L129-G168 WeakPolarHBondContact CD2-O 3.21Å; G165-G168 PolarHBondContact O-N 2.85Å; G165-G168 VanDerWaalsContact O-N 3.15Å; P166-G168 PolarHBondContact O-N 3.2Å; G168-Y170 PolarHBondContact O-N 3.32Å; G168-H171 VanDerWaalsContact CA-CD2 3.5Å; G168-H171 WeakPolarHBondContact CA-CD2 3.39Å; G168-H171 WeakPolarHBondContact O-CB 3.13Å; G168-H171 PolarHBondContact O-CD2 3.07Å; G168-H171 PolarHBondContact O-N 3.4Å
169F88.8Confident87.6Confident31 Ų3157.5 Ų57.514%0.13629%0.292CS..G310 helixtrans-66.4-18.3176-71.3-75.8000113.9C125 P126 V130 I157 I160 L161 P166 L167C125-F169 PolarHBondContact SG-O 3.03Å; P126-F169 WeakPolarHBondContact CA-O 3.5Å; P126-F169 HydrophobicContact CB-CB 3.98Å; P126-F169 HydrophobicContact CB-CD1 4.22Å; P126-F169 HydrophobicContact CB-CG 4.44Å; P126-F169 HydrophobicContact CG-CB 4.12Å; V130-F169 HydrophobicContact CG2-CE1 4.22Å; I157-F169 HydrophobicContact CB-CZ 4.4Å; I157-F169 HydrophobicContact CG1-CE1 4.32Å; I157-F169 HydrophobicContact CG2-CE1 4.39Å; I157-F169 HydrophobicContact CG2-CZ 3.86Å; I160-F169 HydrophobicContact CB-CE1 4.08Å; I160-F169 HydrophobicContact CB-CE2 4.43Å; I160-F169 HydrophobicContact CB-CZ 3.95Å; I160-F169 HydrophobicContact CD1-CD1 3.96Å; I160-F169 HydrophobicContact CD1-CE1 3.56Å; I160-F169 HydrophobicContact CD1-CZ 4.28Å; I160-F169 HydrophobicContact CG1-CE1 4.41Å; I160-F169 HydrophobicContact CG2-CD1 4.05Å; I160-F169 HydrophobicContact CG2-CD2 3.99Å; I160-F169 HydrophobicContact CG2-CE1 3.94Å; I160-F169 HydrophobicContact CG2-CE2 3.87Å; I160-F169 HydrophobicContact CG2-CG 4.07Å; I160-F169 HydrophobicContact CG2-CZ 3.82Å; L161-F169 HydrophobicContact CD2-CE2 3.65Å; L161-F169 HydrophobicContact CD2-CZ 4.43Å; L161-F169 HydrophobicContact CG-CE2 3.72Å; L161-F169 HydrophobicContact CG-CZ 4.01Å; P166-F169 WeakPolarHBondContact O-CD2 3.2Å; P166-F169 PolarHBondContact O-N 2.93Å; L167-F169 PolarHBondContact O-N 3.27Å
170Y88.3Confident87.5Confident103 Ų10356.4 Ų56.440%0.40428%0.284SS..G310 helixtrans-96.813178.6-64.4-82.6000112.7L122 P126 L167 G168 G172 L173L122-Y170 WeakPolarHBondContact O-CE1 3.49Å; P126-Y170 HydrophobicContact CG-CE1 4.36Å; L167-Y170 PolarHBondContact O-N 3.31Å; G168-Y170 PolarHBondContact O-N 3.32Å; Y170-G172 PolarHBondContact O-N 3.24Å; Y170-G172 VanDerWaalsContact O-N 3.13Å; Y170-L173 HydrophobicContact CD1-CD1 4.47Å; Y170-L173 HydrophobicContact CD1-CD2 4.01Å; Y170-L173 VanDerWaalsContact O-CB 3.28Å; Y170-L173 WeakPolarHBondContact O-CB 3.44Å; Y170-L173 PolarHBondContact O-N 3.32Å
171H83.7Confident87.3Confident41 Ų4159 Ų5919%0.1930%0.299CS..THydrogen-bonded Turntrans-62.1117169.4-76.5-44.4000110.7L129 D164 G168 Q246L129-H171 HydrophobicContact CD1-CB 4.39Å; D164-H171 IonicContact OD1-NE2 3.23Å; D164-H171 IonicContact OD2-CD2 3.22Å; G168-H171 VanDerWaalsContact CA-CD2 3.5Å; G168-H171 WeakPolarHBondContact CA-CD2 3.39Å; G168-H171 WeakPolarHBondContact O-CB 3.13Å; G168-H171 PolarHBondContact O-CD2 3.07Å; G168-H171 PolarHBondContact O-N 3.4Å; H171-Q246 PolarHBondContact CE1-NE2 2.84Å; H171-Q246 PolarHBondContact CE1-OE1 3.49Å; H171-Q246 PolarHBondContact NE2-NE2 3.33Å
172G82.9Confident87Confident9 Ų956.7 Ų56.79%0.09329%0.29CS..THydrogen-bonded Turntrans92.27.5-173.500000114.2Y170 S174 S175 T176Y170-G172 PolarHBondContact O-N 3.24Å; Y170-G172 VanDerWaalsContact O-N 3.13Å; G172-S174 VanDerWaalsContact C-N 3.29Å; G172-S174 PolarHBondContact O-N 3.5Å; G172-S175 VanDerWaalsContact CA-OG 3.3Å; G172-S175 WeakPolarHBondContact CA-OG 3.45Å; G172-S175 CarbonylContact O-C 3.53Å; G172-S175 WeakPolarHBondContact O-CA 3.48Å; G172-S175 PolarHBondContact O-N 2.98Å; G172-S175 PolarHBondContact O-OG 3.48Å; G172-T176 PolarHBondContact O-N 2.93Å; G172-T176 PolarHBondContact O-OG1 2.98Å; G172-T176 VanDerWaalsContact O-OG1 3.08Å
173L87Confident86.8Confident39 Ų3947.7 Ų47.720%0.20426%0.256CS..Hα-helixtrans-55.7-43.2177.517761.3000112.3L122 C125 Y170 S175 T176 L177L122-L173 HydrophobicContact CD2-CD1 3.97Å; L122-L173 HydrophobicContact CD2-CD2 4.05Å; C125-L173 HydrophobicContact CB-CD1 4.14Å; Y170-L173 HydrophobicContact CD1-CD1 4.47Å; Y170-L173 HydrophobicContact CD1-CD2 4.01Å; Y170-L173 VanDerWaalsContact O-CB 3.28Å; Y170-L173 WeakPolarHBondContact O-CB 3.44Å; Y170-L173 PolarHBondContact O-N 3.32Å; L173-S175 VanDerWaalsContact C-N 3.3Å; L173-S175 PolarHBondContact O-N 3Å; L173-T176 PolarHBondContact O-N 2.87Å; L173-T176 VanDerWaalsContact O-N 3.14Å; L173-L177 HydrophobicContact CD1-CD1 4.21Å; L173-L177 HydrophobicContact CD1-CG 4.14Å; L173-L177 HydrophobicContact CG-CD1 4.05Å; L173-L177 HydrophobicContact CG-CG 4.43Å; L173-L177 WeakPolarHBondContact O-CG 3.43Å; L173-L177 PolarHBondContact O-N 3.45Å
174S87.7Confident86.7Confident79 Ų7944.5 Ų44.555%0.55224%0.241SC*.Hα-helixtrans-60.5-39.7175.654.50000112.3G172 L178G172-S174 VanDerWaalsContact C-N 3.29Å; G172-S174 PolarHBondContact O-N 3.5Å; S174-L178 VanDerWaalsContact O-CB 3.23Å; S174-L178 WeakPolarHBondContact O-CB 3.44Å; S174-L178 PolarHBondContact O-N 3.49Å
175S85.6Confident86.6Confident0 Ų048 Ų480%026%0.255CS..Hα-helixtrans-70.5-32.4174.661.20000113G172 L173 R179 V230 K234G172-S175 VanDerWaalsContact CA-OG 3.3Å; G172-S175 WeakPolarHBondContact CA-OG 3.45Å; G172-S175 CarbonylContact O-C 3.53Å; G172-S175 WeakPolarHBondContact O-CA 3.48Å; G172-S175 PolarHBondContact O-N 2.98Å; G172-S175 PolarHBondContact O-OG 3.48Å; L173-S175 VanDerWaalsContact C-N 3.3Å; L173-S175 PolarHBondContact O-N 3Å; S175-R179 WeakPolarHBondContact O-CB 3.29Å; S175-R179 PolarHBondContact O-N 2.84Å; S175-V230 WeakPolarHBondContact O-CG1 3.39Å; S175-K234 WeakPolarHBondContact OG-CG 3.2Å
176T88Confident86.5Confident0 Ų051.6 Ų51.60%027%0.265CS..Hα-helixtrans-67.9-47.7173.6-53.80000110.3A121 G172 L173 L178 R179 E180 K234A121-T176 HydrophobicContact CB-CG2 3.77Å; G172-T176 PolarHBondContact O-N 2.93Å; G172-T176 PolarHBondContact O-OG1 2.98Å; G172-T176 VanDerWaalsContact O-OG1 3.08Å; L173-T176 PolarHBondContact O-N 2.87Å; L173-T176 VanDerWaalsContact O-N 3.14Å; T176-L178 PolarHBondContact O-N 3.49Å; T176-R179 WeakPolarHBondContact O-CA 3.41Å; T176-R179 WeakPolarHBondContact O-CB 3.24Å; T176-R179 PolarHBondContact O-N 3.08Å; T176-E180 HydrophobicContact CG2-CG 4.32Å; T176-E180 WeakPolarHBondContact O-CG 3.28Å; T176-E180 PolarHBondContact O-N 3.49Å; T176-K234 VanDerWaalsContact OG1-CE 3.29Å; T176-K234 WeakPolarHBondContact OG1-CE 3.28Å
177L89.3Confident86.4Confident55 Ų5550.1 Ų50.129%0.28825%0.249SC..Hα-helixtrans-61-43.4176.3-73169.8000112.1A118 A121 L173 R179 E180 V181A118-L177 HydrophobicContact CB-CD2 3.86Å; A121-L177 HydrophobicContact CB-CD2 3.62Å; A121-L177 HydrophobicContact CB-CG 4.17Å; L173-L177 HydrophobicContact CD1-CD1 4.21Å; L173-L177 HydrophobicContact CD1-CG 4.14Å; L173-L177 HydrophobicContact CG-CD1 4.05Å; L173-L177 HydrophobicContact CG-CG 4.43Å; L173-L177 WeakPolarHBondContact O-CG 3.43Å; L173-L177 PolarHBondContact O-N 3.45Å; L177-R179 PolarHBondContact O-N 3.39Å; L177-E180 PolarHBondContact O-N 3.27Å; L177-V181 WeakPolarHBondContact O-CB 3.36Å; L177-V181 PolarHBondContact O-N 3.36Å
178L88.2Confident86.2Confident71 Ų7145.7 Ų45.737%0.37222%0.224SC..Hα-helixtrans-66.1-20.8176.4-171.964.6000112.8S174 T176 P182 V230 F249S174-L178 VanDerWaalsContact O-CB 3.23Å; S174-L178 WeakPolarHBondContact O-CB 3.44Å; S174-L178 PolarHBondContact O-N 3.49Å; T176-L178 PolarHBondContact O-N 3.49Å; L178-P182 HydrophobicContact CD1-CG 4.18Å; L178-P182 WeakPolarHBondContact O-CD 3.45Å; L178-P182 WeakPolarHBondContact O-CG 3.22Å; L178-V230 HydrophobicContact CB-CG1 4.02Å; L178-V230 HydrophobicContact CD2-CG1 4.17Å; L178-V230 HydrophobicContact CD2-CG2 4.07Å; L178-V230 HydrophobicContact CG-CG1 4.09Å; L178-V230 HydrophobicContact CG-CG2 4.03Å; L178-F249 HydrophobicContact CD2-CD1 4.05Å; L178-F249 HydrophobicContact CD2-CE1 3.47Å; L178-F249 VanDerWaalsContact CD2-CE1 3.47Å; L178-F249 HydrophobicContact CD2-CE2 4.06Å; L178-F249 HydrophobicContact CD2-CZ 3.48Å; L178-F249 VanDerWaalsContact CD2-CZ 3.48Å
179R87.3Confident86.2Confident45 Ų4547 Ų4717%0.1724%0.236CC..Hα-helixtrans-81.4-52.4171-174.2-167.279.7155.71.2110.9E128 S175 T176 L177 G183 V227 V230 D231E128-R179 IonicContact OE1-CZ 2.63Å; E128-R179 IonicContact OE1-NH1 3.51Å; E128-R179 PolarHBondContact OE1-NH1 2.9Å; E128-R179 IonicContact OE1-NH2 3.05Å; E128-R179 PolarHBondContact OE1-NH2 3.06Å; S175-R179 WeakPolarHBondContact O-CB 3.29Å; S175-R179 PolarHBondContact O-N 2.84Å; T176-R179 WeakPolarHBondContact O-CA 3.41Å; T176-R179 WeakPolarHBondContact O-CB 3.24Å; T176-R179 PolarHBondContact O-N 3.08Å; L177-R179 PolarHBondContact O-N 3.39Å; R179-G183 VanDerWaalsContact O-CA 3.22Å; R179-G183 WeakPolarHBondContact O-CA 3.5Å; R179-G183 PolarHBondContact O-N 2.91Å; R179-V227 HydrophobicContact CG-CB 3.95Å; R179-V227 HydrophobicContact CG-CG1 4.36Å; R179-V227 HydrophobicContact CG-CG2 4.3Å; R179-V227 WeakPolarHBondContact O-CG1 3.42Å; R179-V230 HydrophobicContact CB-CG1 4.06Å; R179-D231 WeakPolarHBondContact CD-OD1 3.49Å; R179-D231 IonicContact NE-OD1 3.99Å; R179-D231 IonicContact NH1-OD1 2.71Å
180E86.7Confident86.1Confident10 Ų1045.8 Ų45.85%0.04723%0.233CC..Hα-helixtrans-64.3-50.9-172.8-70.4-41.1124.800112.5S117 A121 T176 L177 G183 Y184S117-E180 PolarHBondContact OG-O 3.07Å; A121-E180 HydrophobicContact CB-CG 3.9Å; T176-E180 HydrophobicContact CG2-CG 4.32Å; T176-E180 WeakPolarHBondContact O-CG 3.28Å; T176-E180 PolarHBondContact O-N 3.49Å; L177-E180 PolarHBondContact O-N 3.27Å; E180-G183 PolarHBondContact O-N 3.44Å; E180-Y184 WeakPolarHBondContact O-CD2 3.23Å; E180-Y184 PolarHBondContact O-N 2.71Å
181V85.6Confident85.9Confident54 Ų5443.3 Ų43.333%0.32722%0.223SC..Hα-helixtrans-69.6-58.7-169.61700000110.5S114 A118 L177 G183 F185S114-V181 WeakPolarHBondContact OG-CG1 3.45Å; S114-V181 PolarHBondContact OG-O 3.02Å; S114-V181 VanDerWaalsContact OG-O 3.07Å; A118-V181 HydrophobicContact CB-CG2 4.18Å; L177-V181 WeakPolarHBondContact O-CB 3.36Å; L177-V181 PolarHBondContact O-N 3.36Å; V181-G183 VanDerWaalsContact C-N 3.25Å; V181-G183 PolarHBondContact O-N 3.38Å; V181-F185 PolarHBondContact O-N 2.84Å
