A0A096NVY3_PAPAN Loading...

Mitochondrial glutamate carrier 2

Responsible for the transport of glutamate from the cytosol into the mitochondrial matrix with the concomitant import of a proton (symport system).

AlphaFold DB , UniProt , Accession A0A096NVY3, Species PAPAN (Papio anubis, Olive baboon), Gene SLC25A18, Length 315 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M37.8Very low53.6Low195 Ų19595.6 Ų95.696%0.96151%0.512SS*.  0-51.30-72.1179-163.200112.2H3 Q4 D5M1-H3 VanDerWaalsContact C-N 3.3Å; M1-H3 PolarHBondContact O-N 3.17Å; M1-H3 VanDerWaalsContact O-N 3.15Å; M1-Q4 WeakPolarHBondContact O-CB 3.05Å; M1-Q4 PolarHBondContact O-N 3.17Å; M1-D5 PolarHBondContact O-N 2.78Å
2A35.2Very low54.8Low79 Ų7992.8 Ų92.865%0.65350%0.496SS*.Hα-helixtrans-56.5-32.1179.900000116.2Q4 L6A2-Q4 VanDerWaalsContact C-N 3.3Å; A2-Q4 PolarHBondContact O-N 3.17Å; A2-L6 PolarHBondContact O-N 3.12Å
3H37.2Very low56.1Low174 Ų17490.7 Ų90.781%0.80648%0.484SS*.Hα-helixtrans-75.8-17.2178.9-147.7-56.3000113.7M1M1-H3 VanDerWaalsContact C-N 3.3Å; M1-H3 PolarHBondContact O-N 3.17Å; M1-H3 VanDerWaalsContact O-N 3.15Å
4Q48.3Very low56.8Low132 Ų13285.4 Ų85.462%0.61746%0.455SS*.Hα-helixtrans-86.8-38.2-179.8-138165.3-15.100110.5M1 A2 S7 I8M1-Q4 WeakPolarHBondContact O-CB 3.05Å; M1-Q4 PolarHBondContact O-N 3.17Å; A2-Q4 VanDerWaalsContact C-N 3.3Å; A2-Q4 PolarHBondContact O-N 3.17Å; Q4-S7 PolarHBondContact O-N 2.88Å; Q4-I8 PolarHBondContact O-N 2.98Å
5D48.7Very low57.4Low99 Ų9979.9 Ų79.953%0.52943%0.427SS..Hα-helixtrans-66.7-35.7174.1-65.8-38.3000112.7M1 S7 I8 T9M1-D5 PolarHBondContact O-N 2.78Å; D5-S7 VanDerWaalsContact C-N 3.3Å; D5-S7 PolarHBondContact O-N 3.4Å; D5-I8 PolarHBondContact O-N 3.48Å; D5-T9 WeakPolarHBondContact O-CB 3.43Å; D5-T9 PolarHBondContact O-N 2.94Å; D5-T9 PolarHBondContact O-OG1 2.82Å
6L50.8Low58.2Low84 Ų8475.9 Ų75.944%0.4441%0.411SS..Hα-helixtrans-62.3-38.4173.6-120.498.6000111.5A2 A10 L311A2-L6 PolarHBondContact O-N 3.12Å; L6-A10 WeakPolarHBondContact O-CB 3.36Å; L6-A10 PolarHBondContact O-N 3.37Å; L6-L311 HydrophobicContact CD2-CD2 3.97Å; L6-L311 HydrophobicContact CG-CD2 4.34Å
7S65.3Low59Low49 Ų4973.7 Ų73.734%0.34340%0.401SS..Hα-helixtrans-68.8-40.9179.1-170.40000112.3Q4 D5 K11Q4-S7 PolarHBondContact O-N 2.88Å; D5-S7 VanDerWaalsContact C-N 3.3Å; D5-S7 PolarHBondContact O-N 3.4Å; S7-K11 WeakPolarHBondContact O-CB 3.31Å; S7-K11 WeakPolarHBondContact O-CD 3.24Å; S7-K11 WeakPolarHBondContact O-CG 3.11Å; S7-K11 PolarHBondContact O-N 3.36Å; S7-K11 WeakPolarHBondContact OG-CE 3.32Å; S7-K11 PolarHBondContact OG-NZ 2.91Å
8I66.5Low59.4Low61 Ų6170.2 Ų70.231%0.31338%0.383SS..Hα-helixtrans-68.4-44.8179.4-65.7168.5000110.2Q4 D5 K11 L12Q4-I8 PolarHBondContact O-N 2.98Å; D5-I8 PolarHBondContact O-N 3.48Å; I8-K11 PolarHBondContact O-N 3.02Å; I8-L12 HydrophobicContact CG2-CD1 4.17Å; I8-L12 WeakPolarHBondContact O-CB 3.4Å; I8-L12 PolarHBondContact O-N 2.81Å
9T68.1Low59.9Low74 Ų7467.2 Ų67.245%0.45437%0.37SS..Hα-helixtrans-63.4-44.2177.7-54.80000111.6D5 K11 L12 I13D5-T9 WeakPolarHBondContact O-CB 3.43Å; D5-T9 PolarHBondContact O-N 2.94Å; D5-T9 PolarHBondContact O-OG1 2.82Å; T9-K11 VanDerWaalsContact C-N 3.34Å; T9-K11 PolarHBondContact O-N 3.26Å; T9-L12 WeakPolarHBondContact O-CB 3.27Å; T9-L12 PolarHBondContact O-N 2.85Å; T9-I13 HydrophobicContact CG2-CD1 3.91Å; T9-I13 VanDerWaalsContact O-CG1 3.29Å; T9-I13 WeakPolarHBondContact O-CG1 3.47Å; T9-I13 PolarHBondContact O-N 3.3Å
10A65.3Low60.6Low15 Ų1567.4 Ų67.412%0.12437%0.37CS..Hα-helixtrans-62.9-38.9176.500000112.6L6 N14 L311L6-A10 WeakPolarHBondContact O-CB 3.36Å; L6-A10 PolarHBondContact O-N 3.37Å; A10-N14 VanDerWaalsContact O-CB 3.27Å; A10-N14 WeakPolarHBondContact O-CB 3.2Å; A10-N14 PolarHBondContact O-N 3.39Å; A10-N14 PolarHBondContact O-ND2 3.43Å; A10-L311 HydrophobicContact CB-CD1 3.65Å; A10-L311 HydrophobicContact CB-CD2 4.27Å
11K66Low61.3Low90 Ų9067 Ų6739%0.39137%0.37SS..Hα-helixtrans-68.4-41.1175.1-74.3168.9-176.8167.30112S7 I8 T9 N14 G15 L83S7-K11 WeakPolarHBondContact O-CB 3.31Å; S7-K11 WeakPolarHBondContact O-CD 3.24Å; S7-K11 WeakPolarHBondContact O-CG 3.11Å; S7-K11 PolarHBondContact O-N 3.36Å; S7-K11 WeakPolarHBondContact OG-CE 3.32Å; S7-K11 PolarHBondContact OG-NZ 2.91Å; I8-K11 PolarHBondContact O-N 3.02Å; T9-K11 VanDerWaalsContact C-N 3.34Å; T9-K11 PolarHBondContact O-N 3.26Å; K11-N14 WeakPolarHBondContact O-CB 3.48Å; K11-N14 PolarHBondContact O-N 2.72Å; K11-G15 PolarHBondContact O-N 3.4Å; K11-L83 WeakPolarHBondContact O-CD2 3.27Å
12L68.8Low62.8Low61 Ų6157.9 Ų57.932%0.31933%0.325SS..Hα-helixtrans-60.1-45.8173.8-93.1170.4000112.3I8 T9 G15 G16 A84I8-L12 HydrophobicContact CG2-CD1 4.17Å; I8-L12 WeakPolarHBondContact O-CB 3.4Å; I8-L12 PolarHBondContact O-N 2.81Å; T9-L12 WeakPolarHBondContact O-CB 3.27Å; T9-L12 PolarHBondContact O-N 2.85Å; L12-G15 PolarHBondContact O-N 3.08Å; L12-G16 PolarHBondContact O-N 3.22Å; L12-A84 HydrophobicContact CD2-CB 3.73Å
13I70.8Confident64.5Low66 Ų6654.9 Ų54.934%0.33830%0.299SS..Hα-helixtrans-64.7-46.2176.4-68.1167.5000110.1T9 G15 G16 V17 L311T9-I13 HydrophobicContact CG2-CD1 3.91Å; T9-I13 VanDerWaalsContact O-CG1 3.29Å; T9-I13 WeakPolarHBondContact O-CG1 3.47Å; T9-I13 PolarHBondContact O-N 3.3Å; I13-G15 VanDerWaalsContact C-N 3.28Å; I13-G15 PolarHBondContact O-N 3.45Å; I13-G16 PolarHBondContact O-N 3.44Å; I13-V17 HydrophobicContact CG2-CG2 4.28Å; I13-V17 WeakPolarHBondContact O-CB 3.48Å; I13-V17 VanDerWaalsContact O-CG2 3.29Å; I13-V17 WeakPolarHBondContact O-CG2 3.07Å; I13-V17 PolarHBondContact O-N 3.46Å; I13-L311 HydrophobicContact CD1-CD1 3.95Å
14N66.6Low66.4Low16 Ų1649.2 Ų49.29%0.08628%0.277CS..Hα-helixtrans-52.9-47.5172.9-93.2-55.4000111.8A10 K11 A18 G307A10-N14 VanDerWaalsContact O-CB 3.27Å; A10-N14 WeakPolarHBondContact O-CB 3.2Å; A10-N14 PolarHBondContact O-N 3.39Å; A10-N14 PolarHBondContact O-ND2 3.43Å; K11-N14 WeakPolarHBondContact O-CB 3.48Å; K11-N14 PolarHBondContact O-N 2.72Å; N14-A18 WeakPolarHBondContact O-CB 3.31Å; N14-A18 PolarHBondContact O-N 2.79Å; N14-G307 VanDerWaalsContact CG-CA 3.43Å; N14-G307 WeakPolarHBondContact OD1-CA 3.11Å; N14-G307 PolarHBondContact OD1-N 3.32Å
15G65.4Low67.8Low3 Ų346 Ų463%0.03127%0.268CS..Hα-helixtrans-65.8-41.6178.700000114.1K11 L12 I13 G19K11-G15 PolarHBondContact O-N 3.4Å; L12-G15 PolarHBondContact O-N 3.08Å; I13-G15 VanDerWaalsContact C-N 3.28Å; I13-G15 PolarHBondContact O-N 3.45Å; G15-G19 PolarHBondContact O-N 2.84Å
16G70.2Confident69Low17 Ų1741.4 Ų41.418%0.17524%0.244CC..Hα-helixtrans-63.4-45.9175.400000111.9L12 I13 G19 L20L12-G16 PolarHBondContact O-N 3.22Å; I13-G16 PolarHBondContact O-N 3.44Å; G16-G19 PolarHBondContact O-N 2.88Å; G16-L20 WeakPolarHBondContact O-CB 3.48Å; G16-L20 PolarHBondContact O-N 3.42Å