182P84.4Confident85.9Confident39 Ų3942.5 Ų42.525%0.25322%0.22SC..Hα-helixtrans-59.2-35.3171.2-25.434.9000113.4L178 F185 F186L178-P182 HydrophobicContact CD1-CG 4.18Å; L178-P182 WeakPolarHBondContact O-CD 3.45Å; L178-P182 WeakPolarHBondContact O-CG 3.22Å; P182-F185 WeakPolarHBondContact O-CB 3.37Å; P182-F185 PolarHBondContact O-N 3.44Å; P182-F186 HydrophobicContact CB-CD2 4.18Å; P182-F186 HydrophobicContact CB-CE2 4.17Å; P182-F186 WeakPolarHBondContact O-CD2 3.43Å; P182-F186 PolarHBondContact O-N 3.18Å
183G86.3Confident86.1Confident1 Ų148.3 Ų48.31%0.0125%0.248CC..Hα-helixtrans-59-54.1-17800000112.2R179 E180 V181 F185 F186 F187 L223R179-G183 VanDerWaalsContact O-CA 3.22Å; R179-G183 WeakPolarHBondContact O-CA 3.5Å; R179-G183 PolarHBondContact O-N 2.91Å; E180-G183 PolarHBondContact O-N 3.44Å; V181-G183 VanDerWaalsContact C-N 3.25Å; V181-G183 PolarHBondContact O-N 3.38Å; G183-F185 VanDerWaalsContact C-N 3.27Å; G183-F185 PolarHBondContact O-N 3.46Å; G183-F186 PolarHBondContact O-N 3.27Å; G183-F187 WeakPolarHBondContact O-CB 3.16Å; G183-F187 PolarHBondContact O-N 3.34Å; G183-L223 WeakPolarHBondContact O-CD1 3.45Å
184Y83.1Confident86.1Confident61 Ų6147 Ų4724%0.23924%0.242CC..Hα-helixtrans-58.5-41.5175.1-90.1-81.8000111.8S117 E180 F186 F187 F188S117-Y184 VanDerWaalsContact CB-CD2 3.43Å; E180-Y184 WeakPolarHBondContact O-CD2 3.23Å; E180-Y184 PolarHBondContact O-N 2.71Å; Y184-F186 PolarHBondContact O-N 2.96Å; Y184-F187 PolarHBondContact O-N 2.9Å; Y184-F188 HydrophobicContact CD1-CD2 4.37Å; Y184-F188 AromaticContact CD1-CE2 3.75Å; Y184-F188 HydrophobicContact CD1-CE2 3.75Å; Y184-F188 HydrophobicContact CE1-CE2 4.47Å; Y184-F188 WeakPolarHBondContact O-CD2 3.01Å; Y184-F188 PolarHBondContact O-N 3.43Å; Y184-F188 VanDerWaalsContact O-N 3.08Å
185F83.7Confident85.9Confident115 Ų11544.3 Ų44.350%0.50422%0.22SC..Hα-helixtrans-58.5-48.9176.3-179-94.6000112.8V181 P182 G183 G189V181-F185 PolarHBondContact O-N 2.84Å; P182-F185 WeakPolarHBondContact O-CB 3.37Å; P182-F185 PolarHBondContact O-N 3.44Å; G183-F185 VanDerWaalsContact C-N 3.27Å; G183-F185 PolarHBondContact O-N 3.46Å; F185-G189 PolarHBondContact O-N 2.94Å
186F86.8Confident85.9Confident94 Ų9447 Ų4741%0.41224%0.239SC..Hα-helixtrans-70.8-33.3179.5-77-68.2000113.3P182 G183 Y184 G190 C222 A226P182-F186 HydrophobicContact CB-CD2 4.18Å; P182-F186 HydrophobicContact CB-CE2 4.17Å; P182-F186 WeakPolarHBondContact O-CD2 3.43Å; P182-F186 PolarHBondContact O-N 3.18Å; G183-F186 PolarHBondContact O-N 3.27Å; Y184-F186 PolarHBondContact O-N 2.96Å; F186-G190 PolarHBondContact O-N 3.04Å; F186-C222 WeakPolarHBondContact O-CB 3.32Å; F186-A226 HydrophobicContact CB-CB 4.06Å; F186-A226 HydrophobicContact CD1-CB 4.25Å; F186-A226 HydrophobicContact CD2-CB 3.31Å; F186-A226 HydrophobicContact CE2-CB 3.74Å; F186-A226 HydrophobicContact CG-CB 3.62Å; F186-A226 HydrophobicContact CZ-CB 4.37Å
187F86.9Confident85.9Confident64 Ų6454.3 Ų54.328%0.28127%0.271SS..Hα-helixtrans-57.6-54.7172.9-179.7-97.2000110.8G183 Y184 G190 Y191 G219 L223G183-F187 WeakPolarHBondContact O-CB 3.16Å; G183-F187 PolarHBondContact O-N 3.34Å; Y184-F187 PolarHBondContact O-N 2.9Å; F187-G190 PolarHBondContact O-N 3.38Å; F187-Y191 VanDerWaalsContact O-CB 3.29Å; F187-Y191 WeakPolarHBondContact O-CB 3.34Å; F187-Y191 PolarHBondContact O-N 2.9Å; F187-G219 WeakPolarHBondContact CA-O 3.41Å; F187-G219 VanDerWaalsContact CD2-C 3.46Å; F187-G219 VanDerWaalsContact O-CA 3.23Å; F187-G219 WeakPolarHBondContact O-CA 3.42Å; F187-L223 HydrophobicContact CB-CB 3.98Å; F187-L223 HydrophobicContact CB-CD1 4.25Å; F187-L223 HydrophobicContact CD2-CB 4.18Å; F187-L223 HydrophobicContact CD2-CD2 4.21Å
188F84Confident85.7Confident49 Ų4955.3 Ų55.322%0.21527%0.273CS..Hα-helixtrans-69.3-37.9-179.6-75.2-65.3000112.4A110 Y184 Y191 E192A110-F188 HydrophobicContact CB-CB 3.42Å; A110-F188 VanDerWaalsContact CB-CB 3.42Å; A110-F188 HydrophobicContact CB-CD1 4.19Å; A110-F188 HydrophobicContact CB-CD2 3.37Å; A110-F188 HydrophobicContact CB-CE2 4.11Å; A110-F188 HydrophobicContact CB-CG 3.41Å; A110-F188 VanDerWaalsContact CB-CG 3.41Å; Y184-F188 HydrophobicContact CD1-CD2 4.37Å; Y184-F188 AromaticContact CD1-CE2 3.75Å; Y184-F188 HydrophobicContact CD1-CE2 3.75Å; Y184-F188 HydrophobicContact CE1-CE2 4.47Å; Y184-F188 WeakPolarHBondContact O-CD2 3.01Å; Y184-F188 PolarHBondContact O-N 3.43Å; Y184-F188 VanDerWaalsContact O-N 3.08Å; F188-Y191 WeakPolarHBondContact O-CB 3.48Å; F188-Y191 PolarHBondContact O-N 3.39Å; F188-E192 WeakPolarHBondContact O-CB 3.44Å; F188-E192 PolarHBondContact O-N 3.46Å
189G85.4Confident85.4Confident26 Ų2652.3 Ų52.327%0.26826%0.258SS..Hα-helixtrans-59-47.6174.900000112.1F185 E192 L193F185-G189 PolarHBondContact O-N 2.94Å; G189-E192 PolarHBondContact O-N 3.41Å; G189-L193 WeakPolarHBondContact O-CB 3.45Å; G189-L193 VanDerWaalsContact O-CG 3.23Å; G189-L193 WeakPolarHBondContact O-CG 3.16Å; G189-L193 PolarHBondContact O-N 2.95Å
190G86.5Confident84.7Confident6 Ų655 Ų556%0.06228%0.284CS..Hα-helixtrans-64.3-41.1175.300000112.8F186 F187 S194F186-G190 PolarHBondContact O-N 3.04Å; F187-G190 PolarHBondContact O-N 3.38Å; G190-S194 VanDerWaalsContact O-CB 3.26Å; G190-S194 WeakPolarHBondContact O-CB 3.26Å; G190-S194 PolarHBondContact O-N 2.72Å
191Y84.8Confident83.9Confident51 Ų5158.6 Ų58.620%0.232%0.324CS..Hα-helixtrans-59.8-49175.9-178-102.5000112.2F187 F188 S194 R195F187-Y191 VanDerWaalsContact O-CB 3.29Å; F187-Y191 WeakPolarHBondContact O-CB 3.34Å; F187-Y191 PolarHBondContact O-N 2.9Å; F188-Y191 WeakPolarHBondContact O-CB 3.48Å; F188-Y191 PolarHBondContact O-N 3.39Å; Y191-S194 PolarHBondContact O-N 2.98Å; Y191-R195 HydrophobicContact CE1-CG 4.25Å; Y191-R195 VanDerWaalsContact CZ-CD 3.48Å; Y191-R195 WeakPolarHBondContact O-CG 3.32Å; Y191-R195 PolarHBondContact O-N 3.49Å
192E84Confident83.2Confident25 Ų2565.3 Ų65.312%0.11734%0.343CS..Hα-helixtrans-72.3-38.1-177-79.1-55.9126.800113.4D106 F188 G189 S194 R195 S196 K204D106-E192 HydrophobicContact CB-CG 3.85Å; D106-E192 WeakPolarHBondContact CB-OE1 3.44Å; D106-E192 VanDerWaalsContact CG-OE1 3.29Å; F188-E192 WeakPolarHBondContact O-CB 3.44Å; F188-E192 PolarHBondContact O-N 3.46Å; G189-E192 PolarHBondContact O-N 3.41Å; E192-S194 VanDerWaalsContact C-N 3.33Å; E192-R195 PolarHBondContact O-N 2.91Å; E192-R195 IonicContact OE1-CZ 3.46Å; E192-R195 IonicContact OE1-NH1 3.87Å; E192-R195 PolarHBondContact OE1-NH1 3.42Å; E192-S196 WeakPolarHBondContact O-CB 3.29Å; E192-S196 PolarHBondContact O-N 2.89Å; E192-S196 PolarHBondContact O-OG 3.02Å; E192-K204 IonicContact OE2-NZ 3.99Å; E192-K204 PolarHBondContact OE2-NZ 3.45Å
193L87Confident82.6Confident131 Ų13166.3 Ų66.369%0.68635%0.351SS*.Hα-helixtrans-61.9-44.1172.7-73.8171.8000110.7G189 S196 F197G189-L193 WeakPolarHBondContact O-CB 3.45Å; G189-L193 VanDerWaalsContact O-CG 3.23Å; G189-L193 WeakPolarHBondContact O-CG 3.16Å; G189-L193 PolarHBondContact O-N 2.95Å; L193-S196 PolarHBondContact O-N 2.84Å; L193-F197 WeakPolarHBondContact O-CB 3.2Å; L193-F197 PolarHBondContact O-N 3.35Å
194S86.3Confident81.9Confident11 Ų1169.6 Ų69.68%0.07737%0.365CS..Hα-helixtrans-65.2-42.9177.1-177.70000112.3G190 Y191 E192 S196 F197 F198 S215G190-S194 VanDerWaalsContact O-CB 3.26Å; G190-S194 WeakPolarHBondContact O-CB 3.26Å; G190-S194 PolarHBondContact O-N 2.72Å; Y191-S194 PolarHBondContact O-N 2.98Å; E192-S194 VanDerWaalsContact C-N 3.33Å; S194-S196 VanDerWaalsContact C-N 3.34Å; S194-S196 PolarHBondContact O-N 3.5Å; S194-F197 WeakPolarHBondContact O-CB 3.5Å; S194-F197 PolarHBondContact O-N 3.03Å; S194-F198 WeakPolarHBondContact O-CD2 3.41Å; S194-F198 PolarHBondContact O-N 2.89Å; S194-F198 VanDerWaalsContact OG-CE2 3.32Å; S194-F198 WeakPolarHBondContact OG-CE2 3.47Å; S194-S215 VanDerWaalsContact OG-CA 3.25Å; S194-S215 WeakPolarHBondContact OG-CA 3.23Å; S194-S215 WeakPolarHBondContact OG-CB 3.2Å; S194-S215 PolarHBondContact OG-OG 3.32Å
195R84.6Confident81.3Confident22 Ų2273.4 Ų73.48%0.08339%0.39CS..Hα-helixtrans-61.7-42.7175-77.7-179.271.8-168.212112.1D106 Y191 E192 F197 F198 A199 K204 L207 S215D106-R195 IonicContact OD1-NH1 3.94Å; D106-R195 IonicContact OD2-NH1 3.11Å; D106-R195 PolarHBondContact OD2-NH1 3.48Å; Y191-R195 HydrophobicContact CE1-CG 4.25Å; Y191-R195 VanDerWaalsContact CZ-CD 3.48Å; Y191-R195 WeakPolarHBondContact O-CG 3.32Å; Y191-R195 PolarHBondContact O-N 3.49Å; E192-R195 PolarHBondContact O-N 2.91Å; E192-R195 IonicContact OE1-CZ 3.46Å; E192-R195 IonicContact OE1-NH1 3.87Å; E192-R195 PolarHBondContact OE1-NH1 3.42Å; R195-F197 VanDerWaalsContact C-N 3.29Å; R195-F197 PolarHBondContact O-N 3.3Å; R195-F198 PolarHBondContact O-N 3.29Å; R195-A199 WeakPolarHBondContact O-CB 3.32Å; R195-A199 PolarHBondContact O-N 3.36Å; R195-K204 PolarHBondContact NH2-O 3.04Å; R195-K204 VanDerWaalsContact NH2-O 3.17Å; R195-L207 HydrophobicContact CB-CD1 3.91Å; R195-L207 HydrophobicContact CG-CD1 3.91Å; R195-S215 PolarHBondContact N-OG 2.87Å
196S85.2Confident80.9Confident57 Ų5774.6 Ų74.640%0.39940%0.397SS..Hα-helixtrans-64.6-37.6178.7-55.40000111.2E192 L193 S194 S200 K204E192-S196 WeakPolarHBondContact O-CB 3.29Å; E192-S196 PolarHBondContact O-N 2.89Å; E192-S196 PolarHBondContact O-OG 3.02Å; L193-S196 PolarHBondContact O-N 2.84Å; S194-S196 VanDerWaalsContact C-N 3.34Å; S194-S196 PolarHBondContact O-N 3.5Å; S196-S200 PolarHBondContact O-N 3.28Å; S196-K204 WeakPolarHBondContact OG-CE 3.25Å; S196-K204 PolarHBondContact OG-NZ 3.17Å
197F87Confident80.5Confident153 Ų15371.2 Ų71.267%0.67138%0.383SS*.Hα-helixtrans-62.8-50.2172.6-178.8-97.5000112L193 S194 R195 A199 S200L193-F197 WeakPolarHBondContact O-CB 3.2Å; L193-F197 PolarHBondContact O-N 3.35Å; S194-F197 WeakPolarHBondContact O-CB 3.5Å; S194-F197 PolarHBondContact O-N 3.03Å; R195-F197 VanDerWaalsContact C-N 3.29Å; R195-F197 PolarHBondContact O-N 3.3Å; F197-A199 VanDerWaalsContact C-N 3.34Å; F197-A199 PolarHBondContact O-N 2.93Å; F197-S200 PolarHBondContact O-N 3.2Å; F197-S200 PolarHBondContact O-OG 2.89Å
198F85Confident80.3Confident76 Ų7669.6 Ų69.633%0.33339%0.385SS..Hα-helixtrans-69.2-29.4178.8-74.7-61.7000114S194 R195 S200 L207 P211 L214 S215S194-F198 WeakPolarHBondContact O-CD2 3.41Å; S194-F198 PolarHBondContact O-N 2.89Å; S194-F198 VanDerWaalsContact OG-CE2 3.32Å; S194-F198 WeakPolarHBondContact OG-CE2 3.47Å; R195-F198 PolarHBondContact O-N 3.29Å; F198-S200 VanDerWaalsContact C-N 3.31Å; F198-L207 HydrophobicContact CB-CD2 3.8Å; F198-P211 HydrophobicContact CB-CB 3.95Å; F198-P211 HydrophobicContact CD1-CB 4.4Å; F198-P211 HydrophobicContact CD2-CB 4.17Å; F198-P211 HydrophobicContact CG-CB 3.93Å; F198-L214 HydrophobicContact CE1-CD1 4.2Å; F198-L214 HydrophobicContact CE2-CB 3.75Å; F198-L214 HydrophobicContact CE2-CD1 4.35Å; F198-L214 HydrophobicContact CZ-CB 3.87Å; F198-L214 HydrophobicContact CZ-CD1 3.65Å; F198-L214 HydrophobicContact CZ-CG 4.43Å; F198-S215 WeakPolarHBondContact CD2-OG 3.48Å
199A82.6Confident80.3Confident8 Ų872 Ų727%0.06641%0.405CS..Hα-helixtrans-66.8-35178.100000111.2R195 F197 G201 R202 K204 L207R195-A199 WeakPolarHBondContact O-CB 3.32Å; R195-A199 PolarHBondContact O-N 3.36Å; F197-A199 VanDerWaalsContact C-N 3.34Å; F197-A199 PolarHBondContact O-N 2.93Å; A199-G201 PolarHBondContact O-N 2.99Å; A199-R202 WeakPolarHBondContact O-CB 3.47Å; A199-R202 PolarHBondContact O-N 3.48Å; A199-K204 HydrophobicContact CB-CG 4.34Å; A199-L207 HydrophobicContact CB-CD2 4.46Å
200S73.4Confident80.3Confident103 Ų10375.3 Ų75.372%0.7242%0.42SS*.THydrogen-bonded Turntrans40.942.8172.5-76.50000114S196 F197 F198S196-S200 PolarHBondContact O-N 3.28Å; F197-S200 PolarHBondContact O-N 3.2Å; F197-S200 PolarHBondContact O-OG 2.89Å; F198-S200 VanDerWaalsContact C-N 3.31Å
201G68.9Low80.3Confident85 Ų8576.6 Ų76.688%0.87643%0.427SS*.THydrogen-bonded Turntrans98-7.6-179.900000116.6A199A199-G201 PolarHBondContact O-N 2.99Å
202R70.5Confident80.3Confident194 Ų19476.9 Ų76.973%0.73243%0.432SS*.SBendtrans-86.4165.3170.1-61.3-175.6-178.51710.3111.5A199 K204A199-R202 WeakPolarHBondContact O-CB 3.47Å; A199-R202 PolarHBondContact O-N 3.48Å; R202-K204 PolarHBondContact O-N 3.3Å
203S72.7Confident80.2Confident61 Ų6182.5 Ų82.543%0.42746%0.46SS..  trans-64.2136.4173.7-176.90000110.2D205 E206S203-D205 PolarHBondContact O-N 3.42Å; S203-E206 PolarHBondContact O-N 2.92Å
204K70.8Confident80.3Confident69 Ų6980.6 Ų80.630%0.345%0.45SS..G310 helixtrans-60.6-17177.4-68.2-176.5176.3-174.10113.3E192 R195 S196 A199 R202E192-K204 IonicContact OE2-NZ 3.99Å; E192-K204 PolarHBondContact OE2-NZ 3.45Å; R195-K204 PolarHBondContact NH2-O 3.04Å; R195-K204 VanDerWaalsContact NH2-O 3.17Å; S196-K204 WeakPolarHBondContact OG-CE 3.25Å; S196-K204 PolarHBondContact OG-NZ 3.17Å; A199-K204 HydrophobicContact CB-CG 4.34Å; R202-K204 PolarHBondContact O-N 3.3Å
205D71.3Confident80.3Confident141 Ų14180.1 Ų80.175%0.75445%0.446SS*.G310 helixtrans-81.9-15.3178.8-61.6-30.3000112.6S203 L207S203-D205 PolarHBondContact O-N 3.42Å; D205-L207 VanDerWaalsContact C-N 3.33Å
206E75.2Confident80.3Confident140 Ų14080.1 Ų80.165%0.65445%0.454SS*.G310 helixtrans-89.91177.3-64-177.9163.400112.9S203 G208S203-E206 PolarHBondContact O-N 2.92Å; E206-G208 PolarHBondContact O-N 3Å
207L77.9Confident80.4Confident23 Ų2379.3 Ų79.312%0.1245%0.454CS..  trans-65.6120178.6-71.9172.2000110R195 F198 A199 D205 P211 L212R195-L207 HydrophobicContact CB-CD1 3.91Å; R195-L207 HydrophobicContact CG-CD1 3.91Å; F198-L207 HydrophobicContact CB-CD2 3.8Å; A199-L207 HydrophobicContact CB-CD2 4.46Å; D205-L207 VanDerWaalsContact C-N 3.33Å; L207-P211 HydrophobicContact CB-CB 4.4Å; L207-P211 HydrophobicContact CD2-CB 3.85Å; L207-P211 HydrophobicContact CD2-CG 4.36Å; L207-L212 HydrophobicContact CB-CD2 4.2Å; L207-L212 HydrophobicContact CB-CG 4.11Å; L207-L212 HydrophobicContact CD1-CD2 4.45Å; L207-L212 WeakPolarHBondContact O-CD1 3.43Å
208G83.4Confident80.4Confident31 Ų3174.8 Ų74.832%0.3244%0.439SS..  trans-63.9172.5173.500000113.1E206 V210 P211 L212E206-G208 PolarHBondContact O-N 3Å; G208-V210 VanDerWaalsContact C-N 3.28Å; G208-V210 PolarHBondContact O-N 3.22Å; G208-P211 VanDerWaalsContact O-CD 3.3Å; G208-P211 WeakPolarHBondContact O-CD 3.32Å; G208-L212 WeakPolarHBondContact O-CG 3.25Å; G208-L212 PolarHBondContact O-N 2.92Å
209P83.4Confident80.5Confident100 Ų10071.2 Ų71.265%0.64942%0.423SS*.Hα-helixtrans-59.3-36.7-176.822.5-33.3000113L212 M213P209-L212 PolarHBondContact O-N 2.88Å; P209-M213 WeakPolarHBondContact O-CB 3.46Å; P209-M213 WeakPolarHBondContact O-CG 3.33Å; P209-M213 PolarHBondContact O-N 3.5Å
210V85.7Confident80.7Confident95 Ų9571.4 Ų71.458%0.57643%0.426SS*.Hα-helixtrans-65.9-53.5-177.8174.70000112.4G208 L212 M213 L214G208-V210 VanDerWaalsContact C-N 3.28Å; G208-V210 PolarHBondContact O-N 3.22Å; V210-L212 VanDerWaalsContact C-N 3.27Å; V210-L212 PolarHBondContact O-N 3.45Å; V210-M213 PolarHBondContact O-N 3.47Å; V210-L214 HydrophobicContact CG1-CD1 4.16Å; V210-L214 HydrophobicContact CG1-CG 4.49Å; V210-L214 WeakPolarHBondContact O-CG 3.3Å; V210-L214 PolarHBondContact O-N 2.91Å
211P86.5Confident81.4Confident33 Ų3370.5 Ų70.521%0.21441%0.412CS..Hα-helixtrans-55.2-38172.3-2933.3000114.6F198 L207 G208 L214 S215F198-P211 HydrophobicContact CB-CB 3.95Å; F198-P211 HydrophobicContact CD1-CB 4.4Å; F198-P211 HydrophobicContact CD2-CB 4.17Å; F198-P211 HydrophobicContact CG-CB 3.93Å; L207-P211 HydrophobicContact CB-CB 4.4Å; L207-P211 HydrophobicContact CD2-CB 3.85Å; L207-P211 HydrophobicContact CD2-CG 4.36Å; G208-P211 VanDerWaalsContact O-CD 3.3Å; G208-P211 WeakPolarHBondContact O-CD 3.32Å; P211-L214 PolarHBondContact O-N 2.93Å; P211-S215 VanDerWaalsContact O-CB 3.32Å; P211-S215 WeakPolarHBondContact O-CB 3.43Å; P211-S215 PolarHBondContact O-N 3.33Å; P211-S215 PolarHBondContact O-OG 3.46Å
212L84.4Confident82.2Confident57 Ų5768.6 Ų68.630%0.29839%0.385SS..Hα-helixtrans-66.7-42.8177.1-70.8171.4000111.6L207 G208 P209 V210 S215 G216L207-L212 HydrophobicContact CB-CD2 4.2Å; L207-L212 HydrophobicContact CB-CG 4.11Å; L207-L212 HydrophobicContact CD1-CD2 4.45Å; L207-L212 WeakPolarHBondContact O-CD1 3.43Å; G208-L212 WeakPolarHBondContact O-CG 3.25Å; G208-L212 PolarHBondContact O-N 2.92Å; P209-L212 PolarHBondContact O-N 2.88Å; V210-L212 VanDerWaalsContact C-N 3.27Å; V210-L212 PolarHBondContact O-N 3.45Å; L212-S215 PolarHBondContact O-N 2.82Å; L212-G216 PolarHBondContact O-N 2.87Å
213M82.6Confident83.2Confident142 Ų14261.3 Ų61.370%0.736%0.36SS*.Hα-helixtrans-62.2-45.8174.8-73.5174.172.300111.7P209 V210 S215 G216 G217P209-M213 WeakPolarHBondContact O-CB 3.46Å; P209-M213 WeakPolarHBondContact O-CG 3.33Å; P209-M213 PolarHBondContact O-N 3.5Å; V210-M213 PolarHBondContact O-N 3.47Å; M213-S215 VanDerWaalsContact C-N 3.33Å; M213-S215 PolarHBondContact O-N 3.2Å; M213-G216 PolarHBondContact O-N 3.29Å; M213-G217 PolarHBondContact O-N 3.14Å
214L87.9Confident83.9Confident92 Ų9261.3 Ų61.348%0.48235%0.351SS..Hα-helixtrans-62.5-41.6176.8-69.2176.1000111.3F198 V210 P211 G217 V218F198-L214 HydrophobicContact CE1-CD1 4.2Å; F198-L214 HydrophobicContact CE2-CB 3.75Å; F198-L214 HydrophobicContact CE2-CD1 4.35Å; F198-L214 HydrophobicContact CZ-CB 3.87Å; F198-L214 HydrophobicContact CZ-CD1 3.65Å; F198-L214 HydrophobicContact CZ-CG 4.43Å; V210-L214 HydrophobicContact CG1-CD1 4.16Å; V210-L214 HydrophobicContact CG1-CG 4.49Å; V210-L214 WeakPolarHBondContact O-CG 3.3Å; V210-L214 PolarHBondContact O-N 2.91Å; P211-L214 PolarHBondContact O-N 2.93Å; L214-G217 WeakPolarHBondContact O-CA 3.36Å; L214-G217 PolarHBondContact O-N 3.23Å; L214-G217 VanDerWaalsContact O-N 3.15Å; L214-V218 WeakPolarHBondContact O-CG2 3.35Å; L214-V218 PolarHBondContact O-N 3.43Å
215S86.9Confident84.7Confident0 Ų062.2 Ų62.20%036%0.359CS..Hα-helixtrans-65.1-39.7176.5-56.20000112.4S194 R195 F198 P211 L212 M213 G217 V218 G219S194-S215 VanDerWaalsContact OG-CA 3.25Å; S194-S215 WeakPolarHBondContact OG-CA 3.23Å; S194-S215 WeakPolarHBondContact OG-CB 3.2Å; S194-S215 PolarHBondContact OG-OG 3.32Å; R195-S215 PolarHBondContact N-OG 2.87Å; F198-S215 WeakPolarHBondContact CD2-OG 3.48Å; P211-S215 VanDerWaalsContact O-CB 3.32Å; P211-S215 WeakPolarHBondContact O-CB 3.43Å; P211-S215 PolarHBondContact O-N 3.33Å; P211-S215 PolarHBondContact O-OG 3.46Å; L212-S215 PolarHBondContact O-N 2.82Å; M213-S215 VanDerWaalsContact C-N 3.33Å; M213-S215 PolarHBondContact O-N 3.2Å; S215-G217 VanDerWaalsContact C-N 3.31Å; S215-G217 PolarHBondContact O-N 3.2Å; S215-V218 PolarHBondContact O-N 2.93Å; S215-G219 PolarHBondContact O-N 2.83Å
216G85.4Confident85.5Confident23 Ų2357.2 Ų57.224%0.23734%0.337CS..Hα-helixtrans-58.7-43.2170.100000112.2L212 M213 G219 G220L212-G216 PolarHBondContact O-N 2.87Å; M213-G216 PolarHBondContact O-N 3.29Å; G216-G219 PolarHBondContact O-N 3.29Å; G216-G220 PolarHBondContact O-N 3.35Å
217G86.2Confident86.2Confident39 Ų3950.9 Ų50.940%0.40231%0.308SS..Hα-helixtrans-61.5-47.3175.300000113M213 L214 S215 G220 I221M213-G217 PolarHBondContact O-N 3.14Å; L214-G217 WeakPolarHBondContact O-CA 3.36Å; L214-G217 PolarHBondContact O-N 3.23Å; L214-G217 VanDerWaalsContact O-N 3.15Å; S215-G217 VanDerWaalsContact C-N 3.31Å; S215-G217 PolarHBondContact O-N 3.2Å; G217-G220 PolarHBondContact O-N 2.85Å; G217-I221 WeakPolarHBondContact O-CG1 3.42Å; G217-I221 PolarHBondContact O-N 2.88Å
218V87.9Confident86.8Confident59 Ų5949.9 Ų49.936%0.35830%0.302SS..Hα-helixtrans-61.8-44.9176.2173.90000110.8L214 S215 G220 I221 C222L214-V218 WeakPolarHBondContact O-CG2 3.35Å; L214-V218 PolarHBondContact O-N 3.43Å; S215-V218 PolarHBondContact O-N 2.93Å; V218-G220 VanDerWaalsContact C-N 3.33Å; V218-G220 PolarHBondContact O-N 2.74Å; V218-I221 PolarHBondContact O-N 3.43Å; V218-C222 PolarHBondContact O-N 2.71Å; V218-C222 PolarHBondContact O-SG 2.95Å; V218-C222 VanDerWaalsContact O-SG 3.35Å
219G87Confident87.2Confident0 Ų049.3 Ų49.30%029%0.293CS..Hα-helixtrans-56-46.3173.300000112.3F187 S215 G216 I221 C222 L223F187-G219 WeakPolarHBondContact CA-O 3.41Å; F187-G219 VanDerWaalsContact CD2-C 3.46Å; F187-G219 VanDerWaalsContact O-CA 3.23Å; F187-G219 WeakPolarHBondContact O-CA 3.42Å; S215-G219 PolarHBondContact O-N 2.83Å; G216-G219 PolarHBondContact O-N 3.29Å; G219-I221 PolarHBondContact O-N 3.05Å; G219-C222 PolarHBondContact O-N 3.25Å; G219-L223 WeakPolarHBondContact O-CB 3.5Å; G219-L223 PolarHBondContact O-N 2.92Å