17V72.6Confident70.2Confident38 Ų3837.8 Ų37.823%0.2322%0.224CC..Hα-helixtrans-66.4-45.4177174.60000110.8I13 G19 L20 V21 I306 I310I13-V17 HydrophobicContact CG2-CG2 4.28Å; I13-V17 WeakPolarHBondContact O-CB 3.48Å; I13-V17 VanDerWaalsContact O-CG2 3.29Å; I13-V17 WeakPolarHBondContact O-CG2 3.07Å; I13-V17 PolarHBondContact O-N 3.46Å; V17-G19 VanDerWaalsContact C-N 3.29Å; V17-G19 PolarHBondContact O-N 3.19Å; V17-L20 PolarHBondContact O-N 3.36Å; V17-V21 HydrophobicContact CG1-CG2 4.26Å; V17-V21 WeakPolarHBondContact O-CB 3.47Å; V17-V21 VanDerWaalsContact O-CG2 3.3Å; V17-V21 WeakPolarHBondContact O-CG2 3.14Å; V17-V21 PolarHBondContact O-N 2.93Å; V17-I306 HydrophobicContact CG1-CG2 4.08Å; V17-I310 HydrophobicContact CG2-CD1 4.19Å
18A66.4Low70.7Confident10 Ų1036.2 Ų36.28%0.08321%0.213CC..Hα-helixtrans-58.1-43174.800000111.7N14 G22 V301N14-A18 WeakPolarHBondContact O-CB 3.31Å; N14-A18 PolarHBondContact O-N 2.79Å; A18-G22 PolarHBondContact O-N 2.88Å; A18-V301 HydrophobicContact CB-CB 3.86Å; A18-V301 HydrophobicContact CB-CG1 3.55Å; A18-V301 HydrophobicContact CB-CG2 4.31Å
19G67.8Low71.2Confident14 Ų1435 Ų3514%0.14421%0.207CC..Hα-helixtrans-62.2-45.6175.200000112.3G15 G16 V17 G22 V23G15-G19 PolarHBondContact O-N 2.84Å; G16-G19 PolarHBondContact O-N 2.88Å; V17-G19 VanDerWaalsContact C-N 3.29Å; V17-G19 PolarHBondContact O-N 3.19Å; G19-G22 PolarHBondContact O-N 2.7Å; G19-V23 WeakPolarHBondContact O-CB 3.39Å; G19-V23 WeakPolarHBondContact O-CG2 3.37Å; G19-V23 PolarHBondContact O-N 2.91Å
20L73.6Confident71.4Confident71 Ų7134.1 Ų34.137%0.37220%0.199SC..Hα-helixtrans-65.3-46-179.3-169.769.8000112.1G16 V17 T24 L72G16-L20 WeakPolarHBondContact O-CB 3.48Å; G16-L20 PolarHBondContact O-N 3.42Å; V17-L20 PolarHBondContact O-N 3.36Å; L20-T24 WeakPolarHBondContact O-CB 3.37Å; L20-T24 PolarHBondContact O-N 3.48Å; L20-T24 PolarHBondContact O-OG1 3.31Å; L20-L72 HydrophobicContact CD1-CD2 3.48Å; L20-L72 VanDerWaalsContact CD1-CD2 3.48Å; L20-L72 HydrophobicContact CD1-CG 3.88Å
21V75.9Confident71.7Confident60 Ų6034.6 Ų34.636%0.36420%0.199SC..Hα-helixtrans-64.7-47.1176.6176.20000109.9V17 V23 T24 C25 I297V17-V21 HydrophobicContact CG1-CG2 4.26Å; V17-V21 WeakPolarHBondContact O-CB 3.47Å; V17-V21 VanDerWaalsContact O-CG2 3.3Å; V17-V21 WeakPolarHBondContact O-CG2 3.14Å; V17-V21 PolarHBondContact O-N 2.93Å; V21-V23 PolarHBondContact O-N 2.85Å; V21-T24 PolarHBondContact O-N 3.35Å; V21-C25 PolarHBondContact O-N 2.93Å; V21-C25 PolarHBondContact O-SG 3.45Å; V21-C25 VanDerWaalsContact O-SG 3.34Å; V21-I297 HydrophobicContact CG1-CG2 3.93Å
22G70.3Confident72Confident2 Ų230.3 Ų30.32%0.02118%0.181CC..Hα-helixtrans-56.1-49.3176.700000112.4A18 G19 T24 C25 V26A18-G22 PolarHBondContact O-N 2.88Å; G19-G22 PolarHBondContact O-N 2.7Å; G22-T24 PolarHBondContact O-N 3.33Å; G22-C25 PolarHBondContact O-N 2.8Å; G22-V26 VanDerWaalsContact O-CB 3.28Å; G22-V26 WeakPolarHBondContact O-CB 3.5Å; G22-V26 WeakPolarHBondContact O-CG2 3.46Å; G22-V26 PolarHBondContact O-N 3.06Å
23V70.6Confident72.2Confident16 Ų1629 Ų2910%0.09717%0.173CC..Hα-helixtrans-62.2-43.3177.5170.80000111G19 V21 C25 V26 F27 L72 V75G19-V23 WeakPolarHBondContact O-CB 3.39Å; G19-V23 WeakPolarHBondContact O-CG2 3.37Å; G19-V23 PolarHBondContact O-N 2.91Å; V21-V23 PolarHBondContact O-N 2.85Å; V23-C25 PolarHBondContact O-N 3.41Å; V23-V26 PolarHBondContact O-N 3.43Å; V23-F27 WeakPolarHBondContact O-CA 3.38Å; V23-F27 WeakPolarHBondContact O-CB 3.29Å; V23-F27 PolarHBondContact O-N 3.36Å; V23-L72 HydrophobicContact CG1-CD1 3.74Å; V23-L72 HydrophobicContact CG1-CG 4.39Å; V23-V75 HydrophobicContact CG2-CB 4.3Å; V23-V75 HydrophobicContact CG2-CG1 3.52Å
24T75.9Confident72.1Confident55 Ų5528.8 Ų28.834%0.33718%0.175SC..Hα-helixtrans-63.8-40.2-178.6-56.70000112.1L20 V21 G22 P28 Y65L20-T24 WeakPolarHBondContact O-CB 3.37Å; L20-T24 PolarHBondContact O-N 3.48Å; L20-T24 PolarHBondContact O-OG1 3.31Å; V21-T24 PolarHBondContact O-N 3.35Å; G22-T24 PolarHBondContact O-N 3.33Å; T24-P28 WeakPolarHBondContact O-CD 3.36Å; T24-Y65 HydrophobicContact CG2-CE1 4.1Å; T24-Y65 WeakPolarHBondContact O-CE1 3.38Å; T24-Y65 PolarHBondContact O-OH 2.98Å
25C77.3Confident72.1Confident65 Ų6530.8 Ų30.844%0.43918%0.181SC..Hα-helixtrans-73-36177.3-66.20000112.9V21 G22 V23 I297V21-C25 PolarHBondContact O-N 2.93Å; V21-C25 PolarHBondContact O-SG 3.45Å; V21-C25 VanDerWaalsContact O-SG 3.34Å; G22-C25 PolarHBondContact O-N 2.8Å; V23-C25 PolarHBondContact O-N 3.41Å; C25-I297 HydrophobicContact CB-CD1 3.33Å
26V74.6Confident72.3Confident3 Ų332.9 Ų32.92%0.01819%0.191CC..Hα-helixtrans-85-21.4-176.4176.90000112.1G22 V23 I29 D30 V290 P293 L294 I297G22-V26 VanDerWaalsContact O-CB 3.28Å; G22-V26 WeakPolarHBondContact O-CB 3.5Å; G22-V26 WeakPolarHBondContact O-CG2 3.46Å; G22-V26 PolarHBondContact O-N 3.06Å; V23-V26 PolarHBondContact O-N 3.43Å; V26-I29 WeakPolarHBondContact O-CA 3.08Å; V26-I29 WeakPolarHBondContact O-CB 3.29Å; V26-I29 PolarHBondContact O-N 3.38Å; V26-D30 PolarHBondContact O-N 2.98Å; V26-V290 HydrophobicContact CG1-CB 4.46Å; V26-V290 HydrophobicContact CG1-CG1 3.66Å; V26-P293 HydrophobicContact CG2-CB 4.17Å; V26-L294 HydrophobicContact CG2-CB 4.22Å; V26-L294 HydrophobicContact CG2-CD1 4.16Å; V26-I297 HydrophobicContact CG2-CD1 4.37Å
27F75.6Confident71.8Confident8 Ų836.5 Ų36.54%0.03520%0.204CC..Hα-helixtrans-53-46.4-176.4-173.3-90.3000114.1V23 I29 D30 L31 M64 Y65 A68 N71V23-F27 WeakPolarHBondContact O-CA 3.38Å; V23-F27 WeakPolarHBondContact O-CB 3.29Å; V23-F27 PolarHBondContact O-N 3.36Å; F27-I29 VanDerWaalsContact C-N 3.27Å; F27-I29 PolarHBondContact O-N 3.46Å; F27-D30 PolarHBondContact O-N 3.13Å; F27-L31 HydrophobicContact CE1-CD1 4.43Å; F27-L31 WeakPolarHBondContact O-CB 3.05Å; F27-L31 PolarHBondContact O-N 2.98Å; F27-M64 VanDerWaalsContact CD1-O 3.29Å; F27-M64 WeakPolarHBondContact CD1-O 3.31Å; F27-M64 WeakPolarHBondContact CE1-O 3.41Å; F27-Y65 HydrophobicContact CB-CE1 4.34Å; F27-Y65 AromaticContact CD1-CD1 3.85Å; F27-Y65 HydrophobicContact CD1-CD1 3.85Å; F27-Y65 HydrophobicContact CD1-CE1 4.36Å; F27-Y65 HydrophobicContact CD1-CG 4.47Å; F27-Y65 HydrophobicContact CG-CD1 4.43Å; F27-A68 HydrophobicContact CD1-CB 3.91Å; F27-A68 HydrophobicContact CD2-CB 3.96Å; F27-A68 HydrophobicContact CE1-CB 3.7Å; F27-A68 HydrophobicContact CE2-CB 3.75Å; F27-A68 HydrophobicContact CG-CB 4.05Å; F27-A68 HydrophobicContact CZ-CB 3.62Å; F27-N71 HydrophobicContact CD2-CB 4.23Å; F27-N71 HydrophobicContact CE2-CB 3.93Å; F27-N71 WeakPolarHBondContact CE2-ND2 3.49Å
28P75.4Confident71.3Confident15 Ų1537.3 Ų37.310%0.09721%0.207CC..Hα-helixtrans-50.1-44.1170.7-34.941.3000114.6T24 L31 A32 L52 M64 Y65T24-P28 WeakPolarHBondContact O-CD 3.36Å; P28-L31 WeakPolarHBondContact O-CB 3.21Å; P28-L31 PolarHBondContact O-N 3.46Å; P28-A32 PolarHBondContact O-N 3.18Å; P28-L52 HydrophobicContact CB-CD2 4.25Å; P28-L52 WeakPolarHBondContact O-CD2 3.35Å; P28-M64 HydrophobicContact CB-CE 3.56Å; P28-M64 HydrophobicContact CG-CE 3.96Å; P28-Y65 HydrophobicContact CG-CE1 4.26Å; P28-Y65 HydrophobicContact CG-CE2 4.4Å