220G86.4Confident87.5Confident12 Ų1245.3 Ų45.312%0.12427%0.267CS..Hα-helixtrans-61.1-39.5175.400000113.7G216 G217 V218 L223 W224G216-G220 PolarHBondContact O-N 3.35Å; G217-G220 PolarHBondContact O-N 2.85Å; V218-G220 VanDerWaalsContact C-N 3.33Å; V218-G220 PolarHBondContact O-N 2.74Å; G220-L223 WeakPolarHBondContact O-CB 3.13Å; G220-W224 PolarHBondContact O-N 3.33Å
221I87.6Confident87.7Confident84 Ų8441.4 Ų41.443%0.43124%0.243SC..Hα-helixtrans-66.4-47.5175.6-68.5165.4000110.5G217 V218 G219 L223 W224 L225G217-I221 WeakPolarHBondContact O-CG1 3.42Å; G217-I221 PolarHBondContact O-N 2.88Å; V218-I221 PolarHBondContact O-N 3.43Å; G219-I221 PolarHBondContact O-N 3.05Å; I221-L223 PolarHBondContact O-N 2.82Å; I221-W224 PolarHBondContact O-N 3.15Å; I221-L225 HydrophobicContact CG2-CD1 3.73Å; I221-L225 HydrophobicContact CG2-CG 4.18Å; I221-L225 WeakPolarHBondContact O-CB 3.18Å; I221-L225 VanDerWaalsContact O-CG 3.32Å; I221-L225 WeakPolarHBondContact O-CG 3.25Å; I221-L225 PolarHBondContact O-N 2.81Å
222C87.2Confident87.8Confident45 Ų4539.8 Ų39.830%0.30423%0.233SC..Hα-helixtrans-58.9-46.3177.3-70.90000111.7F186 V218 G219 A226F186-C222 WeakPolarHBondContact O-CB 3.32Å; V218-C222 PolarHBondContact O-N 2.71Å; V218-C222 PolarHBondContact O-SG 2.95Å; V218-C222 VanDerWaalsContact O-SG 3.35Å; G219-C222 PolarHBondContact O-N 3.25Å; C222-A226 WeakPolarHBondContact O-CB 3.43Å; C222-A226 PolarHBondContact O-N 2.92Å; C222-A226 VanDerWaalsContact O-N 3.1Å
223L90.4Very high88.1Confident41 Ų4137.1 Ų37.122%0.21522%0.218CC..Hα-helixtrans-50.5-61.5171.7167.976.9000110G183 F187 G219 G220 I221 L225 A226 V227G183-L223 WeakPolarHBondContact O-CD1 3.45Å; F187-L223 HydrophobicContact CB-CB 3.98Å; F187-L223 HydrophobicContact CB-CD1 4.25Å; F187-L223 HydrophobicContact CD2-CB 4.18Å; F187-L223 HydrophobicContact CD2-CD2 4.21Å; G219-L223 WeakPolarHBondContact O-CB 3.5Å; G219-L223 PolarHBondContact O-N 2.92Å; G220-L223 WeakPolarHBondContact O-CB 3.13Å; I221-L223 PolarHBondContact O-N 2.82Å; L223-L225 PolarHBondContact O-N 3.35Å; L223-A226 PolarHBondContact O-N 3.46Å; L223-V227 HydrophobicContact CD1-CG1 4.19Å; L223-V227 WeakPolarHBondContact O-CG1 3.4Å; L223-V227 VanDerWaalsContact O-CG2 3.3Å; L223-V227 WeakPolarHBondContact O-CG2 3.32Å; L223-V227 PolarHBondContact O-N 3.39Å
224W88Confident88.5Confident61 Ų6130.6 Ų30.623%0.23119%0.186CC..Hα-helixtrans-62.2-45.3-173.3-75-28.8000111.9G220 I221 A226 V227 Y228 M273 A276G220-W224 PolarHBondContact O-N 3.33Å; I221-W224 PolarHBondContact O-N 3.15Å; W224-A226 VanDerWaalsContact C-N 3.26Å; W224-A226 PolarHBondContact O-N 3.44Å; W224-V227 PolarHBondContact O-N 3.05Å; W224-Y228 WeakPolarHBondContact O-CB 3.36Å; W224-Y228 PolarHBondContact O-N 2.8Å; W224-M273 HydrophobicContact CE3-SD 3.67Å; W224-M273 HydrophobicContact CZ3-CE 4.43Å; W224-M273 HydrophobicContact CZ3-SD 3.68Å; W224-A276 HydrophobicContact CH2-CB 3.82Å
225L87.9Confident88.5Confident88 Ų8826.3 Ų26.346%0.46116%0.164SC..Hα-helixtrans-59.5-37.3179.5-71.8177.2000112.9I221 L223 Y266I221-L225 HydrophobicContact CG2-CD1 3.73Å; I221-L225 HydrophobicContact CG2-CG 4.18Å; I221-L225 WeakPolarHBondContact O-CB 3.18Å; I221-L225 VanDerWaalsContact O-CG 3.32Å; I221-L225 WeakPolarHBondContact O-CG 3.25Å; I221-L225 PolarHBondContact O-N 2.81Å; L223-L225 PolarHBondContact O-N 3.35Å; L225-Y266 HydrophobicContact CD2-CE1 4.35Å; L225-Y266 PolarHBondContact O-OH 3.39Å
226A87.5Confident88.6Confident37 Ų3727 Ų2731%0.30617%0.167SC..Hα-helixtrans-75.9-42.3179.400000112.8F186 C222 L223 W224F186-A226 HydrophobicContact CB-CB 4.06Å; F186-A226 HydrophobicContact CD1-CB 4.25Å; F186-A226 HydrophobicContact CD2-CB 3.31Å; F186-A226 HydrophobicContact CE2-CB 3.74Å; F186-A226 HydrophobicContact CG-CB 3.62Å; F186-A226 HydrophobicContact CZ-CB 4.37Å; C222-A226 WeakPolarHBondContact O-CB 3.43Å; C222-A226 PolarHBondContact O-N 2.92Å; C222-A226 VanDerWaalsContact O-N 3.1Å; L223-A226 PolarHBondContact O-N 3.46Å; W224-A226 VanDerWaalsContact C-N 3.26Å; W224-A226 PolarHBondContact O-N 3.44Å
227V90Very high88.7Confident7 Ų726.8 Ų26.84%0.04216%0.16CC..Hα-helixtrans-90-16.7-173.9-53.70000114R179 L223 W224 V230 D231R179-V227 HydrophobicContact CG-CB 3.95Å; R179-V227 HydrophobicContact CG-CG1 4.36Å; R179-V227 HydrophobicContact CG-CG2 4.3Å; R179-V227 WeakPolarHBondContact O-CG1 3.42Å; L223-V227 HydrophobicContact CD1-CG1 4.19Å; L223-V227 WeakPolarHBondContact O-CG1 3.4Å; L223-V227 VanDerWaalsContact O-CG2 3.3Å; L223-V227 WeakPolarHBondContact O-CG2 3.32Å; L223-V227 PolarHBondContact O-N 3.39Å; W224-V227 PolarHBondContact O-N 3.05Å; V227-V230 WeakPolarHBondContact O-CA 3.44Å; V227-V230 WeakPolarHBondContact O-CB 3.48Å; V227-V230 PolarHBondContact O-N 2.85Å; V227-D231 PolarHBondContact O-N 3.43Å
228Y89.5Confident88.7Confident1 Ų125 Ų250%0.00414%0.141CC..Hα-helixtrans-55.5-44.9-175.7-135.7-93.9000114.1K34 Q38 W224 V230 D231 C232 L265 Y266 S267 G268 L269 T272K34-Y228 WeakPolarHBondContact CE-OH 3.4Å; Q38-Y228 PolarHBondContact NE2-OH 2.9Å; W224-Y228 WeakPolarHBondContact O-CB 3.36Å; W224-Y228 PolarHBondContact O-N 2.8Å; Y228-V230 VanDerWaalsContact C-N 3.26Å; Y228-V230 PolarHBondContact O-N 3.04Å; Y228-D231 WeakPolarHBondContact O-CB 3.37Å; Y228-D231 PolarHBondContact O-N 3.38Å; Y228-D231 VanDerWaalsContact O-N 3.16Å; Y228-C232 PolarHBondContact O-N 3.2Å; Y228-L265 WeakPolarHBondContact CD1-O 3.46Å; Y228-Y266 HydrophobicContact CD1-CD1 4.25Å; Y228-Y266 HydrophobicContact CG-CD1 4.33Å; Y228-S267 VanDerWaalsContact CE1-O 3.3Å; Y228-S267 WeakPolarHBondContact CE1-O 3.08Å; Y228-G268 WeakPolarHBondContact OH-CA 3.47Å; Y228-G268 PolarHBondContact OH-O 3.3Å; Y228-L269 HydrophobicContact CD2-CD1 3.83Å; Y228-L269 HydrophobicContact CE1-CB 4.06Å; Y228-L269 HydrophobicContact CE2-CB 4.43Å; Y228-L269 HydrophobicContact CE2-CD1 3.79Å; Y228-L269 HydrophobicContact CG-CD1 4.34Å; Y228-L269 VanDerWaalsContact CZ-CA 3.5Å; Y228-L269 WeakPolarHBondContact OH-CA 3.25Å; Y228-L269 PolarHBondContact OH-N 3.16Å; Y228-L269 VanDerWaalsContact OH-N 3.09Å; Y228-T272 HydrophobicContact CE2-CG2 4.21Å; Y228-T272 PolarHBondContact OH-OG1 3.33Å
229P91.8Very high88.6Confident20 Ų2022.2 Ų22.213%0.1312%0.124CC..Hα-helixtrans-56.6-42.2174.7-2938.6000112.8C232 I233 L265 Y266P229-C232 PolarHBondContact O-N 3.27Å; P229-I233 WeakPolarHBondContact O-CG1 3.33Å; P229-I233 PolarHBondContact O-N 3.33Å; P229-I233 VanDerWaalsContact O-N 3.12Å; P229-L265 HydrophobicContact CB-CB 4.11Å; P229-L265 HydrophobicContact CB-CD1 4.17Å; P229-L265 HydrophobicContact CB-CD2 4.5Å; P229-L265 HydrophobicContact CG-CB 4.35Å; P229-Y266 HydrophobicContact CG-CE1 4.43Å; P229-Y266 HydrophobicContact CG-CE2 4.31Å
230V91.2Very high88.5Confident16 Ų1624.5 Ų24.510%0.09714%0.136CC..Hα-helixtrans-65.2-42.5178.2-174.80000110.3S175 L178 R179 V227 Y228 C232 I233 K234 F249S175-V230 WeakPolarHBondContact O-CG1 3.39Å; L178-V230 HydrophobicContact CB-CG1 4.02Å; L178-V230 HydrophobicContact CD2-CG1 4.17Å; L178-V230 HydrophobicContact CD2-CG2 4.07Å; L178-V230 HydrophobicContact CG-CG1 4.09Å; L178-V230 HydrophobicContact CG-CG2 4.03Å; R179-V230 HydrophobicContact CB-CG1 4.06Å; V227-V230 WeakPolarHBondContact O-CA 3.44Å; V227-V230 WeakPolarHBondContact O-CB 3.48Å; V227-V230 PolarHBondContact O-N 2.85Å; Y228-V230 VanDerWaalsContact C-N 3.26Å; Y228-V230 PolarHBondContact O-N 3.04Å; V230-C232 PolarHBondContact O-N 3.27Å; V230-I233 PolarHBondContact O-N 2.84Å; V230-K234 WeakPolarHBondContact O-CB 3.19Å; V230-K234 PolarHBondContact O-N 3.31Å; V230-F249 HydrophobicContact CB-CE2 4.41Å; V230-F249 HydrophobicContact CB-CZ 4.42Å; V230-F249 HydrophobicContact CG1-CE2 3.84Å; V230-F249 HydrophobicContact CG1-CZ 4.17Å; V230-F249 HydrophobicContact CG2-CZ 4.19Å
231D88.8Confident88.3Confident12 Ų1224.1 Ų24.16%0.06413%0.132CC..Hα-helixtrans-59.2-43.5175.7-102.8-2.4000112.8K34 R179 V227 Y228 K234 S235K34-D231 IonicContact NZ-OD2 2.73Å; K34-D231 PolarHBondContact NZ-OD2 3.24Å; R179-D231 WeakPolarHBondContact CD-OD1 3.49Å; R179-D231 IonicContact NE-OD1 3.99Å; R179-D231 IonicContact NH1-OD1 2.71Å; V227-D231 PolarHBondContact O-N 3.43Å; Y228-D231 WeakPolarHBondContact O-CB 3.37Å; Y228-D231 PolarHBondContact O-N 3.38Å; Y228-D231 VanDerWaalsContact O-N 3.16Å; D231-K234 PolarHBondContact O-N 3.36Å; D231-S235 PolarHBondContact O-N 3.34Å; D231-S235 PolarHBondContact O-OG 2.88Å; D231-S235 VanDerWaalsContact O-OG 3.06Å
232C89.9Confident87.9Confident0 Ų020.5 Ų20.50%011%0.113CC..Hα-helixtrans-64.3-43.8177.7-173.80000111.2Q38 Y228 P229 V230 S235 R236 A264 L265Q38-C232 HydrophobicContact CG-CB 4.46Å; Y228-C232 PolarHBondContact O-N 3.2Å; P229-C232 PolarHBondContact O-N 3.27Å; V230-C232 PolarHBondContact O-N 3.27Å; C232-S235 PolarHBondContact O-OG 2.95Å; C232-R236 WeakPolarHBondContact O-CG 3.16Å; C232-R236 PolarHBondContact O-N 3.43Å; C232-A264 PolarHBondContact SG-O 3.45Å; C232-L265 WeakPolarHBondContact CB-O 3.35Å
233I91.1Very high87.5Confident0 Ų020 Ų200%011%0.11CC..Hα-helixtrans-69.1-39.4177-61.1-49.5000111.7P229 V230 R236 I237 F249 T252 F253 V256 L265P229-I233 WeakPolarHBondContact O-CG1 3.33Å; P229-I233 PolarHBondContact O-N 3.33Å; P229-I233 VanDerWaalsContact O-N 3.12Å; V230-I233 PolarHBondContact O-N 2.84Å; I233-R236 PolarHBondContact O-N 3.49Å; I233-I237 HydrophobicContact CG2-CD1 3.71Å; I233-I237 HydrophobicContact CG2-CG1 4.33Å; I233-I237 WeakPolarHBondContact O-CG1 3.4Å; I233-I237 PolarHBondContact O-N 2.77Å; I233-F249 HydrophobicContact CB-CD2 4.13Å; I233-F249 HydrophobicContact CB-CE2 3.69Å; I233-F249 HydrophobicContact CB-CZ 4.36Å; I233-F249 HydrophobicContact CG1-CE2 4.38Å; I233-F249 HydrophobicContact CG2-CD2 3.47Å; I233-F249 VanDerWaalsContact CG2-CD2 3.47Å; I233-F249 HydrophobicContact CG2-CE2 3.57Å; I233-F249 HydrophobicContact CG2-CG 4.23Å; I233-F249 HydrophobicContact CG2-CZ 4.37Å; I233-T252 HydrophobicContact CD1-CG2 4.27Å; I233-T252 HydrophobicContact CG2-CG2 3.91Å; I233-F253 HydrophobicContact CD1-CB 4.36Å; I233-F253 HydrophobicContact CD1-CD2 4.47Å; I233-F253 HydrophobicContact CG1-CB 4.16Å; I233-F253 HydrophobicContact CG1-CD2 4.01Å; I233-V256 HydrophobicContact CD1-CB 3.9Å; I233-V256 HydrophobicContact CD1-CG1 4.33Å; I233-V256 HydrophobicContact CD1-CG2 3.69Å; I233-L265 HydrophobicContact CD1-CD2 3.78Å; I233-L265 HydrophobicContact CG1-CD2 4.1Å
234K89Confident86.7Confident5 Ų520.8 Ų20.82%0.02213%0.128CC..Hα-helixtrans-57.8-53.7177175.4-178.9177.7-175.60111.6E128 S175 T176 V230 D231 R236 I237 Q238E128-K234 IonicContact OE1-NZ 2.68Å; E128-K234 PolarHBondContact OE1-NZ 3.49Å; E128-K234 VanDerWaalsContact OE2-CE 3.3Å; E128-K234 WeakPolarHBondContact OE2-CE 3.34Å; E128-K234 IonicContact OE2-NZ 3.65Å; E128-K234 PolarHBondContact OE2-NZ 2.86Å; S175-K234 WeakPolarHBondContact OG-CG 3.2Å; T176-K234 VanDerWaalsContact OG1-CE 3.29Å; T176-K234 WeakPolarHBondContact OG1-CE 3.28Å; V230-K234 WeakPolarHBondContact O-CB 3.19Å; V230-K234 PolarHBondContact O-N 3.31Å; D231-K234 PolarHBondContact O-N 3.36Å; K234-R236 VanDerWaalsContact C-N 3.29Å; K234-R236 PolarHBondContact O-N 2.98Å; K234-I237 PolarHBondContact O-N 2.92Å; K234-I237 VanDerWaalsContact O-N 3.16Å; K234-Q238 HydrophobicContact CG-CG 4.4Å; K234-Q238 WeakPolarHBondContact O-CB 3.43Å; K234-Q238 WeakPolarHBondContact O-CG 3.35Å; K234-Q238 PolarHBondContact O-N 3.37Å
235S88.7Confident85.7Confident3 Ų325 Ų252%0.02115%0.148CC..Hα-helixtrans-58.6-42.2179.453.40000111.4Q38 D231 C232 Q238 V239Q38-S235 WeakPolarHBondContact CB-OG 3.34Å; Q38-S235 PolarHBondContact OE1-OG 2.96Å; Q38-S235 VanDerWaalsContact OE1-OG 3.1Å; D231-S235 PolarHBondContact O-N 3.34Å; D231-S235 PolarHBondContact O-OG 2.88Å; D231-S235 VanDerWaalsContact O-OG 3.06Å; C232-S235 PolarHBondContact O-OG 2.95Å; S235-Q238 PolarHBondContact O-N 3.44Å; S235-V239 WeakPolarHBondContact O-CB 3.37Å; S235-V239 VanDerWaalsContact O-CG2 3.27Å; S235-V239 WeakPolarHBondContact O-CG2 3.25Å; S235-V239 PolarHBondContact O-N 2.88Å
236R88.9Confident84.6Confident13 Ų1326.2 Ų26.25%0.04915%0.151CC..Hα-helixtrans-60.1-47.3174.1-71.7172.1-176.5-103.43.7112.7Q38 C232 I233 K234 V239 L240 T252 E260Q38-R236 PolarHBondContact O-NE 3.02Å; Q38-R236 PolarHBondContact O-NH2 2.62Å; C232-R236 WeakPolarHBondContact O-CG 3.16Å; C232-R236 PolarHBondContact O-N 3.43Å; I233-R236 PolarHBondContact O-N 3.49Å; K234-R236 VanDerWaalsContact C-N 3.29Å; K234-R236 PolarHBondContact O-N 2.98Å; R236-V239 PolarHBondContact O-N 3.46Å; R236-L240 HydrophobicContact CB-CD1 4.34Å; R236-L240 WeakPolarHBondContact O-CB 3.34Å; R236-L240 WeakPolarHBondContact O-CG 3.36Å; R236-L240 PolarHBondContact O-N 3.28Å; R236-T252 HydrophobicContact CB-CG2 4.23Å; R236-E260 IonicContact CZ-OE1 3.51Å; R236-E260 IonicContact CZ-OE2 2.73Å; R236-E260 VanDerWaalsContact CZ-OE2 3.23Å; R236-E260 IonicContact NH1-OE1 3.32Å; R236-E260 PolarHBondContact NH1-OE1 3.05Å; R236-E260 IonicContact NH1-OE2 3.57Å; R236-E260 PolarHBondContact NH1-OE2 3.42Å; R236-E260 IonicContact NH2-OE1 3.06Å; R236-E260 IonicContact NH2-OE2 3.93Å; R236-E260 PolarHBondContact NH2-OE2 2.99Å
237I87.8Confident83.6Confident20 Ų2026.1 Ų26.110%0.10315%0.151CC..Hα-helixtrans-62.8-46.2178.6-68.6168.2000110.5I233 K234 V239 S241 F249 T252I233-I237 HydrophobicContact CG2-CD1 3.71Å; I233-I237 HydrophobicContact CG2-CG1 4.33Å; I233-I237 WeakPolarHBondContact O-CG1 3.4Å; I233-I237 PolarHBondContact O-N 2.77Å; K234-I237 PolarHBondContact O-N 2.92Å; K234-I237 VanDerWaalsContact O-N 3.16Å; I237-V239 VanDerWaalsContact C-N 3.31Å; I237-V239 PolarHBondContact O-N 3.31Å; I237-S241 WeakPolarHBondContact O-CB 3.17Å; I237-S241 PolarHBondContact O-N 3.45Å; I237-S241 PolarHBondContact O-OG 2.88Å; I237-F249 HydrophobicContact CD1-CB 4.36Å; I237-F249 HydrophobicContact CD1-CD2 4.4Å; I237-T252 HydrophobicContact CG1-CG2 4.13Å
238Q87.1Confident83.3Confident2 Ų228.3 Ų28.31%0.00917%0.174CC..Hα-helixtrans-62.7-36.6-178.6-73.5-176.8-32.300112.2L129 C132 R133 K234 S235 S241L129-Q238 HydrophobicContact CD1-CB 3.75Å; L129-Q238 HydrophobicContact CD1-CG 3.81Å; C132-Q238 HydrophobicContact CB-CB 4.19Å; C132-Q238 PolarHBondContact SG-OE1 3.2Å; C132-Q238 VanDerWaalsContact SG-OE1 3.33Å; R133-Q238 PolarHBondContact NE-O 2.9Å; K234-Q238 HydrophobicContact CG-CG 4.4Å; K234-Q238 WeakPolarHBondContact O-CB 3.43Å; K234-Q238 WeakPolarHBondContact O-CG 3.35Å; K234-Q238 PolarHBondContact O-N 3.37Å; S235-Q238 PolarHBondContact O-N 3.44Å; Q238-S241 PolarHBondContact O-OG 3.07Å
239V85.7Confident83.1Confident0 Ų030.1 Ų30.10%018%0.182CC..Hα-helixtrans-84-45.4177.5179.30000112.7V35 T39 C132 T136 M140 S235 R236 I237 S241 M242V35-V239 HydrophobicContact CG1-CG2 4.43Å; T39-V239 HydrophobicContact CG2-CB 3.73Å; T39-V239 HydrophobicContact CG2-CG1 3.59Å; T39-V239 HydrophobicContact CG2-CG2 4.17Å; C132-V239 HydrophobicContact CB-CG2 4.13Å; T136-V239 HydrophobicContact CG2-CG1 4.3Å; T136-V239 HydrophobicContact CG2-CG2 3.85Å; T136-V239 WeakPolarHBondContact OG1-CG1 3.35Å; T136-V239 WeakPolarHBondContact OG1-CG2 3.23Å; M140-V239 HydrophobicContact CE-CG1 4.29Å; M140-V239 HydrophobicContact CG-CG1 3.88Å; M140-V239 HydrophobicContact SD-CG1 3.91Å; S235-V239 WeakPolarHBondContact O-CB 3.37Å; S235-V239 VanDerWaalsContact O-CG2 3.27Å; S235-V239 WeakPolarHBondContact O-CG2 3.25Å; S235-V239 PolarHBondContact O-N 2.88Å; R236-V239 PolarHBondContact O-N 3.46Å; I237-V239 VanDerWaalsContact C-N 3.31Å; I237-V239 PolarHBondContact O-N 3.31Å; V239-S241 PolarHBondContact O-N 3.35Å; V239-M242 HydrophobicContact CG1-SD 4.13Å; V239-M242 WeakPolarHBondContact O-CB 3.47Å; V239-M242 WeakPolarHBondContact O-CG 3.49Å; V239-M242 PolarHBondContact O-N 2.88Å
240L83.9Confident83Confident47 Ų4735 Ų3525%0.24621%0.206CC..Hα-helixtrans-65-25.9-178.1-67.4174.7000112.5R236 M242 S243R236-L240 HydrophobicContact CB-CD1 4.34Å; R236-L240 WeakPolarHBondContact O-CB 3.34Å; R236-L240 WeakPolarHBondContact O-CG 3.36Å; R236-L240 PolarHBondContact O-N 3.28Å; L240-M242 PolarHBondContact O-N 3.33Å; L240-M242 VanDerWaalsContact O-N 3.13Å; L240-S243 PolarHBondContact O-N 2.88Å; L240-S243 PolarHBondContact O-OG 3.15Å
241S82.3Confident82.9Confident4 Ų443.3 Ų43.33%0.02824%0.236CC..G310 helixtrans-56.1-25.7170.867.90000113.3R133 I237 Q238 V239 S243 G244R133-S241 PolarHBondContact NE-OG 3.49Å; R133-S241 PolarHBondContact NH2-OG 3.45Å; I237-S241 WeakPolarHBondContact O-CB 3.17Å; I237-S241 PolarHBondContact O-N 3.45Å; I237-S241 PolarHBondContact O-OG 2.88Å; Q238-S241 PolarHBondContact O-OG 3.07Å; V239-S241 PolarHBondContact O-N 3.35Å; S241-S243 PolarHBondContact O-N 3.34Å; S241-G244 PolarHBondContact O-N 2.85Å; S241-G244 VanDerWaalsContact O-N 3.12Å
242M79.1Confident82.9Confident8 Ų843.2 Ų43.24%0.03924%0.235CC..G310 helixtrans-62-30.4174.5-60.3172.472.200113.3R133 M137 M140 I146 K163 V239 L240 G244R133-M242 HydrophobicContact CB-CE 4.24Å; R133-M242 HydrophobicContact CB-CG 4.21Å; R133-M242 HydrophobicContact CB-SD 3.71Å; R133-M242 HydrophobicContact CG-CG 3.53Å; R133-M242 HydrophobicContact CG-SD 3.62Å; M137-M242 HydrophobicContact CE-CE 3.59Å; M137-M242 HydrophobicContact CG-CE 4.3Å; M137-M242 HydrophobicContact SD-CE 3.28Å; M137-M242 WeakPolarHBondContact SD-CE 3.18Å; M140-M242 HydrophobicContact CE-CB 4.08Å; M140-M242 HydrophobicContact CG-SD 4.23Å; I146-M242 HydrophobicContact CD1-CE 3.54Å; I146-M242 HydrophobicContact CG2-CB 4.08Å; K163-M242 PolarHBondContact NZ-O 3.38Å; V239-M242 HydrophobicContact CG1-SD 4.13Å; V239-M242 WeakPolarHBondContact O-CB 3.47Å; V239-M242 WeakPolarHBondContact O-CG 3.49Å; V239-M242 PolarHBondContact O-N 2.88Å; L240-M242 PolarHBondContact O-N 3.33Å; L240-M242 VanDerWaalsContact O-N 3.13Å; M242-G244 VanDerWaalsContact C-N 3.33Å
243S79.3Confident82.9Confident35 Ų3546.8 Ų46.825%0.24525%0.251CS..G310 helixtrans-90.68179.166.70000113.3L240 S241 K245L240-S243 PolarHBondContact O-N 2.88Å; L240-S243 PolarHBondContact O-OG 3.15Å; S241-S243 PolarHBondContact O-N 3.34Å; S243-K245 PolarHBondContact O-N 3.41Å
244G73.4Confident83Confident57 Ų5751.5 Ų51.559%0.58828%0.275SS*.THydrogen-bonded Turntrans73.5-2.8-175.700000114.4S241 M242 Q246S241-G244 PolarHBondContact O-N 2.85Å; S241-G244 VanDerWaalsContact O-N 3.12Å; M242-G244 VanDerWaalsContact C-N 3.33Å; G244-Q246 PolarHBondContact O-N 2.93Å
245K67Low83.1Confident150 Ų15055.2 Ų55.265%0.65230%0.295SS*.  trans-7692.7174.3-67.1-170.4-179.4-1740109.7S243S243-K245 PolarHBondContact O-N 3.41Å
246Q65Low83.1Confident114 Ų11455.2 Ų55.253%0.53330%0.295SS..  trans-93.9107.3174.5-58.6-155.6-6.600110.1D164 H171 G244D164-Q246 PolarHBondContact OD1-NE2 2.81Å; H171-Q246 PolarHBondContact CE1-NE2 2.84Å; H171-Q246 PolarHBondContact CE1-OE1 3.49Å; H171-Q246 PolarHBondContact NE2-NE2 3.33Å; G244-Q246 PolarHBondContact O-N 2.93Å
247A66.6Low83.3Confident35 Ų3557.1 Ų57.129%0.28931%0.308SS..  trans-116.7133.4171.100000109.3T252A247-T252 VanDerWaalsContact CB-OG1 3.26Å; A247-T252 WeakPolarHBondContact CB-OG1 3.45Å
248G82.4Confident83.6Confident52 Ų5264.4 Ų64.454%0.53634%0.339SS..  trans-63.5159.2172.400000111.7I250 R251 T252G248-I250 VanDerWaalsContact C-N 3.34Å; G248-I250 PolarHBondContact O-N 2.87Å; G248-R251 PolarHBondContact O-N 2.93Å; G248-R251 VanDerWaalsContact O-N 3.11Å; G248-T252 PolarHBondContact O-N 3.46Å; G248-T252 PolarHBondContact O-OG1 3.31Å
249F86.6Confident83.8Confident40 Ų4069.3 Ų69.318%0.17537%0.365CS..Hα-helixtrans-47.6-52.7-177.2-177.9-93.9000113.3L178 V230 I233 I237 R251 T252 F253L178-F249 HydrophobicContact CD2-CD1 4.05Å; L178-F249 HydrophobicContact CD2-CE1 3.47Å; L178-F249 VanDerWaalsContact CD2-CE1 3.47Å; L178-F249 HydrophobicContact CD2-CE2 4.06Å; L178-F249 HydrophobicContact CD2-CZ 3.48Å; L178-F249 VanDerWaalsContact CD2-CZ 3.48Å; V230-F249 HydrophobicContact CB-CE2 4.41Å; V230-F249 HydrophobicContact CB-CZ 4.42Å; V230-F249 HydrophobicContact CG1-CE2 3.84Å; V230-F249 HydrophobicContact CG1-CZ 4.17Å; V230-F249 HydrophobicContact CG2-CZ 4.19Å; I233-F249 HydrophobicContact CB-CD2 4.13Å; I233-F249 HydrophobicContact CB-CE2 3.69Å; I233-F249 HydrophobicContact CB-CZ 4.36Å; I233-F249 HydrophobicContact CG1-CE2 4.38Å; I233-F249 HydrophobicContact CG2-CD2 3.47Å; I233-F249 VanDerWaalsContact CG2-CD2 3.47Å; I233-F249 HydrophobicContact CG2-CE2 3.57Å; I233-F249 HydrophobicContact CG2-CG 4.23Å; I233-F249 HydrophobicContact CG2-CZ 4.37Å; I237-F249 HydrophobicContact CD1-CB 4.36Å; I237-F249 HydrophobicContact CD1-CD2 4.4Å; F249-R251 PolarHBondContact O-N 2.75Å; F249-T252 PolarHBondContact O-N 3.38Å; F249-F253 WeakPolarHBondContact O-CB 3.43Å; F249-F253 PolarHBondContact O-N 2.97Å