29I78.4Confident71Confident37 Ų3739.1 Ų39.119%0.1921%0.213CC..Hα-helixtrans-72.2-41.2-176.4-53.2177.6000109.6V26 F27 L31 A32 K33 M48 V290 P293V26-I29 WeakPolarHBondContact O-CA 3.08Å; V26-I29 WeakPolarHBondContact O-CB 3.29Å; V26-I29 PolarHBondContact O-N 3.38Å; F27-I29 VanDerWaalsContact C-N 3.27Å; F27-I29 PolarHBondContact O-N 3.46Å; I29-L31 VanDerWaalsContact C-N 3.34Å; I29-L31 PolarHBondContact O-N 3.28Å; I29-A32 PolarHBondContact O-N 3.35Å; I29-K33 WeakPolarHBondContact O-CB 3.48Å; I29-K33 PolarHBondContact O-N 3.13Å; I29-M48 HydrophobicContact CG2-SD 3.79Å; I29-V290 HydrophobicContact CB-CG2 4.35Å; I29-V290 HydrophobicContact CG2-CG2 3.61Å; I29-P293 HydrophobicContact CD1-CG 4.05Å
30D71.8Confident70Confident55 Ų5546.1 Ų46.129%0.29424%0.242SC..Hα-helixtrans-62-40.6173.7-82.9-23.1000112V26 F27 K33 T34 V290V26-D30 PolarHBondContact O-N 2.98Å; F27-D30 PolarHBondContact O-N 3.13Å; D30-K33 PolarHBondContact O-N 3.39Å; D30-T34 WeakPolarHBondContact O-CB 3.45Å; D30-T34 VanDerWaalsContact O-CG2 3.31Å; D30-T34 WeakPolarHBondContact O-CG2 3.49Å; D30-T34 PolarHBondContact O-N 3.08Å; D30-T34 PolarHBondContact O-OG1 3.45Å; D30-V290 WeakPolarHBondContact OD1-CG1 3.11Å; D30-V290 VanDerWaalsContact OD1-CG2 3.32Å; D30-V290 WeakPolarHBondContact OD1-CG2 3.29Å
31L72.7Confident69.2Low24 Ų2446.4 Ų46.413%0.12626%0.262CS..Hα-helixtrans-61.6-47.7174.1-171.292.2000110.9F27 P28 I29 K33 T34 R35 T55 M64F27-L31 HydrophobicContact CE1-CD1 4.43Å; F27-L31 WeakPolarHBondContact O-CB 3.05Å; F27-L31 PolarHBondContact O-N 2.98Å; P28-L31 WeakPolarHBondContact O-CB 3.21Å; P28-L31 PolarHBondContact O-N 3.46Å; I29-L31 VanDerWaalsContact C-N 3.34Å; I29-L31 PolarHBondContact O-N 3.28Å; L31-K33 VanDerWaalsContact C-N 3.34Å; L31-K33 PolarHBondContact O-N 3.25Å; L31-T34 WeakPolarHBondContact CA-OG1 3.46Å; L31-T34 PolarHBondContact O-N 2.71Å; L31-T34 PolarHBondContact O-OG1 2.92Å; L31-R35 WeakPolarHBondContact O-CB 3.4Å; L31-R35 WeakPolarHBondContact O-CG 3.27Å; L31-R35 PolarHBondContact O-N 2.84Å; L31-T55 HydrophobicContact CD2-CG2 3.97Å; L31-M64 HydrophobicContact CD2-CG 4.45Å
32A72.1Confident67.8Low1 Ų153.3 Ų53.31%0.00829%0.287CS..Hα-helixtrans-63-41.917900000112P28 I29 R35 L36 M48 L52P28-A32 PolarHBondContact O-N 3.18Å; I29-A32 PolarHBondContact O-N 3.35Å; A32-R35 PolarHBondContact O-N 3.32Å; A32-L36 VanDerWaalsContact O-CB 3.29Å; A32-L36 WeakPolarHBondContact O-CB 3.33Å; A32-L36 PolarHBondContact O-N 3.23Å; A32-M48 HydrophobicContact CB-CG 3.76Å; A32-L52 HydrophobicContact CB-CD1 4.31Å; A32-L52 HydrophobicContact CB-CD2 3.76Å; A32-L52 HydrophobicContact CB-CG 3.64Å
33K72.4Confident67.3Low32 Ų3257.3 Ų57.314%0.13932%0.32CS..Hα-helixtrans-59.8-49.5174.4171.9176.9-178.3-177.20111.6I29 D30 L31 R35 L36 Q37 C286 V290I29-K33 WeakPolarHBondContact O-CB 3.48Å; I29-K33 PolarHBondContact O-N 3.13Å; D30-K33 PolarHBondContact O-N 3.39Å; L31-K33 VanDerWaalsContact C-N 3.34Å; L31-K33 PolarHBondContact O-N 3.25Å; K33-R35 VanDerWaalsContact C-N 3.33Å; K33-R35 PolarHBondContact O-N 3.29Å; K33-L36 PolarHBondContact O-N 3.29Å; K33-Q37 VanDerWaalsContact CE-NE2 3.26Å; K33-Q37 HydrophobicContact CG-CG 4.28Å; K33-Q37 WeakPolarHBondContact O-CB 3.44Å; K33-Q37 VanDerWaalsContact O-CG 3.27Å; K33-Q37 WeakPolarHBondContact O-CG 3.37Å; K33-Q37 PolarHBondContact O-N 3.43Å; K33-C286 HydrophobicContact CB-CB 4.11Å; K33-C286 HydrophobicContact CD-CB 3.59Å; K33-C286 HydrophobicContact CG-CB 3.54Å; K33-V290 HydrophobicContact CD-CG2 4.07Å
34T67.5Low66.8Low62 Ų6262.2 Ų62.238%0.3834%0.343SS..Hα-helixtrans-65.2-37.3-178.651.30000112D30 L31 N38D30-T34 WeakPolarHBondContact O-CB 3.45Å; D30-T34 VanDerWaalsContact O-CG2 3.31Å; D30-T34 WeakPolarHBondContact O-CG2 3.49Å; D30-T34 PolarHBondContact O-N 3.08Å; D30-T34 PolarHBondContact O-OG1 3.45Å; L31-T34 WeakPolarHBondContact CA-OG1 3.46Å; L31-T34 PolarHBondContact O-N 2.71Å; L31-T34 PolarHBondContact O-OG1 2.92Å; T34-N38 WeakPolarHBondContact O-CB 3.38Å; T34-N38 PolarHBondContact O-N 3.49Å; T34-N38 VanDerWaalsContact O-N 3.07Å
35R68.3Low66.5Low58 Ų5860.9 Ų60.922%0.21933%0.332CS..Hα-helixtrans-64.6-45172.9-74.1-177.9-175.3-143.2-6.1112.1L31 A32 K33 N38 Q39 Y45 T55 E59L31-R35 WeakPolarHBondContact O-CB 3.4Å; L31-R35 WeakPolarHBondContact O-CG 3.27Å; L31-R35 PolarHBondContact O-N 2.84Å; A32-R35 PolarHBondContact O-N 3.32Å; K33-R35 VanDerWaalsContact C-N 3.33Å; K33-R35 PolarHBondContact O-N 3.29Å; R35-N38 PolarHBondContact O-N 2.89Å; R35-Q39 WeakPolarHBondContact O-CG 3.44Å; R35-Y45 HydrophobicContact CB-CE2 4.02Å; R35-T55 PolarHBondContact NH1-OG1 3.16Å; R35-E59 IonicContact CZ-OE1 3.61Å; R35-E59 IonicContact CZ-OE2 2.67Å; R35-E59 IonicContact NH1-OE1 2.78Å; R35-E59 PolarHBondContact NH1-OE1 3Å; R35-E59 IonicContact NH2-OE1 3.64Å; R35-E59 PolarHBondContact NH2-OE1 2.77Å; R35-E59 IonicContact NH2-OE2 3.63Å; R35-E59 PolarHBondContact NH2-OE2 2.77Å
36L69.3Low66.2Low47 Ų4767.3 Ų67.325%0.24635%0.353CS..Hα-helixtrans-66.9-38.7178.8-167.671.8000112.2A32 K33A32-L36 VanDerWaalsContact O-CB 3.29Å; A32-L36 WeakPolarHBondContact O-CB 3.33Å; A32-L36 PolarHBondContact O-N 3.23Å; K33-L36 PolarHBondContact O-N 3.29Å
37Q60Low66.1Low93 Ų9368.3 Ų68.344%0.43536%0.364SS..Hα-helixtrans-72.8-26.3177.8-74.5-177.9-24.400113.4K33K33-Q37 VanDerWaalsContact CE-NE2 3.26Å; K33-Q37 HydrophobicContact CG-CG 4.28Å; K33-Q37 WeakPolarHBondContact O-CB 3.44Å; K33-Q37 VanDerWaalsContact O-CG 3.27Å; K33-Q37 WeakPolarHBondContact O-CG 3.37Å; K33-Q37 PolarHBondContact O-N 3.43Å
38N61.4Low66.1Low56 Ų5669.3 Ų69.330%0.29937%0.369SS..THydrogen-bonded Turntrans-93.910.4-177.9-155.137.6000113.6T34 R35 H40T34-N38 WeakPolarHBondContact O-CB 3.38Å; T34-N38 PolarHBondContact O-N 3.49Å; T34-N38 VanDerWaalsContact O-N 3.07Å; R35-N38 PolarHBondContact O-N 2.89Å; N38-H40 PolarHBondContact O-N 2.96Å; N38-H40 PolarHBondContact O-ND1 3.46Å
39Q59.5Low66.2Low47 Ų4774.8 Ų74.822%0.2240%0.396CS..  trans-78.3111.4176.3-52.9-162.1-77.800109.4R35 M44 Y45R35-Q39 WeakPolarHBondContact O-CG 3.44Å; Q39-M44 VanDerWaalsContact NE2-CB 3.29Å; Q39-Y45 HydrophobicContact CG-CD2 4.16Å; Q39-Y45 VanDerWaalsContact NE2-CE2 3.3Å; Q39-Y45 VanDerWaalsContact NE2-N 3.11Å
40H46.5Very low66.4Low162 Ų16275.2 Ų75.275%0.7540%0.398SS*.  trans-104124.1170.8-60.5104.5000108.6N38N38-H40 PolarHBondContact O-N 2.96Å; N38-H40 PolarHBondContact O-ND1 3.46Å
41G58.6Low66.6Low76 Ų7672.6 Ų72.678%0.78438%0.384SS*.SBendtrans97.1-138.9179.600000114.3A43G41-A43 PolarHBondContact O-N 2.87Å
42K44.8Very low67Low205 Ų20573.4 Ų73.489%0.89139%0.389SS*.SBendtrans-57.7131.5-175.9-80.1-178.8176.8176.50111M44K42-M44 PolarHBondContact O-N 2.98Å