250I89.2Confident83.9Confident123 Ų12372 Ų7263%0.63138%0.378SS*.Hα-helixtrans-61.5-43.4-177.4-62.2172.4000111.2G248 F253 I254G248-I250 VanDerWaalsContact C-N 3.34Å; G248-I250 PolarHBondContact O-N 2.87Å; I250-F253 PolarHBondContact O-N 3.47Å; I250-I254 HydrophobicContact CG2-CD1 3.73Å; I250-I254 HydrophobicContact CG2-CG1 4.38Å; I250-I254 VanDerWaalsContact O-CG1 3.3Å; I250-I254 WeakPolarHBondContact O-CG1 3.5Å; I250-I254 PolarHBondContact O-N 3.31Å
251R89.4Confident84.2Confident190 Ų19071.1 Ų71.172%0.71738%0.38SS*.Hα-helixtrans-65.5-43.7-179.6-172.5176.1-179.3175.71.3111.1G248 F249 N255G248-R251 PolarHBondContact O-N 2.93Å; G248-R251 VanDerWaalsContact O-N 3.11Å; F249-R251 PolarHBondContact O-N 2.75Å; R251-N255 VanDerWaalsContact O-CB 3.23Å; R251-N255 WeakPolarHBondContact O-CB 3.15Å; R251-N255 PolarHBondContact O-N 3.42Å
252T88.2Confident84.6Confident10 Ų1076.5 Ų76.56%0.06141%0.407CS..Hα-helixtrans-65.3-41.6176.4-52.90000111I233 R236 I237 A247 G248 F249 N255 V256I233-T252 HydrophobicContact CD1-CG2 4.27Å; I233-T252 HydrophobicContact CG2-CG2 3.91Å; R236-T252 HydrophobicContact CB-CG2 4.23Å; I237-T252 HydrophobicContact CG1-CG2 4.13Å; A247-T252 VanDerWaalsContact CB-OG1 3.26Å; A247-T252 WeakPolarHBondContact CB-OG1 3.45Å; G248-T252 PolarHBondContact O-N 3.46Å; G248-T252 PolarHBondContact O-OG1 3.31Å; F249-T252 PolarHBondContact O-N 3.38Å; T252-N255 PolarHBondContact O-N 2.93Å; T252-V256 HydrophobicContact CG2-CG2 4.49Å; T252-V256 WeakPolarHBondContact O-CG2 3.25Å; T252-V256 PolarHBondContact O-N 3.03Å
253F90.9Very high85.1Confident75 Ų7581.3 Ų81.333%0.32944%0.437SS..Hα-helixtrans-58.9-53.9176.1178.8-94000112.1I233 F249 I250 N255 V256 V257 L265I233-F253 HydrophobicContact CD1-CB 4.36Å; I233-F253 HydrophobicContact CD1-CD2 4.47Å; I233-F253 HydrophobicContact CG1-CB 4.16Å; I233-F253 HydrophobicContact CG1-CD2 4.01Å; F249-F253 WeakPolarHBondContact O-CB 3.43Å; F249-F253 PolarHBondContact O-N 2.97Å; I250-F253 PolarHBondContact O-N 3.47Å; F253-N255 VanDerWaalsContact C-N 3.25Å; F253-N255 PolarHBondContact O-N 3.11Å; F253-V256 PolarHBondContact O-N 3.06Å; F253-V257 HydrophobicContact CD1-CG2 4.36Å; F253-V257 HydrophobicContact CE1-CG2 3.98Å; F253-V257 HydrophobicContact CE2-CG2 4.21Å; F253-V257 HydrophobicContact CZ-CG2 3.9Å; F253-V257 WeakPolarHBondContact O-CG2 3.42Å; F253-V257 PolarHBondContact O-N 3.17Å; F253-L265 HydrophobicContact CD2-CD1 4.49Å; F253-L265 HydrophobicContact CD2-CD2 4.25Å; F253-L265 HydrophobicContact CE2-CD1 3.73Å; F253-L265 HydrophobicContact CE2-CD2 4.27Å; F253-L265 HydrophobicContact CZ-CD1 4.28Å
254I92.5Very high85.5Confident98 Ų9880.2 Ų80.250%0.50343%0.43SS..Hα-helixtrans-58.6-41.4177.7-67.3169000110.5I250 V257 K258I250-I254 HydrophobicContact CG2-CD1 3.73Å; I250-I254 HydrophobicContact CG2-CG1 4.38Å; I250-I254 VanDerWaalsContact O-CG1 3.3Å; I250-I254 WeakPolarHBondContact O-CG1 3.5Å; I250-I254 PolarHBondContact O-N 3.31Å; I254-V257 PolarHBondContact O-N 2.9Å; I254-K258 WeakPolarHBondContact O-CB 3.37Å; I254-K258 PolarHBondContact O-N 3.36Å
255N90.8Very high86.3Confident84 Ų8477.7 Ų77.745%0.44940%0.403SS..Hα-helixtrans-64.1-42.5179.9-170.672.5000112.6R251 T252 F253 N259R251-N255 VanDerWaalsContact O-CB 3.23Å; R251-N255 WeakPolarHBondContact O-CB 3.15Å; R251-N255 PolarHBondContact O-N 3.42Å; T252-N255 PolarHBondContact O-N 2.93Å; F253-N255 VanDerWaalsContact C-N 3.25Å; F253-N255 PolarHBondContact O-N 3.11Å; N255-N259 VanDerWaalsContact CG-ND2 3.3Å; N255-N259 VanDerWaalsContact O-CB 3.3Å; N255-N259 WeakPolarHBondContact O-CB 3.37Å; N255-N259 PolarHBondContact O-N 2.86Å; N255-N259 PolarHBondContact O-ND2 3.48Å; N255-N259 PolarHBondContact OD1-ND2 2.94Å
256V90Very high87.5Confident2 Ų274.8 Ų74.81%0.01239%0.389CS..Hα-helixtrans-67-48.5176.9171.60000110.3I233 T252 F253 K258 N259 E260 G261 A264 L265I233-V256 HydrophobicContact CD1-CB 3.9Å; I233-V256 HydrophobicContact CD1-CG1 4.33Å; I233-V256 HydrophobicContact CD1-CG2 3.69Å; T252-V256 HydrophobicContact CG2-CG2 4.49Å; T252-V256 WeakPolarHBondContact O-CG2 3.25Å; T252-V256 PolarHBondContact O-N 3.03Å; F253-V256 PolarHBondContact O-N 3.06Å; V256-K258 VanDerWaalsContact C-N 3.31Å; V256-K258 PolarHBondContact O-N 2.85Å; V256-N259 PolarHBondContact O-N 2.92Å; V256-E260 HydrophobicContact CG1-CB 4.46Å; V256-E260 WeakPolarHBondContact O-CA 3.45Å; V256-E260 WeakPolarHBondContact O-CB 3.34Å; V256-E260 PolarHBondContact O-N 3.07Å; V256-G261 PolarHBondContact O-N 3.31Å; V256-A264 HydrophobicContact CG1-CB 4.05Å; V256-L265 HydrophobicContact CB-CD2 4.48Å; V256-L265 HydrophobicContact CG1-CD2 3.84Å; V256-L265 HydrophobicContact CG1-CG 4.44Å
257V92.9Very high88.6Confident54 Ų5470.5 Ų70.533%0.32737%0.372SS..Hα-helixtrans-60.2-42.4179.4172.50000111.6F253 I254 G261 L265F253-V257 HydrophobicContact CD1-CG2 4.36Å; F253-V257 HydrophobicContact CE1-CG2 3.98Å; F253-V257 HydrophobicContact CE2-CG2 4.21Å; F253-V257 HydrophobicContact CZ-CG2 3.9Å; F253-V257 WeakPolarHBondContact O-CG2 3.42Å; F253-V257 PolarHBondContact O-N 3.17Å; I254-V257 PolarHBondContact O-N 2.9Å; V257-G261 VanDerWaalsContact O-CA 3.27Å; V257-G261 WeakPolarHBondContact O-CA 3.43Å; V257-G261 PolarHBondContact O-N 3.32Å; V257-L265 HydrophobicContact CG2-CD1 3.86Å; V257-L265 HydrophobicContact CG2-CG 4.47Å
258K92.5Very high89.5Confident173 Ų17369 Ų6975%0.75236%0.359SS*.Hα-helixtrans-72.4-40.3-177.4-175.7174.8177.4179.20113.2I254 V256I254-K258 WeakPolarHBondContact O-CB 3.37Å; I254-K258 PolarHBondContact O-N 3.36Å; V256-K258 VanDerWaalsContact C-N 3.31Å; V256-K258 PolarHBondContact O-N 2.85Å
259N91.4Very high89.8Confident104 Ų10468.7 Ų68.756%0.55635%0.345SS*.Hα-helixtrans-98.1-27.8-171.6-59.4-35.1000113.7N255 V256N255-N259 VanDerWaalsContact CG-ND2 3.3Å; N255-N259 VanDerWaalsContact O-CB 3.3Å; N255-N259 WeakPolarHBondContact O-CB 3.37Å; N255-N259 PolarHBondContact O-N 2.86Å; N255-N259 PolarHBondContact O-ND2 3.48Å; N255-N259 PolarHBondContact OD1-ND2 2.94Å; V256-N259 PolarHBondContact O-N 2.92Å
260E89.3Confident89.9Confident58 Ų5874.2 Ų74.227%0.27137%0.369SS..Hα-helixtrans-118.6-13.9-174-54.4176.6-156.300112.5P41 R236 V256 A264P41-E260 WeakPolarHBondContact CG-OE2 3.26Å; R236-E260 IonicContact CZ-OE1 3.51Å; R236-E260 IonicContact CZ-OE2 2.73Å; R236-E260 VanDerWaalsContact CZ-OE2 3.23Å; R236-E260 IonicContact NH1-OE1 3.32Å; R236-E260 PolarHBondContact NH1-OE1 3.05Å; R236-E260 IonicContact NH1-OE2 3.57Å; R236-E260 PolarHBondContact NH1-OE2 3.42Å; R236-E260 IonicContact NH2-OE1 3.06Å; R236-E260 IonicContact NH2-OE2 3.93Å; R236-E260 PolarHBondContact NH2-OE2 2.99Å; V256-E260 HydrophobicContact CG1-CB 4.46Å; V256-E260 WeakPolarHBondContact O-CA 3.45Å; V256-E260 WeakPolarHBondContact O-CB 3.34Å; V256-E260 PolarHBondContact O-N 3.07Å; E260-A264 HydrophobicContact CB-CB 3.58Å
261G90.2Very high90Very high27 Ų2768.4 Ų68.428%0.27834%0.339SS..  trans85.5169.2-178.900000113.9V256 V257 T263 A264V256-G261 PolarHBondContact O-N 3.31Å; V257-G261 VanDerWaalsContact O-CA 3.27Å; V257-G261 WeakPolarHBondContact O-CA 3.43Å; V257-G261 PolarHBondContact O-N 3.32Å; G261-T263 VanDerWaalsContact C-N 3.28Å; G261-T263 PolarHBondContact O-N 3.45Å; G261-A264 WeakPolarHBondContact O-CB 3.28Å; G261-A264 PolarHBondContact O-N 2.89Å
262I90.1Very high90Very high117 Ų11759.6 Ų59.660%0.631%0.306SS*.G310 helixtrans-68.1-27.5-176.3-158.8169.5000112.8A264 L265I262-A264 PolarHBondContact O-N 3.36Å; I262-L265 HydrophobicContact CG1-CD1 4Å; I262-L265 VanDerWaalsContact O-CB 3.28Å; I262-L265 WeakPolarHBondContact O-CB 3.49Å; I262-L265 PolarHBondContact O-N 3.34Å
263T89Confident90Very high110 Ų11062.9 Ų62.968%0.67532%0.322SS*.G310 helixtrans-67.1-27.1178.751.40000112.2G261 L265 Y266G261-T263 VanDerWaalsContact C-N 3.28Å; G261-T263 PolarHBondContact O-N 3.45Å; T263-L265 PolarHBondContact O-N 2.96Å; T263-Y266 PolarHBondContact O-N 3.23Å
264A88.8Confident90.1Very high12 Ų1263 Ų6310%0.09933%0.326CS..G310 helixtrans-63.2-27.8175.100000112.5C232 V256 E260 G261 I262 Y266 S267C232-A264 PolarHBondContact SG-O 3.45Å; V256-A264 HydrophobicContact CG1-CB 4.05Å; E260-A264 HydrophobicContact CB-CB 3.58Å; G261-A264 WeakPolarHBondContact O-CB 3.28Å; G261-A264 PolarHBondContact O-N 2.89Å; I262-A264 PolarHBondContact O-N 3.36Å; A264-Y266 PolarHBondContact O-N 3.38Å; A264-S267 VanDerWaalsContact O-CB 3.26Å; A264-S267 WeakPolarHBondContact O-CB 3.36Å; A264-S267 PolarHBondContact O-N 2.92Å; A264-S267 VanDerWaalsContact O-N 3.09Å
265L90.3Very high90Very high4 Ų460.5 Ų60.52%0.02131%0.31CS..G310 helixtrans-63.8-21.9174-62174.4000112.5Y228 P229 C232 I233 F253 V256 V257 I262 T263Y228-L265 WeakPolarHBondContact CD1-O 3.46Å; P229-L265 HydrophobicContact CB-CB 4.11Å; P229-L265 HydrophobicContact CB-CD1 4.17Å; P229-L265 HydrophobicContact CB-CD2 4.5Å; P229-L265 HydrophobicContact CG-CB 4.35Å; C232-L265 WeakPolarHBondContact CB-O 3.35Å; I233-L265 HydrophobicContact CD1-CD2 3.78Å; I233-L265 HydrophobicContact CG1-CD2 4.1Å; F253-L265 HydrophobicContact CD2-CD1 4.49Å; F253-L265 HydrophobicContact CD2-CD2 4.25Å; F253-L265 HydrophobicContact CE2-CD1 3.73Å; F253-L265 HydrophobicContact CE2-CD2 4.27Å; F253-L265 HydrophobicContact CZ-CD1 4.28Å; V256-L265 HydrophobicContact CB-CD2 4.48Å; V256-L265 HydrophobicContact CG1-CD2 3.84Å; V256-L265 HydrophobicContact CG1-CG 4.44Å; V257-L265 HydrophobicContact CG2-CD1 3.86Å; V257-L265 HydrophobicContact CG2-CG 4.47Å; I262-L265 HydrophobicContact CG1-CD1 4Å; I262-L265 VanDerWaalsContact O-CB 3.28Å; I262-L265 WeakPolarHBondContact O-CB 3.49Å; I262-L265 PolarHBondContact O-N 3.34Å; T263-L265 PolarHBondContact O-N 2.96Å