43A59.8Low67.4Low86 Ų8679.6 Ų79.671%0.71142%0.419SS*.  trans-62.190.917900000111.6G41G41-A43 PolarHBondContact O-N 2.87Å
44M61.6Low67.8Low120 Ų12082.3 Ų82.359%0.59143%0.431SS*.SBendtrans-77.7-23.2-178.7166.6-164169.900112Q39 K42 K54Q39-M44 VanDerWaalsContact NE2-CB 3.29Å; K42-M44 PolarHBondContact O-N 2.98Å; M44-K54 PolarHBondContact O-NZ 3.31Å; M44-K54 VanDerWaalsContact O-NZ 3.12Å
45Y68.6Low68.4Low27 Ų2779.5 Ų79.511%0.10641%0.414CS..  trans-118.4130.3169.9-55.1-58000109.9R35 Q39 G47 C51 K54R35-Y45 HydrophobicContact CB-CE2 4.02Å; Q39-Y45 HydrophobicContact CG-CD2 4.16Å; Q39-Y45 VanDerWaalsContact NE2-CE2 3.3Å; Q39-Y45 VanDerWaalsContact NE2-N 3.11Å; Y45-G47 VanDerWaalsContact C-N 3.29Å; Y45-C51 HydrophobicContact CD1-CB 3.82Å; Y45-C51 HydrophobicContact CD2-CB 3.97Å; Y45-C51 WeakPolarHBondContact CD2-SG 3.45Å; Y45-C51 HydrophobicContact CE1-CB 4.34Å; Y45-C51 VanDerWaalsContact CE2-SG 3.58Å; Y45-C51 HydrophobicContact CG-CB 3.65Å; Y45-K54 HydrophobicContact CD1-CD 3.88Å; Y45-K54 HydrophobicContact CE1-CB 4.21Å; Y45-K54 HydrophobicContact CE1-CD 4.03Å
46K70.7Confident69Low200 Ų20078.7 Ų78.787%0.8742%0.419SS*.SBendtrans-79.1-15.4176.1-71.6-177176.7-179.40112.8D50K46-D50 HydrophobicContact CB-CB 4.49Å; K46-D50 PolarHBondContact N-OD2 3.45Å
47G73.7Confident69.6Low24 Ų2487.3 Ų87.325%0.24745%0.448CS..SBendtrans177.4-178.6-179.900000112.3Y45 D50 C51Y45-G47 VanDerWaalsContact C-N 3.29Å; G47-D50 PolarHBondContact O-N 2.91Å; G47-C51 WeakPolarHBondContact O-CB 3.31Å; G47-C51 PolarHBondContact O-N 3.33Å
48M74.1Confident70.4Confident28 Ų2887 Ų8714%0.13846%0.461CS..Hα-helixtrans-66.1-41.5-176.1-164.5175.2-53.900112.7I29 A32 C51 L52 C286 L289I29-M48 HydrophobicContact CG2-SD 3.79Å; A32-M48 HydrophobicContact CB-CG 3.76Å; M48-C51 WeakPolarHBondContact O-CB 3.18Å; M48-C51 PolarHBondContact O-N 2.87Å; M48-L52 HydrophobicContact CG-CD1 4.43Å; M48-L52 WeakPolarHBondContact O-CB 3.41Å; M48-L52 WeakPolarHBondContact O-CG 3.01Å; M48-L52 PolarHBondContact O-N 3.13Å; M48-C286 HydrophobicContact CE-CB 4.02Å; M48-L289 HydrophobicContact CE-CB 4.16Å; M48-L289 HydrophobicContact CE-CD1 3.33Å; M48-L289 HydrophobicContact CE-CG 4.38Å; M48-L289 HydrophobicContact SD-CB 4.4Å; M48-L289 HydrophobicContact SD-CD1 3.96Å
49I79.1Confident71Confident131 Ų13188.1 Ų88.167%0.67247%0.465SS*.Hα-helixtrans-67.3-41.8178.3-59.4172.9000110.5C51 L52 M53I49-C51 VanDerWaalsContact C-N 3.33Å; I49-C51 PolarHBondContact O-N 3.42Å; I49-L52 PolarHBondContact O-N 2.82Å; I49-M53 VanDerWaalsContact O-CB 3.27Å; I49-M53 WeakPolarHBondContact O-CB 3.43Å; I49-M53 PolarHBondContact O-N 2.97Å
50D81.4Confident71.9Confident45 Ų4587.4 Ų87.424%0.24147%0.47CS..Hα-helixtrans-62.5-41174.8-179.244.3000111.3K46 G47 K54K46-D50 HydrophobicContact CB-CB 4.49Å; K46-D50 PolarHBondContact N-OD2 3.45Å; G47-D50 PolarHBondContact O-N 2.91Å; D50-K54 VanDerWaalsContact O-CB 3.27Å; D50-K54 WeakPolarHBondContact O-CB 3.25Å; D50-K54 VanDerWaalsContact O-CG 3.31Å; D50-K54 WeakPolarHBondContact O-CG 3.39Å; D50-K54 PolarHBondContact O-N 3.29Å; D50-K54 WeakPolarHBondContact OD1-CD 3.5Å; D50-K54 WeakPolarHBondContact OD1-CE 3.39Å; D50-K54 IonicContact OD1-NZ 2.8Å; D50-K54 PolarHBondContact OD1-NZ 3.46Å; D50-K54 VanDerWaalsContact OD1-NZ 3.17Å; D50-K54 IonicContact OD2-NZ 3.17Å; D50-K54 PolarHBondContact OD2-NZ 3.14Å
51C77Confident73.3Confident0 Ų086.3 Ų86.30%046%0.463CS..Hα-helixtrans-63.3-47.2174.6-172.40000112.4Y45 G47 M48 I49 T55Y45-C51 HydrophobicContact CD1-CB 3.82Å; Y45-C51 HydrophobicContact CD2-CB 3.97Å; Y45-C51 WeakPolarHBondContact CD2-SG 3.45Å; Y45-C51 HydrophobicContact CE1-CB 4.34Å; Y45-C51 VanDerWaalsContact CE2-SG 3.58Å; Y45-C51 HydrophobicContact CG-CB 3.65Å; G47-C51 WeakPolarHBondContact O-CB 3.31Å; G47-C51 PolarHBondContact O-N 3.33Å; M48-C51 WeakPolarHBondContact O-CB 3.18Å; M48-C51 PolarHBondContact O-N 2.87Å; I49-C51 VanDerWaalsContact C-N 3.33Å; I49-C51 PolarHBondContact O-N 3.42Å; C51-T55 WeakPolarHBondContact O-CB 3.48Å; C51-T55 PolarHBondContact O-N 3.07Å; C51-T55 PolarHBondContact O-OG1 3.28Å
52L79.7Confident73.9Confident41 Ų4191.1 Ų91.122%0.21546%0.463CS..Hα-helixtrans-61.1-48.1177.2-78.5168.3000111.3P28 A32 M48 I49 T55 A56 M64P28-L52 HydrophobicContact CB-CD2 4.25Å; P28-L52 WeakPolarHBondContact O-CD2 3.35Å; A32-L52 HydrophobicContact CB-CD1 4.31Å; A32-L52 HydrophobicContact CB-CD2 3.76Å; A32-L52 HydrophobicContact CB-CG 3.64Å; M48-L52 HydrophobicContact CG-CD1 4.43Å; M48-L52 WeakPolarHBondContact O-CB 3.41Å; M48-L52 WeakPolarHBondContact O-CG 3.01Å; M48-L52 PolarHBondContact O-N 3.13Å; I49-L52 PolarHBondContact O-N 2.82Å; L52-T55 PolarHBondContact O-N 3.48Å; L52-A56 VanDerWaalsContact O-CB 3.31Å; L52-A56 WeakPolarHBondContact O-CB 3.42Å; L52-A56 PolarHBondContact O-N 3.05Å; L52-M64 HydrophobicContact CD2-CE 3.86Å
53M81.4Confident75Confident131 Ų13181.8 Ų81.865%0.64543%0.425SS*.Hα-helixtrans-67-42.8-177-167.5177.8-80.400111.7I49 A56 R57I49-M53 VanDerWaalsContact O-CB 3.27Å; I49-M53 WeakPolarHBondContact O-CB 3.43Å; I49-M53 PolarHBondContact O-N 2.97Å; M53-A56 PolarHBondContact O-N 3.05Å; M53-R57 WeakPolarHBondContact O-CB 3.38Å; M53-R57 PolarHBondContact O-N 2.88Å
54K81.9Confident75.5Confident90 Ų9078.7 Ų78.739%0.39140%0.396SS..Hα-helixtrans-64.1-40.8173.7-77170.1173.7163.10112.1M44 Y45 D50 R57 A58M44-K54 PolarHBondContact O-NZ 3.31Å; M44-K54 VanDerWaalsContact O-NZ 3.12Å; Y45-K54 HydrophobicContact CD1-CD 3.88Å; Y45-K54 HydrophobicContact CE1-CB 4.21Å; Y45-K54 HydrophobicContact CE1-CD 4.03Å; D50-K54 VanDerWaalsContact O-CB 3.27Å; D50-K54 WeakPolarHBondContact O-CB 3.25Å; D50-K54 VanDerWaalsContact O-CG 3.31Å; D50-K54 WeakPolarHBondContact O-CG 3.39Å; D50-K54 PolarHBondContact O-N 3.29Å; D50-K54 WeakPolarHBondContact OD1-CD 3.5Å; D50-K54 WeakPolarHBondContact OD1-CE 3.39Å; D50-K54 IonicContact OD1-NZ 2.8Å; D50-K54 PolarHBondContact OD1-NZ 3.46Å; D50-K54 VanDerWaalsContact OD1-NZ 3.17Å; D50-K54 IonicContact OD2-NZ 3.17Å; D50-K54 PolarHBondContact OD2-NZ 3.14Å; K54-R57 PolarHBondContact O-N 3.42Å; K54-A58 VanDerWaalsContact O-CB 3.24Å; K54-A58 WeakPolarHBondContact O-CB 3.37Å; K54-A58 PolarHBondContact O-N 2.91Å
55T78.4Confident76Confident3 Ų376.1 Ų76.12%0.01838%0.38CS..Hα-helixtrans-65.8-45.1177.6-60.40000111.2L31 R35 C51 L52 R57 A58 E59 M64L31-T55 HydrophobicContact CD2-CG2 3.97Å; R35-T55 PolarHBondContact NH1-OG1 3.16Å; C51-T55 WeakPolarHBondContact O-CB 3.48Å; C51-T55 PolarHBondContact O-N 3.07Å; C51-T55 PolarHBondContact O-OG1 3.28Å; L52-T55 PolarHBondContact O-N 3.48Å; T55-R57 VanDerWaalsContact C-N 3.27Å; T55-R57 PolarHBondContact O-N 2.91Å; T55-A58 PolarHBondContact O-N 3.43Å; T55-E59 PolarHBondContact O-N 3.07Å; T55-M64 HydrophobicContact CG2-CG 3.91Å
56A81.1Confident75.7Confident40 Ų4084.6 Ų84.633%0.33141%0.412SS..Hα-helixtrans-60.6-38.1175.800000111.8L52 M53 G60 M64L52-A56 VanDerWaalsContact O-CB 3.31Å; L52-A56 WeakPolarHBondContact O-CB 3.42Å; L52-A56 PolarHBondContact O-N 3.05Å; M53-A56 PolarHBondContact O-N 3.05Å; A56-G60 WeakPolarHBondContact O-CA 3.33Å; A56-G60 PolarHBondContact O-N 3.38Å; A56-M64 HydrophobicContact CB-SD 3.79Å
57R81.8Confident75.4Confident229 Ų22977.2 Ų77.286%0.86439%0.392SS*.Hα-helixtrans-73.2-34.2177.7-161.1178.2-140.5163.55.8113.2M53 K54 T55M53-R57 WeakPolarHBondContact O-CB 3.38Å; M53-R57 PolarHBondContact O-N 2.88Å; K54-R57 PolarHBondContact O-N 3.42Å; T55-R57 VanDerWaalsContact C-N 3.27Å; T55-R57 PolarHBondContact O-N 2.91Å
58A77.8Confident75Confident85 Ų8576.6 Ų76.670%0.70239%0.385SS*.Hα-helixtrans-86-39.9-176.600000113.5K54 T55K54-A58 VanDerWaalsContact O-CB 3.24Å; K54-A58 WeakPolarHBondContact O-CB 3.37Å; K54-A58 PolarHBondContact O-N 2.91Å; T55-A58 PolarHBondContact O-N 3.43Å
59E74.2Confident74.6Confident81 Ų8178.6 Ų78.638%0.37941%0.406SS..Hα-helixtrans-113.8-6.4-172.9-62.9173-142.600113.1R35 T55 G63R35-E59 IonicContact CZ-OE1 3.61Å; R35-E59 IonicContact CZ-OE2 2.67Å; R35-E59 IonicContact NH1-OE1 2.78Å; R35-E59 PolarHBondContact NH1-OE1 3Å; R35-E59 IonicContact NH2-OE1 3.64Å; R35-E59 PolarHBondContact NH2-OE1 2.77Å; R35-E59 IonicContact NH2-OE2 3.63Å; R35-E59 PolarHBondContact NH2-OE2 2.77Å; T55-E59 PolarHBondContact O-N 3.07Å; E59-G63 VanDerWaalsContact O-CA 3.32Å; E59-G63 WeakPolarHBondContact O-CA 3.39Å; E59-G63 PolarHBondContact O-N 3.34Å
60G78.4Confident73.9Confident31 Ų3175.1 Ų75.132%0.3239%0.39SS..Hα-helixtrans77.4173.2-175.600000113.5A56 F62 G63 M64A56-G60 WeakPolarHBondContact O-CA 3.33Å; A56-G60 PolarHBondContact O-N 3.38Å; G60-F62 PolarHBondContact O-N 2.95Å; G60-G63 WeakPolarHBondContact O-CA 3.34Å; G60-G63 PolarHBondContact O-N 2.9Å; G60-M64 PolarHBondContact O-N 2.97Å
61F74.8Confident73.1Confident140 Ų14074.2 Ų74.261%0.61439%0.386SS*.Hα-helixtrans-60.1-42.5179.6-177.8-100.9000112.7G63 M64 Y65F61-G63 VanDerWaalsContact C-N 3.29Å; F61-G63 PolarHBondContact O-N 3.29Å; F61-M64 PolarHBondContact O-N 3.33Å; F61-Y65 HydrophobicContact CE1-CE2 4.25Å; F61-Y65 HydrophobicContact CZ-CE2 4.13Å
62F72.3Confident72.7Confident176 Ų17676.5 Ų76.577%0.77240%0.398SS*.Hα-helixtrans-71.9-22.9175-76.1-79.3000113.2G60 M64 Y65 R66G60-F62 PolarHBondContact O-N 2.95Å; F62-M64 VanDerWaalsContact C-N 3.3Å; F62-M64 PolarHBondContact O-N 3.44Å; F62-Y65 PolarHBondContact O-N 3.42Å; F62-Y65 VanDerWaalsContact O-N 3.13Å; F62-R66 PolarHBondContact O-N 3.26Å
63G66.2Low72.1Confident9 Ų979.5 Ų79.59%0.09342%0.418CS..Hα-helixtrans-62.5-35.9172.600000112.8E59 G60 F61 Y65 R66E59-G63 VanDerWaalsContact O-CA 3.32Å; E59-G63 WeakPolarHBondContact O-CA 3.39Å; E59-G63 PolarHBondContact O-N 3.34Å; G60-G63 WeakPolarHBondContact O-CA 3.34Å; G60-G63 PolarHBondContact O-N 2.9Å; F61-G63 VanDerWaalsContact C-N 3.29Å; F61-G63 PolarHBondContact O-N 3.29Å; G63-Y65 PolarHBondContact O-N 3.34Å; G63-Y65 VanDerWaalsContact O-N 3.13Å; G63-R66 WeakPolarHBondContact O-CB 3.2Å; G63-R66 PolarHBondContact O-N 2.81Å
64M71.3Confident71.3Confident21 Ų2175 Ų7510%0.10340%0.396CS..THydrogen-bonded Turntrans-63.4-17.3174.3-79.5167.75200114F27 P28 L31 L52 T55 A56 G60 F61 F62F27-M64 VanDerWaalsContact CD1-O 3.29Å; F27-M64 WeakPolarHBondContact CD1-O 3.31Å; F27-M64 WeakPolarHBondContact CE1-O 3.41Å; P28-M64 HydrophobicContact CB-CE 3.56Å; P28-M64 HydrophobicContact CG-CE 3.96Å; L31-M64 HydrophobicContact CD2-CG 4.45Å; L52-M64 HydrophobicContact CD2-CE 3.86Å; T55-M64 HydrophobicContact CG2-CG 3.91Å; A56-M64 HydrophobicContact CB-SD 3.79Å; G60-M64 PolarHBondContact O-N 2.97Å; F61-M64 PolarHBondContact O-N 3.33Å; F62-M64 VanDerWaalsContact C-N 3.3Å; F62-M64 PolarHBondContact O-N 3.44Å
65Y71.6Confident70.4Confident67 Ų6771.1 Ų71.126%0.26338%0.38SS..THydrogen-bonded Turntrans-102.35.4175.2-69.5-84000112.9T24 F27 P28 F61 F62 G63 G67 A68T24-Y65 HydrophobicContact CG2-CE1 4.1Å; T24-Y65 WeakPolarHBondContact O-CE1 3.38Å; T24-Y65 PolarHBondContact O-OH 2.98Å; F27-Y65 HydrophobicContact CB-CE1 4.34Å; F27-Y65 AromaticContact CD1-CD1 3.85Å; F27-Y65 HydrophobicContact CD1-CD1 3.85Å; F27-Y65 HydrophobicContact CD1-CE1 4.36Å; F27-Y65 HydrophobicContact CD1-CG 4.47Å; F27-Y65 HydrophobicContact CG-CD1 4.43Å; P28-Y65 HydrophobicContact CG-CE1 4.26Å; P28-Y65 HydrophobicContact CG-CE2 4.4Å; F61-Y65 HydrophobicContact CE1-CE2 4.25Å; F61-Y65 HydrophobicContact CZ-CE2 4.13Å; F62-Y65 PolarHBondContact O-N 3.42Å; F62-Y65 VanDerWaalsContact O-N 3.13Å; G63-Y65 PolarHBondContact O-N 3.34Å; G63-Y65 VanDerWaalsContact O-N 3.13Å; Y65-G67 PolarHBondContact O-N 3.39Å; Y65-G67 VanDerWaalsContact O-N 3.14Å; Y65-A68 HydrophobicContact CD1-CB 4.21Å; Y65-A68 WeakPolarHBondContact O-CB 3.28Å; Y65-A68 PolarHBondContact O-N 3.4Å
66R63Low69.8Low205 Ų20573 Ų7377%0.77439%0.392SS*.THydrogen-bonded Turntrans-68.2114.6178.9-164.1173.4-179.2146.7-0.8109.5F62 G63F62-R66 PolarHBondContact O-N 3.26Å; G63-R66 WeakPolarHBondContact O-CB 3.2Å; G63-R66 PolarHBondContact O-N 2.81Å
67G63.5Low69.2Low44 Ų4473.7 Ų73.745%0.45439%0.392SS..THydrogen-bonded Turntrans97.4-4.2-171.300000114.4Y65 A69 V70Y65-G67 PolarHBondContact O-N 3.39Å; Y65-G67 VanDerWaalsContact O-N 3.14Å; G67-A69 PolarHBondContact O-N 2.74Å; G67-V70 PolarHBondContact O-N 2.72Å
68A67Low68.4Low11 Ų1163.1 Ų63.19%0.09135%0.353CS..Hα-helixtrans-60.5-33.3174.700000112.3F27 Y65 V70 N71 L72F27-A68 HydrophobicContact CD1-CB 3.91Å; F27-A68 HydrophobicContact CD2-CB 3.96Å; F27-A68 HydrophobicContact CE1-CB 3.7Å; F27-A68 HydrophobicContact CE2-CB 3.75Å; F27-A68 HydrophobicContact CG-CB 4.05Å; F27-A68 HydrophobicContact CZ-CB 3.62Å; Y65-A68 HydrophobicContact CD1-CB 4.21Å; Y65-A68 WeakPolarHBondContact O-CB 3.28Å; Y65-A68 PolarHBondContact O-N 3.4Å; A68-V70 VanDerWaalsContact C-N 3.31Å; A68-V70 PolarHBondContact O-N 3.32Å; A68-N71 CarbonylContact O-C 3.55Å; A68-N71 PolarHBondContact O-N 3.14Å; A68-N71 VanDerWaalsContact O-N 3.14Å; A68-L72 HydrophobicContact CB-CD1 4.22Å; A68-L72 WeakPolarHBondContact O-CB 3.47Å; A68-L72 WeakPolarHBondContact O-CD1 3.32Å; A68-L72 PolarHBondContact O-N 2.82Å
69A65.2Low67.8Low70 Ų7062 Ų6258%0.57933%0.332SS*.Hα-helixtrans-55.6-44.2177.700000112.5G67 L72 T73G67-A69 PolarHBondContact O-N 2.74Å; A69-L72 PolarHBondContact O-N 3.49Å; A69-T73 WeakPolarHBondContact O-CB 2.97Å; A69-T73 PolarHBondContact O-N 2.86Å; A69-T73 PolarHBondContact O-OG1 3.47Å