266Y90.9Very high89.9Confident88 Ų8857.1 Ų57.135%0.34529%0.294SS..G310 helixtrans-101.29.4177.6-65.2-85.8000113.3L225 Y228 P229 T263 A264 G268 L269L225-Y266 HydrophobicContact CD2-CE1 4.35Å; L225-Y266 PolarHBondContact O-OH 3.39Å; Y228-Y266 HydrophobicContact CD1-CD1 4.25Å; Y228-Y266 HydrophobicContact CG-CD1 4.33Å; P229-Y266 HydrophobicContact CG-CE1 4.43Å; P229-Y266 HydrophobicContact CG-CE2 4.31Å; T263-Y266 PolarHBondContact O-N 3.23Å; A264-Y266 PolarHBondContact O-N 3.38Å; Y266-G268 PolarHBondContact O-N 3.4Å; Y266-L269 HydrophobicContact CD1-CD2 4.43Å; Y266-L269 VanDerWaalsContact O-CB 3.27Å; Y266-L269 WeakPolarHBondContact O-CB 3.16Å; Y266-L269 PolarHBondContact O-N 2.95Å; Y266-L269 VanDerWaalsContact O-N 3.13Å
267S87.9Confident89.8Confident25 Ų2564.8 Ų64.818%0.17533%0.327CS..THydrogen-bonded Turntrans-61.3129.7173.4-1760000110.8M37 Q38 Y228 A264M37-S267 PolarHBondContact O-OG 2.88Å; Q38-S267 WeakPolarHBondContact CG-O 3.33Å; Q38-S267 PolarHBondContact NE2-O 3.44Å; Y228-S267 VanDerWaalsContact CE1-O 3.3Å; Y228-S267 WeakPolarHBondContact CE1-O 3.08Å; A264-S267 VanDerWaalsContact O-CB 3.26Å; A264-S267 WeakPolarHBondContact O-CB 3.36Å; A264-S267 PolarHBondContact O-N 2.92Å; A264-S267 VanDerWaalsContact O-N 3.09Å
268G87.1Confident89.8Confident3 Ų364.7 Ų64.73%0.03133%0.327CS..THydrogen-bonded Turntrans92.8-4.5-175.100000114.8Y228 Y266 K270 P271 T272Y228-G268 WeakPolarHBondContact OH-CA 3.47Å; Y228-G268 PolarHBondContact OH-O 3.3Å; Y266-G268 PolarHBondContact O-N 3.4Å; G268-K270 VanDerWaalsContact C-N 3.26Å; G268-K270 PolarHBondContact O-N 3.47Å; G268-P271 VanDerWaalsContact C-CD 3.46Å; G268-P271 WeakPolarHBondContact O-CD 3.3Å; G268-P271 WeakPolarHBondContact O-CG 3.33Å; G268-T272 PolarHBondContact O-N 3.21Å; G268-T272 VanDerWaalsContact O-N 3.1Å; G268-T272 PolarHBondContact O-OG1 2.86Å
269L87.9Confident89.7Confident46 Ų4656.4 Ų56.424%0.24129%0.291CS..Hα-helixtrans-59.5-41.5178.9-177.263.4000110.9Y228 Y266 T272 M273Y228-L269 HydrophobicContact CD2-CD1 3.83Å; Y228-L269 HydrophobicContact CE1-CB 4.06Å; Y228-L269 HydrophobicContact CE2-CB 4.43Å; Y228-L269 HydrophobicContact CE2-CD1 3.79Å; Y228-L269 HydrophobicContact CG-CD1 4.34Å; Y228-L269 VanDerWaalsContact CZ-CA 3.5Å; Y228-L269 WeakPolarHBondContact OH-CA 3.25Å; Y228-L269 PolarHBondContact OH-N 3.16Å; Y228-L269 VanDerWaalsContact OH-N 3.09Å; Y266-L269 HydrophobicContact CD1-CD2 4.43Å; Y266-L269 VanDerWaalsContact O-CB 3.27Å; Y266-L269 WeakPolarHBondContact O-CB 3.16Å; Y266-L269 PolarHBondContact O-N 2.95Å; Y266-L269 VanDerWaalsContact O-N 3.13Å; L269-T272 WeakPolarHBondContact O-CA 3.19Å; L269-T272 WeakPolarHBondContact O-CB 3.19Å; L269-T272 PolarHBondContact O-N 3.35Å; L269-T272 VanDerWaalsContact O-N 3.09Å; L269-M273 HydrophobicContact CD1-CG 4.22Å; L269-M273 HydrophobicContact CD1-SD 4.44Å; L269-M273 HydrophobicContact CG-CG 4.23Å; L269-M273 WeakPolarHBondContact O-CG 3.39Å; L269-M273 PolarHBondContact O-N 3.17Å
270K89.7Confident89.6Confident156 Ų15654.9 Ų54.968%0.67828%0.283SS*.Hα-helixtrans-55.4-56.4176.5-66.7-178.1-178.6-1800113.3G268 T272 M273 I274G268-K270 VanDerWaalsContact C-N 3.26Å; G268-K270 PolarHBondContact O-N 3.47Å; K270-T272 PolarHBondContact O-N 3.03Å; K270-M273 PolarHBondContact O-N 3.4Å; K270-I274 WeakPolarHBondContact O-CG1 3.35Å; K270-I274 PolarHBondContact O-N 3.45Å
271P90.4Very high89.7Confident0 Ų054 Ų540%029%0.289CS..Hα-helixtrans-58.6-35.4174.912-22000112.4F30 M33 K34 M37 L47 G268 I274 R275F30-P271 HydrophobicContact CB-CB 4.34Å; F30-P271 HydrophobicContact CD1-CB 4.49Å; M33-P271 HydrophobicContact CB-CB 4.31Å; K34-P271 HydrophobicContact CB-CG 4.32Å; M37-P271 HydrophobicContact SD-CG 4.05Å; L47-P271 HydrophobicContact CD1-CB 3.66Å; L47-P271 HydrophobicContact CD1-CG 3.87Å; G268-P271 VanDerWaalsContact C-CD 3.46Å; G268-P271 WeakPolarHBondContact O-CD 3.3Å; G268-P271 WeakPolarHBondContact O-CG 3.33Å; P271-I274 PolarHBondContact O-N 3.38Å; P271-R275 WeakPolarHBondContact O-CB 3.45Å; P271-R275 PolarHBondContact O-N 2.81Å
272T89.6Confident89.9Confident5 Ų553.6 Ų53.63%0.03128%0.283CS..Hα-helixtrans-64.2-44.2178.5-50.50000112.1Y228 G268 L269 K270 R275 A276Y228-T272 HydrophobicContact CE2-CG2 4.21Å; Y228-T272 PolarHBondContact OH-OG1 3.33Å; G268-T272 PolarHBondContact O-N 3.21Å; G268-T272 VanDerWaalsContact O-N 3.1Å; G268-T272 PolarHBondContact O-OG1 2.86Å; L269-T272 WeakPolarHBondContact O-CA 3.19Å; L269-T272 WeakPolarHBondContact O-CB 3.19Å; L269-T272 PolarHBondContact O-N 3.35Å; L269-T272 VanDerWaalsContact O-N 3.09Å; K270-T272 PolarHBondContact O-N 3.03Å; T272-R275 WeakPolarHBondContact O-CB 3.28Å; T272-R275 PolarHBondContact O-N 3.25Å; T272-A276 PolarHBondContact O-N 3.38Å
273M88.9Confident89.9Confident79 Ų7950.7 Ų50.739%0.38927%0.269SS..Hα-helixtrans-66.2-44.3177.5-67.1-59.3-70.700111.4W224 L269 K270 R275 A276 F277W224-M273 HydrophobicContact CE3-SD 3.67Å; W224-M273 HydrophobicContact CZ3-CE 4.43Å; W224-M273 HydrophobicContact CZ3-SD 3.68Å; L269-M273 HydrophobicContact CD1-CG 4.22Å; L269-M273 HydrophobicContact CD1-SD 4.44Å; L269-M273 HydrophobicContact CG-CG 4.23Å; L269-M273 WeakPolarHBondContact O-CG 3.39Å; L269-M273 PolarHBondContact O-N 3.17Å; K270-M273 PolarHBondContact O-N 3.4Å; M273-R275 VanDerWaalsContact C-N 3.34Å; M273-R275 PolarHBondContact O-N 3.04Å; M273-A276 WeakPolarHBondContact O-CB 3.36Å; M273-A276 PolarHBondContact O-N 3.49Å; M273-F277 WeakPolarHBondContact O-CD2 3.39Å
274I91.7Very high90Very high79 Ų7951.5 Ų51.541%0.40526%0.263SS..Hα-helixtrans-64.6-41.9177.6-64.7168.3000110.1F30 L47 K270 P271 A276 F277 P278F30-I274 HydrophobicContact CD1-CB 4.34Å; F30-I274 HydrophobicContact CD1-CG2 4.1Å; F30-I274 HydrophobicContact CE1-CB 4.1Å; F30-I274 HydrophobicContact CE1-CG2 3.38Å; F30-I274 HydrophobicContact CZ-CG2 3.83Å; L47-I274 HydrophobicContact CD2-CD1 3.47Å; L47-I274 VanDerWaalsContact CD2-CD1 3.47Å; K270-I274 WeakPolarHBondContact O-CG1 3.35Å; K270-I274 PolarHBondContact O-N 3.45Å; P271-I274 PolarHBondContact O-N 3.38Å; I274-A276 PolarHBondContact O-N 2.78Å; I274-F277 PolarHBondContact O-N 2.9Å; I274-P278 WeakPolarHBondContact O-CD 3.49Å
275R91.5Very high90.3Very high45 Ų4556.9 Ų56.917%0.1729%0.29CS..Hα-helixtrans-54-37.9177.3-170.2-170.17275.52.8112.9F30 D31 P271 T272 M273 F277 P278 A279F30-R275 HydrophobicContact CB-CB 3.53Å; F30-R275 HydrophobicContact CB-CG 3.71Å; F30-R275 HydrophobicContact CD2-CB 4.03Å; F30-R275 HydrophobicContact CD2-CG 4.02Å; F30-R275 HydrophobicContact CG-CB 3.81Å; F30-R275 HydrophobicContact CG-CG 4.15Å; D31-R275 WeakPolarHBondContact OD1-CD 3.38Å; D31-R275 IonicContact OD1-NE 2.65Å; D31-R275 PolarHBondContact OD1-NE 2.88Å; P271-R275 WeakPolarHBondContact O-CB 3.45Å; P271-R275 PolarHBondContact O-N 2.81Å; T272-R275 WeakPolarHBondContact O-CB 3.28Å; T272-R275 PolarHBondContact O-N 3.25Å; M273-R275 VanDerWaalsContact C-N 3.34Å; M273-R275 PolarHBondContact O-N 3.04Å; R275-F277 PolarHBondContact O-N 2.99Å; R275-P278 VanDerWaalsContact O-CD 3.26Å; R275-P278 WeakPolarHBondContact O-CD 3.42Å; R275-A279 HydrophobicContact CG-CB 4.13Å; R275-A279 WeakPolarHBondContact O-CB 3.46Å; R275-A279 PolarHBondContact O-N 2.92Å
276A88.1Confident90.4Very high13 Ų1357.7 Ų57.711%0.10730%0.297CS..Hα-helixtrans-56.5-38.8-174.800000111.9W224 T272 M273 I274 N280W224-A276 HydrophobicContact CH2-CB 3.82Å; T272-A276 PolarHBondContact O-N 3.38Å; M273-A276 WeakPolarHBondContact O-CB 3.36Å; M273-A276 PolarHBondContact O-N 3.49Å; I274-A276 PolarHBondContact O-N 2.78Å; A276-N280 WeakPolarHBondContact O-CB 3.46Å; A276-N280 PolarHBondContact O-N 3.25Å; A276-N280 VanDerWaalsContact O-N 3.11Å; A276-N280 PolarHBondContact O-ND2 3.06Å
277F88.6Confident90.4Very high163 Ų16356.6 Ų56.672%0.71529%0.293SS*.Hα-helixtrans-66.9-62.3-179.6-68.4-89.6000113.7M273 I274 R275 A279 G281M273-F277 WeakPolarHBondContact O-CD2 3.39Å; I274-F277 PolarHBondContact O-N 2.9Å; R275-F277 PolarHBondContact O-N 2.99Å; F277-A279 PolarHBondContact O-N 3.25Å; F277-G281 WeakPolarHBondContact O-CA 3.36Å; F277-G281 PolarHBondContact O-N 3.4Å
278P91.5Very high90.6Very high51 Ų5160.5 Ų60.533%0.33131%0.308SS..Hα-helixtrans-67.1-36.2-179.528.4-33.9000112.4F30 I274 R275 A282F30-P278 HydrophobicContact CD2-CG 4.42Å; F30-P278 HydrophobicContact CE2-CG 3.67Å; F30-P278 HydrophobicContact CZ-CG 4.17Å; I274-P278 WeakPolarHBondContact O-CD 3.49Å; R275-P278 VanDerWaalsContact O-CD 3.26Å; R275-P278 WeakPolarHBondContact O-CD 3.42Å; P278-A282 WeakPolarHBondContact O-CB 3.38Å; P278-A282 PolarHBondContact O-N 2.92Å
279A90.7Very high90.9Very high0 Ų067.8 Ų67.80%034%0.336CS..Hα-helixtrans-67.8-49.4-178.800000111.9T26 R275 F277 A282 L283T26-A279 WeakPolarHBondContact OG1-CA 2.97Å; R275-A279 HydrophobicContact CG-CB 4.13Å; R275-A279 WeakPolarHBondContact O-CB 3.46Å; R275-A279 PolarHBondContact O-N 2.92Å; F277-A279 PolarHBondContact O-N 3.25Å; A279-A282 PolarHBondContact O-N 2.92Å; A279-L283 WeakPolarHBondContact O-CB 3.4Å; A279-L283 PolarHBondContact O-N 3.49Å
280N89.8Confident91.1Very high71 Ų7166.6 Ų66.638%0.3833%0.331SS..Hα-helixtrans-69.9-39.2177.6-62-23.2000110.9A276 A282 L283 F284A276-N280 WeakPolarHBondContact O-CB 3.46Å; A276-N280 PolarHBondContact O-N 3.25Å; A276-N280 VanDerWaalsContact O-N 3.11Å; A276-N280 PolarHBondContact O-ND2 3.06Å; N280-A282 VanDerWaalsContact C-N 3.35Å; N280-A282 PolarHBondContact O-N 3.36Å; N280-L283 WeakPolarHBondContact O-CB 3.48Å; N280-L283 PolarHBondContact O-N 3.35Å; N280-F284 WeakPolarHBondContact O-CD2 3.39Å; N280-F284 PolarHBondContact O-N 3.39Å
281G90.7Very high91.1Very high39 Ų3962.7 Ų62.740%0.40231%0.312SS..Hα-helixtrans-58.8-45175.300000112.4F277 F284 L285F277-G281 WeakPolarHBondContact O-CA 3.36Å; F277-G281 PolarHBondContact O-N 3.4Å; G281-F284 PolarHBondContact O-N 3.34Å; G281-L285 VanDerWaalsContact O-CB 3.25Å; G281-L285 WeakPolarHBondContact O-CB 3.36Å; G281-L285 PolarHBondContact O-N 2.95Å
282A93.8Very high91.1Very high19 Ų1969.2 Ų69.216%0.15734%0.341CS..Hα-helixtrans-66.5-37.1175.900000112.5A22 T26 P278 A279 N280 A286A22-A282 HydrophobicContact CB-CB 4.22Å; T26-A282 HydrophobicContact CG2-CB 3.64Å; T26-A282 WeakPolarHBondContact OG1-CB 3.2Å; P278-A282 WeakPolarHBondContact O-CB 3.38Å; P278-A282 PolarHBondContact O-N 2.92Å; A279-A282 PolarHBondContact O-N 2.92Å; N280-A282 VanDerWaalsContact C-N 3.35Å; N280-A282 PolarHBondContact O-N 3.36Å; A282-A286 WeakPolarHBondContact O-CB 3.22Å; A282-A286 PolarHBondContact O-N 3.45Å