70V63.8Low67.4Low58 Ų5859.4 Ų59.435%0.35233%0.325SS..Hα-helixtrans-65.7-42.9178.61720000111.1G67 A68 L74 L130G67-V70 PolarHBondContact O-N 2.72Å; A68-V70 VanDerWaalsContact C-N 3.31Å; A68-V70 PolarHBondContact O-N 3.32Å; V70-L74 HydrophobicContact CG1-CD1 4.01Å; V70-L74 WeakPolarHBondContact O-CB 3.25Å; V70-L74 WeakPolarHBondContact O-CG 3.47Å; V70-L74 PolarHBondContact O-N 2.92Å; V70-L74 VanDerWaalsContact O-N 3.17Å; V70-L130 HydrophobicContact CB-CD2 4.5Å; V70-L130 HydrophobicContact CG1-CD1 4.44Å; V70-L130 HydrophobicContact CG1-CD2 3.36Å; V70-L130 HydrophobicContact CG1-CG 4.44Å; V70-L130 HydrophobicContact CG2-CD2 4.35Å
71N65.6Low67Low27 Ų2760.1 Ų60.114%0.14432%0.321CS..Hα-helixtrans-67.1-44.1175.9-90.8-16.6000111.3F27 A68 L74 V75 Q131F27-N71 HydrophobicContact CD2-CB 4.23Å; F27-N71 HydrophobicContact CE2-CB 3.93Å; F27-N71 WeakPolarHBondContact CE2-ND2 3.49Å; A68-N71 CarbonylContact O-C 3.55Å; A68-N71 PolarHBondContact O-N 3.14Å; A68-N71 VanDerWaalsContact O-N 3.14Å; N71-L74 PolarHBondContact O-N 3.31Å; N71-V75 WeakPolarHBondContact O-CA 3.49Å; N71-V75 WeakPolarHBondContact O-CB 3.25Å; N71-V75 WeakPolarHBondContact O-CG2 3.3Å; N71-V75 PolarHBondContact O-N 2.91Å; N71-Q131 PolarHBondContact OD1-NE2 3.4Å
72L67.3Low66.7Low47 Ų4754.8 Ų54.825%0.24630%0.297CS..Hα-helixtrans-61.6-49.1176.9-99.279.4000111.6L20 V23 A68 A69 L74 T76L20-L72 HydrophobicContact CD1-CD2 3.48Å; L20-L72 VanDerWaalsContact CD1-CD2 3.48Å; L20-L72 HydrophobicContact CD1-CG 3.88Å; V23-L72 HydrophobicContact CG1-CD1 3.74Å; V23-L72 HydrophobicContact CG1-CG 4.39Å; A68-L72 HydrophobicContact CB-CD1 4.22Å; A68-L72 WeakPolarHBondContact O-CB 3.47Å; A68-L72 WeakPolarHBondContact O-CD1 3.32Å; A68-L72 PolarHBondContact O-N 2.82Å; A69-L72 PolarHBondContact O-N 3.49Å; L72-L74 VanDerWaalsContact C-N 3.26Å; L72-L74 PolarHBondContact O-N 3.39Å; L72-T76 VanDerWaalsContact O-CB 3.22Å; L72-T76 WeakPolarHBondContact O-CB 3.4Å; L72-T76 PolarHBondContact O-N 2.87Å; L72-T76 PolarHBondContact O-OG1 3.17Å
73T66.9Low66.3Low104 Ų10447.4 Ų47.464%0.63827%0.266SS*.Hα-helixtrans-63.1-32-177.8-58.10000112.5A69 P77A69-T73 WeakPolarHBondContact O-CB 2.97Å; A69-T73 PolarHBondContact O-N 2.86Å; A69-T73 PolarHBondContact O-OG1 3.47Å; T73-P77 WeakPolarHBondContact O-CD 3.28Å; T73-P77 VanDerWaalsContact O-CG 3.3Å; T73-P77 WeakPolarHBondContact O-CG 3.38Å
74L64.6Low66.3Low38 Ų3848.8 Ų48.820%0.19928%0.277CS..Hα-helixtrans-93.5-32.9-179.9-66.1174.4000113.5V70 N71 L72 K127 L130V70-L74 HydrophobicContact CG1-CD1 4.01Å; V70-L74 WeakPolarHBondContact O-CB 3.25Å; V70-L74 WeakPolarHBondContact O-CG 3.47Å; V70-L74 PolarHBondContact O-N 2.92Å; V70-L74 VanDerWaalsContact O-N 3.17Å; N71-L74 PolarHBondContact O-N 3.31Å; L72-L74 VanDerWaalsContact C-N 3.26Å; L72-L74 PolarHBondContact O-N 3.39Å; L74-K127 HydrophobicContact CD1-CB 4.34Å; L74-K127 HydrophobicContact CD1-CG 4.43Å; L74-L130 HydrophobicContact CD1-CD1 4.18Å
75V64.8Low66.1Low7 Ų748.5 Ų48.54%0.04228%0.277CS..Hα-helixtrans-83.2-33.4-176.6179.70000111.6V23 N71 E78 K79 K127V23-V75 HydrophobicContact CG2-CB 4.3Å; V23-V75 HydrophobicContact CG2-CG1 3.52Å; N71-V75 WeakPolarHBondContact O-CA 3.49Å; N71-V75 WeakPolarHBondContact O-CB 3.25Å; N71-V75 WeakPolarHBondContact O-CG2 3.3Å; N71-V75 PolarHBondContact O-N 2.91Å; V75-E78 WeakPolarHBondContact O-CB 3.16Å; V75-E78 PolarHBondContact O-N 2.85Å; V75-K79 HydrophobicContact CG1-CD 4.4Å; V75-K79 HydrophobicContact CG1-CG 3.77Å; V75-K79 WeakPolarHBondContact O-CG 3.47Å; V75-K79 PolarHBondContact O-N 3.15Å; V75-K127 HydrophobicContact CG2-CD 4.2Å
76T65.3Low65.8Low43 Ų4347.6 Ų47.626%0.26428%0.277SS..Hα-helixtrans-61.3-47.5179.3-59.70000112.1L72 E78 K79 A80L72-T76 VanDerWaalsContact O-CB 3.22Å; L72-T76 WeakPolarHBondContact O-CB 3.4Å; L72-T76 PolarHBondContact O-N 2.87Å; L72-T76 PolarHBondContact O-OG1 3.17Å; T76-E78 VanDerWaalsContact C-N 3.35Å; T76-E78 PolarHBondContact O-N 2.91Å; T76-K79 PolarHBondContact O-N 3.11Å; T76-A80 WeakPolarHBondContact O-CB 3.45Å; T76-A80 PolarHBondContact O-N 3.33Å
77P67Low65.9Low54 Ų5439.4 Ų39.435%0.35125%0.249SC..Hα-helixtrans-61.8-41.2172.3-22.133.9000112.5T73 K79 A80 I81T73-P77 WeakPolarHBondContact O-CD 3.28Å; T73-P77 VanDerWaalsContact O-CG 3.3Å; T73-P77 WeakPolarHBondContact O-CG 3.38Å; P77-K79 PolarHBondContact O-N 3.02Å; P77-A80 PolarHBondContact O-N 3.25Å; P77-I81 WeakPolarHBondContact O-CB 3.28Å; P77-I81 WeakPolarHBondContact O-CD1 3.35Å; P77-I81 VanDerWaalsContact O-CG1 3.22Å; P77-I81 WeakPolarHBondContact O-CG1 3.32Å; P77-I81 PolarHBondContact O-N 3.33Å
78E65.8Low66Low7 Ų743.3 Ų43.33%0.03325%0.253CS..Hα-helixtrans-56.5-48.5176.7-173.7-150127.500111V75 T76 K82 K127V75-E78 WeakPolarHBondContact O-CB 3.16Å; V75-E78 PolarHBondContact O-N 2.85Å; T76-E78 VanDerWaalsContact C-N 3.35Å; T76-E78 PolarHBondContact O-N 2.91Å; E78-K82 HydrophobicContact CG-CD 4.29Å; E78-K82 WeakPolarHBondContact O-CB 3.18Å; E78-K82 WeakPolarHBondContact O-CG 3.33Å; E78-K82 PolarHBondContact O-N 3.4Å; E78-K82 WeakPolarHBondContact OE1-CE 3.2Å; E78-K82 IonicContact OE1-NZ 3.62Å; E78-K82 PolarHBondContact OE1-NZ 3.1Å; E78-K127 IonicContact OE2-NZ 2.8Å
79K65.9Low65.8Low61 Ų6145 Ų4527%0.26526%0.259SS..Hα-helixtrans-71.3-38-179.3-63.7-53.7179.8-142.90112.7V75 T76 P77 K82 L83V75-K79 HydrophobicContact CG1-CD 4.4Å; V75-K79 HydrophobicContact CG1-CG 3.77Å; V75-K79 WeakPolarHBondContact O-CG 3.47Å; V75-K79 PolarHBondContact O-N 3.15Å; T76-K79 PolarHBondContact O-N 3.11Å; P77-K79 PolarHBondContact O-N 3.02Å; K79-K82 HydrophobicContact CD-CD 4.39Å; K79-K82 PolarHBondContact O-N 3.35Å; K79-L83 WeakPolarHBondContact O-CB 3.45Å; K79-L83 PolarHBondContact O-N 2.91Å
80A65.6Low65.5Low27 Ų2747.3 Ų47.322%0.22325%0.252CS..Hα-helixtrans-61.4-45.6175.200000111.3T76 P77 L83 A84T76-A80 WeakPolarHBondContact O-CB 3.45Å; T76-A80 PolarHBondContact O-N 3.33Å; P77-A80 PolarHBondContact O-N 3.25Å; A80-L83 PolarHBondContact O-N 2.96Å; A80-A84 WeakPolarHBondContact O-CB 3.18Å; A80-A84 PolarHBondContact O-N 3.39Å
81I69.4Low65.5Low46 Ų4648.4 Ų48.424%0.23625%0.254CS..Hα-helixtrans-64.4-42176.4-69.5166.6000111P77 L83 A84 A85 V119 T120 M123P77-I81 WeakPolarHBondContact O-CB 3.28Å; P77-I81 WeakPolarHBondContact O-CD1 3.35Å; P77-I81 VanDerWaalsContact O-CG1 3.22Å; P77-I81 WeakPolarHBondContact O-CG1 3.32Å; P77-I81 PolarHBondContact O-N 3.33Å; I81-L83 VanDerWaalsContact C-N 3.29Å; I81-L83 PolarHBondContact O-N 3.07Å; I81-A84 PolarHBondContact O-N 3.33Å; I81-A85 VanDerWaalsContact O-CB 3.3Å; I81-A85 WeakPolarHBondContact O-CB 3.49Å; I81-A85 PolarHBondContact O-N 3.3Å; I81-V119 HydrophobicContact CG2-CB 4.3Å; I81-V119 HydrophobicContact CG2-CG1 3.55Å; I81-T120 HydrophobicContact CB-CG2 4.48Å; I81-T120 HydrophobicContact CG2-CG2 3.88Å; I81-M123 HydrophobicContact CD1-CE 3.44Å; I81-M123 VanDerWaalsContact CD1-CE 3.44Å; I81-M123 HydrophobicContact CD1-SD 3.73Å
82K67.9Low65.3Low28 Ų2851 Ų5112%0.12227%0.267CS..Hα-helixtrans-58.1-43.7176.5-76179.2175.9-1780111.6E78 K79 N86 Q116 T120 E124E78-K82 HydrophobicContact CG-CD 4.29Å; E78-K82 WeakPolarHBondContact O-CB 3.18Å; E78-K82 WeakPolarHBondContact O-CG 3.33Å; E78-K82 PolarHBondContact O-N 3.4Å; E78-K82 WeakPolarHBondContact OE1-CE 3.2Å; E78-K82 IonicContact OE1-NZ 3.62Å; E78-K82 PolarHBondContact OE1-NZ 3.1Å; K79-K82 HydrophobicContact CD-CD 4.39Å; K79-K82 PolarHBondContact O-N 3.35Å; K82-N86 WeakPolarHBondContact O-CB 3.45Å; K82-N86 PolarHBondContact O-N 3.43Å; K82-Q116 HydrophobicContact CB-CG 4.3Å; K82-Q116 HydrophobicContact CD-CG 4.43Å; K82-Q116 HydrophobicContact CG-CG 3.63Å; K82-T120 HydrophobicContact CG-CG2 4.04Å; K82-E124 IonicContact NZ-OE1 3.87Å; K82-E124 PolarHBondContact NZ-OE1 3.48Å
83L65.1Low64.8Low22 Ų2251.4 Ų51.412%0.11527%0.269CS..Hα-helixtrans-70.2-42.9179.8-163.5129.2000112K11 K79 A80 I81 A85 N86 D87 Y302K11-L83 WeakPolarHBondContact O-CD2 3.27Å; K79-L83 WeakPolarHBondContact O-CB 3.45Å; K79-L83 PolarHBondContact O-N 2.91Å; A80-L83 PolarHBondContact O-N 2.96Å; I81-L83 VanDerWaalsContact C-N 3.29Å; I81-L83 PolarHBondContact O-N 3.07Å; L83-A85 PolarHBondContact O-N 3.02Å; L83-N86 PolarHBondContact O-N 3.02Å; L83-D87 WeakPolarHBondContact O-CB 3.19Å; L83-D87 PolarHBondContact O-N 3.22Å; L83-Y302 WeakPolarHBondContact CD1-OH 3.48Å
84A65.9Low64.1Low38 Ų3853.2 Ų53.231%0.31427%0.272SS..Hα-helixtrans-59.2-45.7174.300000112.3L12 A80 I81 D87 F88L12-A84 HydrophobicContact CD2-CB 3.73Å; A80-A84 WeakPolarHBondContact O-CB 3.18Å; A80-A84 PolarHBondContact O-N 3.39Å; I81-A84 PolarHBondContact O-N 3.33Å; A84-D87 PolarHBondContact O-N 3.32Å; A84-F88 WeakPolarHBondContact O-CB 3.41Å; A84-F88 PolarHBondContact O-N 3.32Å
85A66.8Low63.5Low15 Ų1559.2 Ų59.212%0.12430%0.299CS..Hα-helixtrans-65-44178.400000111.3I81 L83 D87 F88 F89 Q116I81-A85 VanDerWaalsContact O-CB 3.3Å; I81-A85 WeakPolarHBondContact O-CB 3.49Å; I81-A85 PolarHBondContact O-N 3.3Å; L83-A85 PolarHBondContact O-N 3.02Å; A85-D87 VanDerWaalsContact C-N 3.32Å; A85-D87 PolarHBondContact O-N 3.2Å; A85-F88 PolarHBondContact O-N 3.33Å; A85-F89 WeakPolarHBondContact O-CD2 3.3Å; A85-F89 PolarHBondContact O-N 2.92Å; A85-Q116 HydrophobicContact CB-CB 4.49Å
86N65.8Low62.7Low48 Ų4864.6 Ų64.626%0.25733%0.328SS..Hα-helixtrans-62.1-39.5176.7179.966.7000112.2K82 L83 R90K82-N86 WeakPolarHBondContact O-CB 3.45Å; K82-N86 PolarHBondContact O-N 3.43Å; L83-N86 PolarHBondContact O-N 3.02Å; N86-R90 WeakPolarHBondContact O-CB 3.39Å; N86-R90 WeakPolarHBondContact O-CG 3.17Å; N86-R90 PolarHBondContact O-N 3.23Å
87D64.4Low61.9Low32 Ų3266.1 Ų66.117%0.17135%0.352CS..Hα-helixtrans-70.3-41.5177.9-78.8-7.9000112.3L83 A84 A85 F89 R90 Q91L83-D87 WeakPolarHBondContact O-CB 3.19Å; L83-D87 PolarHBondContact O-N 3.22Å; A84-D87 PolarHBondContact O-N 3.32Å; A85-D87 VanDerWaalsContact C-N 3.32Å; A85-D87 PolarHBondContact O-N 3.2Å; D87-F89 VanDerWaalsContact C-N 3.35Å; D87-F89 PolarHBondContact O-N 2.97Å; D87-R90 PolarHBondContact O-N 2.85Å; D87-Q91 WeakPolarHBondContact O-CG 3.17Å; D87-Q91 PolarHBondContact O-N 3.04Å
88F66.8Low60.8Low127 Ų12769.4 Ų69.456%0.55736%0.364SS*.Hα-helixtrans-57.5-47.8174.5-177.9-104000111.4A84 A85 Q91 L92A84-F88 WeakPolarHBondContact O-CB 3.41Å; A84-F88 PolarHBondContact O-N 3.32Å; A85-F88 PolarHBondContact O-N 3.33Å; F88-Q91 PolarHBondContact O-N 3.23Å; F88-L92 HydrophobicContact CD1-CD1 3.61Å; F88-L92 HydrophobicContact CE1-CD1 3.26Å; F88-L92 HydrophobicContact CE2-CD1 4.29Å; F88-L92 HydrophobicContact CG-CD1 4.26Å; F88-L92 HydrophobicContact CZ-CD1 3.65Å; F88-L92 PolarHBondContact O-N 3.01Å; F88-L92 VanDerWaalsContact O-N 3.12Å
89F62.3Low59.8Low47 Ų4776.8 Ų76.821%0.20640%0.399CS..Hα-helixtrans-69.2-38.1177.4-87.3-88.3000112.7A85 D87 Q91 L92 L93 A112 C115A85-F89 WeakPolarHBondContact O-CD2 3.3Å; A85-F89 PolarHBondContact O-N 2.92Å; D87-F89 VanDerWaalsContact C-N 3.35Å; D87-F89 PolarHBondContact O-N 2.97Å; F89-Q91 VanDerWaalsContact C-N 3.25Å; F89-Q91 PolarHBondContact O-N 3.4Å; F89-L92 PolarHBondContact O-N 2.93Å; F89-L93 HydrophobicContact CB-CD1 4.31Å; F89-L93 HydrophobicContact CD1-CD1 4.33Å; F89-L93 WeakPolarHBondContact O-CB 3.02Å; F89-L93 WeakPolarHBondContact O-CD1 2.98Å; F89-L93 PolarHBondContact O-N 2.89Å; F89-A112 HydrophobicContact CB-CB 3.76Å; F89-A112 HydrophobicContact CD2-CB 4.46Å; F89-A112 HydrophobicContact CG-CB 4.04Å; F89-C115 HydrophobicContact CD2-CB 4.21Å; F89-C115 HydrophobicContact CE2-CB 3.23Å; F89-C115 WeakPolarHBondContact CE2-SG 3.46Å; F89-C115 HydrophobicContact CZ-CB 3.43Å; F89-C115 VanDerWaalsContact CZ-CB 3.43Å
90R58.6Low59.3Low117 Ų11785.6 Ų85.644%0.44243%0.43SS..Hα-helixtrans-60.4-36.7174.1-83.3-179.7171.4-138.9-7.1112.1N86 D87 L93 M94N86-R90 WeakPolarHBondContact O-CB 3.39Å; N86-R90 WeakPolarHBondContact O-CG 3.17Å; N86-R90 PolarHBondContact O-N 3.23Å; D87-R90 PolarHBondContact O-N 2.85Å; R90-L93 PolarHBondContact O-N 3.35Å; R90-M94 VanDerWaalsContact O-CB 3.22Å; R90-M94 WeakPolarHBondContact O-CB 3.36Å; R90-M94 WeakPolarHBondContact O-CG 3.39Å; R90-M94 PolarHBondContact O-N 3.21Å
91Q63.1Low59.1Low81 Ų8189.1 Ų89.138%0.37945%0.445SS..Hα-helixtrans-66.6-48.4175.7-73.9176.1-12.900111.7D87 F88 F89 L93 M94 E95D87-Q91 WeakPolarHBondContact O-CG 3.17Å; D87-Q91 PolarHBondContact O-N 3.04Å; F88-Q91 PolarHBondContact O-N 3.23Å; F89-Q91 VanDerWaalsContact C-N 3.25Å; F89-Q91 PolarHBondContact O-N 3.4Å; Q91-L93 PolarHBondContact O-N 2.8Å; Q91-M94 PolarHBondContact O-N 3.48Å; Q91-E95 PolarHBondContact O-N 2.89Å; Q91-E95 VanDerWaalsContact O-N 3.15Å
92L63.2Low59Low83 Ų8390.5 Ų90.544%0.43545%0.453SS..Hα-helixtrans-55.6-38.2174.4-88.2144.4000112.8F88 F89F88-L92 HydrophobicContact CD1-CD1 3.61Å; F88-L92 HydrophobicContact CE1-CD1 3.26Å; F88-L92 HydrophobicContact CE2-CD1 4.29Å; F88-L92 HydrophobicContact CG-CD1 4.26Å; F88-L92 HydrophobicContact CZ-CD1 3.65Å; F88-L92 PolarHBondContact O-N 3.01Å; F88-L92 VanDerWaalsContact O-N 3.12Å; F89-L92 PolarHBondContact O-N 2.93Å
93L55.1Low58.9Low55 Ų5597.2 Ų97.229%0.28848%0.482SS..Hα-helixtrans-84.9-21.2-179.7-83.9123.1000114.4F89 R90 Q91 M104 A108F89-L93 HydrophobicContact CB-CD1 4.31Å; F89-L93 HydrophobicContact CD1-CD1 4.33Å; F89-L93 WeakPolarHBondContact O-CB 3.02Å; F89-L93 WeakPolarHBondContact O-CD1 2.98Å; F89-L93 PolarHBondContact O-N 2.89Å; R90-L93 PolarHBondContact O-N 3.35Å; Q91-L93 PolarHBondContact O-N 2.8Å; L93-M104 HydrophobicContact CD2-CE 4.38Å; L93-A108 HydrophobicContact CD1-CB 3.84Å; L93-A108 HydrophobicContact CD2-CB 3.5Å; L93-A108 VanDerWaalsContact CD2-CB 3.5Å; L93-A108 HydrophobicContact CG-CB 4.2Å
94M53.5Low59Low142 Ų14298 Ų9870%0.749%0.486SS*.Hα-helixtrans-85.1-18.3176.6-76.9-178.5-179.700112.8R90 Q91 D96R90-M94 VanDerWaalsContact O-CB 3.22Å; R90-M94 WeakPolarHBondContact O-CB 3.36Å; R90-M94 WeakPolarHBondContact O-CG 3.39Å; R90-M94 PolarHBondContact O-N 3.21Å; Q91-M94 PolarHBondContact O-N 3.48Å; M94-D96 VanDerWaalsContact C-N 3.26Å; M94-D96 PolarHBondContact O-N 3.48Å