283L91.8Very high91.2Very high56 Ų5672.8 Ų72.829%0.29336%0.359SS..Hα-helixtrans-56.9-55.9173.8-173.1154.1000110.8C23 A279 N280 A286 Y287C23-L283 HydrophobicContact CB-CB 3.92Å; C23-L283 HydrophobicContact CB-CD1 3.97Å; C23-L283 HydrophobicContact CB-CG 4.32Å; A279-L283 WeakPolarHBondContact O-CB 3.4Å; A279-L283 PolarHBondContact O-N 3.49Å; N280-L283 WeakPolarHBondContact O-CB 3.48Å; N280-L283 PolarHBondContact O-N 3.35Å; L283-A286 PolarHBondContact O-N 3.46Å; L283-Y287 VanDerWaalsContact O-CB 3.25Å; L283-Y287 WeakPolarHBondContact O-CB 3.43Å; L283-Y287 PolarHBondContact O-N 3.16Å
284F91.3Very high91.3Very high128 Ų12871 Ų7156%0.56135%0.35SS*.Hα-helixtrans-64.5-44.4-177.9-75.1-65.5000111.6N280 G281 A286 Y287 E288N280-F284 WeakPolarHBondContact O-CD2 3.39Å; N280-F284 PolarHBondContact O-N 3.39Å; G281-F284 PolarHBondContact O-N 3.34Å; F284-A286 PolarHBondContact O-N 3Å; F284-Y287 PolarHBondContact O-N 3.34Å; F284-E288 WeakPolarHBondContact O-CB 3.39Å; F284-E288 WeakPolarHBondContact O-CG 3.46Å; F284-E288 PolarHBondContact O-N 3.16Å
285L93.2Very high91.1Very high125 Ų12568.6 Ų68.665%0.65434%0.338SS*.Hα-helixtrans-61.3-47.5179.1-175.1150.1000111.6G281 Y289G281-L285 VanDerWaalsContact O-CB 3.25Å; G281-L285 WeakPolarHBondContact O-CB 3.36Å; G281-L285 PolarHBondContact O-N 2.95Å; L285-Y289 WeakPolarHBondContact O-CB 3.43Å; L285-Y289 PolarHBondContact O-N 3Å
286A93.9Very high90.9Very high20 Ų2070.2 Ų70.217%0.16535%0.35CS..Hα-helixtrans-67.1-40179.500000111.7A22 A282 L283 F284 S290A22-A286 HydrophobicContact CB-CB 3.57Å; A282-A286 WeakPolarHBondContact O-CB 3.22Å; A282-A286 PolarHBondContact O-N 3.45Å; L283-A286 PolarHBondContact O-N 3.46Å; F284-A286 PolarHBondContact O-N 3Å; A286-S290 WeakPolarHBondContact O-CB 3.32Å; A286-S290 PolarHBondContact O-N 3.31Å; A286-S290 PolarHBondContact O-OG 2.95Å
287Y91.2Very high90.8Very high66 Ų6675.7 Ų75.726%0.25937%0.373SS..Hα-helixtrans-61.3-55.1175.6178.6-94000111.7A15 L283 F284 Y289 S290 R291A15-Y287 HydrophobicContact CB-CD2 3.77Å; A15-Y287 HydrophobicContact CB-CE2 3.87Å; A15-Y287 HydrophobicContact CB-CG 4.49Å; L283-Y287 VanDerWaalsContact O-CB 3.25Å; L283-Y287 WeakPolarHBondContact O-CB 3.43Å; L283-Y287 PolarHBondContact O-N 3.16Å; F284-Y287 PolarHBondContact O-N 3.34Å; Y287-Y289 PolarHBondContact O-N 3.03Å; Y287-S290 PolarHBondContact O-OG 3.49Å; Y287-S290 VanDerWaalsContact O-OG 3.07Å; Y287-R291 WeakPolarHBondContact O-CB 3.44Å; Y287-R291 PolarHBondContact O-N 3.39Å
288E91.6Very high90.5Very high106 Ų10670.6 Ų70.650%0.49535%0.353SS..Hα-helixtrans-62.7-45-177.6-72.3-64.5160.600112F284 K292F284-E288 WeakPolarHBondContact O-CB 3.39Å; F284-E288 WeakPolarHBondContact O-CG 3.46Å; F284-E288 PolarHBondContact O-N 3.16Å; E288-K292 WeakPolarHBondContact O-CB 3.39Å; E288-K292 PolarHBondContact O-N 3.43Å
289Y93.4Very high90.1Very high156 Ų15675.5 Ų75.561%0.61237%0.371SS*.Hα-helixtrans-66.8-46.4-178.6-171.9-104.4000111.9L285 Y287 K292 L293L285-Y289 WeakPolarHBondContact O-CB 3.43Å; L285-Y289 PolarHBondContact O-N 3Å; Y287-Y289 PolarHBondContact O-N 3.03Å; Y289-K292 PolarHBondContact O-N 3.41Å; Y289-L293 HydrophobicContact CD1-CD1 3.71Å; Y289-L293 HydrophobicContact CD1-CG 4.39Å; Y289-L293 HydrophobicContact CE1-CD1 3.25Å; Y289-L293 HydrophobicContact CE1-CG 4.11Å; Y289-L293 HydrophobicContact CE2-CD1 4.49Å; Y289-L293 HydrophobicContact CG-CD1 4.5Å; Y289-L293 WeakPolarHBondContact O-CB 3.37Å; Y289-L293 WeakPolarHBondContact O-CG 3.43Å; Y289-L293 PolarHBondContact O-N 3.15Å
290S91.3Very high89.5Confident22 Ų2279.7 Ų79.715%0.15441%0.406CS..Hα-helixtrans-65.5-43.317960.80000111.8A15 A286 Y287 L293 M294A15-S290 VanDerWaalsContact CA-OG 3.25Å; A15-S290 WeakPolarHBondContact CA-OG 3.42Å; A15-S290 VanDerWaalsContact CB-OG 3.3Å; A15-S290 WeakPolarHBondContact CB-OG 3.41Å; A286-S290 WeakPolarHBondContact O-CB 3.32Å; A286-S290 PolarHBondContact O-N 3.31Å; A286-S290 PolarHBondContact O-OG 2.95Å; Y287-S290 PolarHBondContact O-OG 3.49Å; Y287-S290 VanDerWaalsContact O-OG 3.07Å; S290-L293 PolarHBondContact O-N 3.11Å; S290-M294 WeakPolarHBondContact O-CE 3.49Å; S290-M294 WeakPolarHBondContact O-CG 3.31Å; S290-M294 PolarHBondContact O-N 3.21Å
291R90.3Very high88.4Confident73 Ų7387.6 Ų87.628%0.27543%0.432SS..Hα-helixtrans-61.6-47.3176.4-174.5172.6176.6-83.6-5.6111.8I11 D12 A15 Y287 L293 M294 M295I11-R291 HydrophobicContact CG2-CG 4.07Å; D12-R291 WeakPolarHBondContact OD1-CD 3.14Å; D12-R291 IonicContact OD1-CZ 3.97Å; D12-R291 IonicContact OD1-NE 2.9Å; D12-R291 PolarHBondContact OD1-NE 3.41Å; A15-R291 HydrophobicContact CB-CB 3.84Å; Y287-R291 WeakPolarHBondContact O-CB 3.44Å; Y287-R291 PolarHBondContact O-N 3.39Å; R291-L293 PolarHBondContact O-N 3.47Å; R291-M294 PolarHBondContact O-N 2.82Å; R291-M295 HydrophobicContact CG-CG 4.46Å; R291-M295 WeakPolarHBondContact O-CB 3.46Å; R291-M295 WeakPolarHBondContact O-CG 3.35Å; R291-M295 PolarHBondContact O-N 2.95Å
292K91.2Very high88.3Confident138 Ų13890.1 Ų90.160%0.643%0.434SS*.Hα-helixtrans-61.7-43.7178.4-174.1175.5-178.1177.10111.9E288 Y289 M295 N296E288-K292 WeakPolarHBondContact O-CB 3.39Å; E288-K292 PolarHBondContact O-N 3.43Å; Y289-K292 PolarHBondContact O-N 3.41Å; K292-M295 PolarHBondContact O-N 2.94Å; K292-N296 WeakPolarHBondContact O-CB 3.33Å; K292-N296 PolarHBondContact O-N 3.07Å; K292-N296 PolarHBondContact O-OD1 3.1Å
293L91.5Very high88Confident80 Ų8093.8 Ų93.842%0.41945%0.449SS..Hα-helixtrans-60.3-47.2176.6-78.3177.7000112.1Y289 S290 R291 N296 Q297Y289-L293 HydrophobicContact CD1-CD1 3.71Å; Y289-L293 HydrophobicContact CD1-CG 4.39Å; Y289-L293 HydrophobicContact CE1-CD1 3.25Å; Y289-L293 HydrophobicContact CE1-CG 4.11Å; Y289-L293 HydrophobicContact CE2-CD1 4.49Å; Y289-L293 HydrophobicContact CG-CD1 4.5Å; Y289-L293 WeakPolarHBondContact O-CB 3.37Å; Y289-L293 WeakPolarHBondContact O-CG 3.43Å; Y289-L293 PolarHBondContact O-N 3.15Å; S290-L293 PolarHBondContact O-N 3.11Å; R291-L293 PolarHBondContact O-N 3.47Å; L293-N296 PolarHBondContact O-N 3.29Å; L293-Q297 WeakPolarHBondContact O-CG 3.42Å; L293-Q297 PolarHBondContact O-N 3Å
294M89.6Confident87.8Confident40 Ų4095.9 Ų95.920%0.19746%0.457CS..Hα-helixtrans-67.3-38.4179.8-71.3-177.7-7900112.6I11 T14 A15 S290 R291 Q297 L298I11-M294 HydrophobicContact CD1-CB 4.28Å; I11-M294 HydrophobicContact CG1-CB 4.04Å; I11-M294 HydrophobicContact CG1-SD 4.47Å; I11-M294 HydrophobicContact CG2-CB 3.88Å; I11-M294 HydrophobicContact CG2-CE 3.99Å; I11-M294 HydrophobicContact CG2-SD 4.32Å; I11-M294 WeakPolarHBondContact O-CE 3.41Å; T14-M294 HydrophobicContact CG2-CE 4.08Å; T14-M294 HydrophobicContact CG2-SD 3.86Å; A15-M294 HydrophobicContact CB-CE 3.86Å; S290-M294 WeakPolarHBondContact O-CE 3.49Å; S290-M294 WeakPolarHBondContact O-CG 3.31Å; S290-M294 PolarHBondContact O-N 3.21Å; R291-M294 PolarHBondContact O-N 2.82Å; M294-Q297 PolarHBondContact O-N 3.06Å; M294-L298 PolarHBondContact O-N 3.02Å
295M87.8Confident87.6Confident29 Ų2994 Ų9414%0.14345%0.451CS..Hα-helixtrans-65.4-44.4175.2-74.3-66.8-169.800111.9Q8 I11 R291 K292 Q297 L298 E299Q8-M295 HydrophobicContact CG-CE 4.03Å; I11-M295 HydrophobicContact CD1-CE 4.27Å; I11-M295 HydrophobicContact CD1-CG 4.48Å; I11-M295 HydrophobicContact CD1-SD 3.83Å; I11-M295 HydrophobicContact CG2-CE 4.25Å; I11-M295 HydrophobicContact CG2-CG 4.39Å; R291-M295 HydrophobicContact CG-CG 4.46Å; R291-M295 WeakPolarHBondContact O-CB 3.46Å; R291-M295 WeakPolarHBondContact O-CG 3.35Å; R291-M295 PolarHBondContact O-N 2.95Å; K292-M295 PolarHBondContact O-N 2.94Å; M295-Q297 VanDerWaalsContact C-N 3.26Å; M295-Q297 PolarHBondContact O-N 3.02Å; M295-L298 WeakPolarHBondContact O-CB 3.29Å; M295-L298 PolarHBondContact O-N 3.47Å; M295-E299 WeakPolarHBondContact O-CG 3.46Å; M295-E299 PolarHBondContact O-N 2.87Å
296N88.3Confident87.3Confident80 Ų8092.1 Ų92.143%0.42844%0.438SS..Hα-helixtrans-61.3-37.1176.1-71.6-3000111.9K292 L293 A300K292-N296 WeakPolarHBondContact O-CB 3.33Å; K292-N296 PolarHBondContact O-N 3.07Å; K292-N296 PolarHBondContact O-OD1 3.1Å; L293-N296 PolarHBondContact O-N 3.29Å; N296-A300 WeakPolarHBondContact O-CB 3.49Å; N296-A300 PolarHBondContact O-N 2.98Å; N296-A300 VanDerWaalsContact O-N 3.16Å
297Q84.5Confident86.8Confident128 Ų12896.9 Ų96.960%0.59846%0.457SS*.Hα-helixtrans-65.2-41.7173.6-75.5-178.4-30.600111.3L293 M294 M295 E299 A300 Y301L293-Q297 WeakPolarHBondContact O-CG 3.42Å; L293-Q297 PolarHBondContact O-N 3Å; M294-Q297 PolarHBondContact O-N 3.06Å; M295-Q297 VanDerWaalsContact C-N 3.26Å; M295-Q297 PolarHBondContact O-N 3.02Å; Q297-E299 VanDerWaalsContact C-N 3.33Å; Q297-E299 PolarHBondContact O-N 3.04Å; Q297-A300 PolarHBondContact O-N 3.01Å; Q297-Y301 VanDerWaalsContact O-CD2 3.29Å; Q297-Y301 WeakPolarHBondContact O-CD2 3.49Å
298L82.9Confident86.5Confident56 Ų5699.1 Ų99.129%0.29347%0.471SS..Hα-helixtrans-64.6-36.7177.7-168.573.4000112.7I7 I11 M294 M295 A300I7-L298 HydrophobicContact CD1-CD1 4.26Å; I7-L298 HydrophobicContact CG2-CD1 3.67Å; I7-L298 HydrophobicContact CG2-CD2 3.77Å; I7-L298 HydrophobicContact CG2-CG 4.37Å; I11-L298 HydrophobicContact CD1-CD2 4.23Å; M294-L298 PolarHBondContact O-N 3.02Å; M295-L298 WeakPolarHBondContact O-CB 3.29Å; M295-L298 PolarHBondContact O-N 3.47Å; L298-A300 VanDerWaalsContact C-N 3.32Å
299E82.6Confident86.1Confident153 Ų15398.5 Ų98.572%0.71547%0.469SS*.Hα-helixtrans-73.8-23.7177.7-71.4178.3178.800113.2M295 Q297 Y301M295-E299 WeakPolarHBondContact O-CG 3.46Å; M295-E299 PolarHBondContact O-N 2.87Å; Q297-E299 VanDerWaalsContact C-N 3.33Å; Q297-E299 PolarHBondContact O-N 3.04Å; E299-Y301 VanDerWaalsContact C-N 3.32Å
300A79Confident85.5Confident88 Ų8893.8 Ų93.873%0.72746%0.457SS*.Hα-helixtrans-79-13.617700000113.8N296 Q297 L298N296-A300 WeakPolarHBondContact O-CB 3.49Å; N296-A300 PolarHBondContact O-N 2.98Å; N296-A300 VanDerWaalsContact O-N 3.16Å; Q297-A300 PolarHBondContact O-N 3.01Å; L298-A300 VanDerWaalsContact C-N 3.32Å
301Y67Low85Confident238 Ų238100.3 Ų100.393%0.93348%0.484SS*.  trans-98.10175.3-84.3-77.6000111.7Q297 E299Q297-Y301 VanDerWaalsContact O-CD2 3.29Å; Q297-Y301 WeakPolarHBondContact O-CD2 3.49Å; E299-Y301 VanDerWaalsContact C-N 3.32Å

Retrieved 301 of 301 residues in 496.6 ms (Link to these results)