95E50.9Low59Low164 Ų16499.9 Ų99.977%0.76649%0.488SS*.THydrogen-bonded Turntrans-68.4-25.3177.7-149.9166.4-170.200112.3Q91 G97Q91-E95 PolarHBondContact O-N 2.89Å; Q91-E95 VanDerWaalsContact O-N 3.15Å; E95-G97 PolarHBondContact O-N 2.96Å
96D48.3Very low59.1Low120 Ų120101.3 Ų101.364%0.64249%0.492SS*.THydrogen-bonded Turntrans-85.77.3-175.2-80.8-27.1000115.9M94 M98M94-D96 VanDerWaalsContact C-N 3.26Å; M94-D96 PolarHBondContact O-N 3.48Å; D96-M98 PolarHBondContact O-N 2.85Å
97G48.3Very low59.3Low75 Ų75105 Ų10577%0.77351%0.512SS*.  trans56.118169.700000116E95E95-G97 PolarHBondContact O-N 2.96Å
98M44.5Very low59.5Low122 Ų122104.6 Ų104.660%0.60151%0.513SS*.  trans-88132.7-170.4-106.6-17664.800111.6D96 M104D96-M98 PolarHBondContact O-N 2.85Å; M98-M104 HydrophobicContact CB-CE 3.63Å; M98-M104 HydrophobicContact CB-SD 3.6Å; M98-M104 HydrophobicContact CE-CE 3.47Å; M98-M104 VanDerWaalsContact CE-CE 3.47Å; M98-M104 HydrophobicContact CE-CG 4.29Å; M98-M104 HydrophobicContact CE-SD 3.17Å; M98-M104 WeakPolarHBondContact CE-SD 3.1Å; M98-M104 HydrophobicContact CG-CE 4.24Å; M98-M104 HydrophobicContact CG-SD 4.38Å; M98-M104 HydrophobicContact SD-CE 3.63Å; M98-M104 HydrophobicContact SD-SD 4.07Å
99Q45.3Very low59.5Low162 Ų16299 Ų9976%0.75749%0.49SS*.  trans-52.9146.2-178-74.4-145.4-26.100113.9N101Q99-N101 PolarHBondContact O-N 3.38Å
100R53.8Low59.9Low247 Ų24797.8 Ų97.893%0.93249%0.487SS*.  trans-56.568.9176.7-65.3175.267.5170.8-0.1113.1
101N63.2Low60.6Low101 Ų10193.2 Ų93.254%0.5448%0.477SS..  trans-91129170.5-88.9-49.1000109.5Q99 K103 M104 E105Q99-N101 PolarHBondContact O-N 3.38Å; N101-K103 PolarHBondContact O-N 2.84Å; N101-K103 VanDerWaalsContact O-N 3.09Å; N101-M104 HydrophobicContact CB-CB 4.44Å; N101-M104 WeakPolarHBondContact O-CA 3.28Å; N101-M104 WeakPolarHBondContact O-CB 3.35Å; N101-M104 PolarHBondContact O-N 2.85Å; N101-E105 PolarHBondContact O-N 3.04Å; N101-E105 VanDerWaalsContact O-N 3.14Å
102L66.1Low60.8Low75 Ų7589.7 Ų89.739%0.39346%0.461SS..Hα-helixtrans-48.6-39.7178-179.364000112.8M104 E105 M106 P202L102-M104 VanDerWaalsContact C-N 3.31Å; L102-M104 PolarHBondContact O-N 3.45Å; L102-E105 PolarHBondContact O-N 2.59Å; L102-M106 HydrophobicContact CG-SD 4.2Å; L102-M106 WeakPolarHBondContact O-CG 3.3Å; L102-M106 PolarHBondContact O-N 3.43Å; L102-P202 HydrophobicContact CD1-CB 3.76Å; L102-P202 HydrophobicContact CD1-CG 3.86Å; L102-P202 HydrophobicContact CD2-CB 4.11Å; L102-P202 HydrophobicContact CD2-CG 4.49Å; L102-P202 HydrophobicContact CG-CB 4.33Å; L102-P202 HydrophobicContact CG-CG 4.32Å
103K66.1Low61.1Low169 Ų16986.1 Ų86.174%0.73545%0.445SS*.Hα-helixtrans-63.7-35177.7-62.8-178.9-179.7178.50112.8N101 L107N101-K103 PolarHBondContact O-N 2.84Å; N101-K103 VanDerWaalsContact O-N 3.09Å; K103-L107 WeakPolarHBondContact O-CB 3.34Å; K103-L107 PolarHBondContact O-N 3.2Å
104M66.8Low62.1Low39 Ų3987.9 Ų87.919%0.19245%0.453CS..Hα-helixtrans-75.7-38.1178.6-164.5179.2-171.300111.1L93 M98 N101 L102 M106 L107 A108L93-M104 HydrophobicContact CD2-CE 4.38Å; M98-M104 HydrophobicContact CB-CE 3.63Å; M98-M104 HydrophobicContact CB-SD 3.6Å; M98-M104 HydrophobicContact CE-CE 3.47Å; M98-M104 VanDerWaalsContact CE-CE 3.47Å; M98-M104 HydrophobicContact CE-CG 4.29Å; M98-M104 HydrophobicContact CE-SD 3.17Å; M98-M104 WeakPolarHBondContact CE-SD 3.1Å; M98-M104 HydrophobicContact CG-CE 4.24Å; M98-M104 HydrophobicContact CG-SD 4.38Å; M98-M104 HydrophobicContact SD-CE 3.63Å; M98-M104 HydrophobicContact SD-SD 4.07Å; N101-M104 HydrophobicContact CB-CB 4.44Å; N101-M104 WeakPolarHBondContact O-CA 3.28Å; N101-M104 WeakPolarHBondContact O-CB 3.35Å; N101-M104 PolarHBondContact O-N 2.85Å; L102-M104 VanDerWaalsContact C-N 3.31Å; L102-M104 PolarHBondContact O-N 3.45Å; M104-M106 VanDerWaalsContact C-N 3.29Å; M104-M106 PolarHBondContact O-N 3.46Å; M104-L107 PolarHBondContact O-N 3.46Å; M104-A108 VanDerWaalsContact O-CB 3.26Å; M104-A108 WeakPolarHBondContact O-CB 3.22Å; M104-A108 PolarHBondContact O-N 3.19Å
105E65.9Low62.9Low76 Ų7683.4 Ų83.436%0.35544%0.435SS..Hα-helixtrans-62.8-37.9172.6-169.2170.7-176.900111.5N101 L102 G109N101-E105 PolarHBondContact O-N 3.04Å; N101-E105 VanDerWaalsContact O-N 3.14Å; L102-E105 PolarHBondContact O-N 2.59Å; E105-G109 PolarHBondContact O-N 3.39Å
106M69.1Low63.9Low45 Ų4577.4 Ų77.422%0.22241%0.407CS..Hα-helixtrans-65.1-45.7172.1-66.6167.980.100112.2L102 M104 G109 C110 I198 P202L102-M106 HydrophobicContact CG-SD 4.2Å; L102-M106 WeakPolarHBondContact O-CG 3.3Å; L102-M106 PolarHBondContact O-N 3.43Å; M104-M106 VanDerWaalsContact C-N 3.29Å; M104-M106 PolarHBondContact O-N 3.46Å; M106-G109 PolarHBondContact O-N 2.97Å; M106-C110 WeakPolarHBondContact O-CB 3.31Å; M106-C110 PolarHBondContact O-N 2.9Å; M106-C110 PolarHBondContact O-SG 3Å; M106-I198 HydrophobicContact CE-CB 4.03Å; M106-I198 HydrophobicContact CE-CG1 4.09Å; M106-I198 HydrophobicContact CE-CG2 3.6Å; M106-P202 HydrophobicContact CE-CG 4.03Å; M106-P202 HydrophobicContact CG-CG 3.89Å; M106-P202 HydrophobicContact SD-CG 3.69Å
107L71.1Confident65.1Low127 Ų12771.7 Ų71.767%0.66538%0.376SS*.Hα-helixtrans-62.5-41.7176.5-90.6156.1000112.2K103 M104 C110 G111K103-L107 WeakPolarHBondContact O-CB 3.34Å; K103-L107 PolarHBondContact O-N 3.2Å; M104-L107 PolarHBondContact O-N 3.46Å; L107-C110 PolarHBondContact O-N 2.75Å; L107-G111 PolarHBondContact O-N 2.97Å
108A67.4Low66.5Low23 Ų2371.2 Ų71.219%0.1936%0.358CS..Hα-helixtrans-59.6-49174.200000111.1L93 M104 C110 G111 A112L93-A108 HydrophobicContact CD1-CB 3.84Å; L93-A108 HydrophobicContact CD2-CB 3.5Å; L93-A108 VanDerWaalsContact CD2-CB 3.5Å; L93-A108 HydrophobicContact CG-CB 4.2Å; M104-A108 VanDerWaalsContact O-CB 3.26Å; M104-A108 WeakPolarHBondContact O-CB 3.22Å; M104-A108 PolarHBondContact O-N 3.19Å; A108-C110 VanDerWaalsContact C-N 3.33Å; A108-C110 PolarHBondContact O-N 3.44Å; A108-G111 PolarHBondContact O-N 2.86Å; A108-A112 VanDerWaalsContact O-CB 3.29Å; A108-A112 WeakPolarHBondContact O-CB 3.29Å; A108-A112 PolarHBondContact O-N 3.4Å
109G66.6Low68Low8 Ų868.9 Ų68.98%0.08235%0.35CS..Hα-helixtrans-62.9-37.5177.300000112.8E105 M106 G113E105-G109 PolarHBondContact O-N 3.39Å; M106-G109 PolarHBondContact O-N 2.97Å; G109-G113 PolarHBondContact O-N 3.25Å
110C71.8Confident69.4Low22 Ų2261.1 Ų61.115%0.14931%0.314CS..Hα-helixtrans-67.5-46.9174-72.20000111.8M106 L107 A108 G113 M114M106-C110 WeakPolarHBondContact O-CB 3.31Å; M106-C110 PolarHBondContact O-N 2.9Å; M106-C110 PolarHBondContact O-SG 3Å; L107-C110 PolarHBondContact O-N 2.75Å; A108-C110 VanDerWaalsContact C-N 3.33Å; A108-C110 PolarHBondContact O-N 3.44Å; C110-G113 PolarHBondContact O-N 2.95Å; C110-M114 VanDerWaalsContact O-CG 3.31Å; C110-M114 WeakPolarHBondContact O-CG 3.24Å; C110-M114 PolarHBondContact O-N 2.88Å
111G72.5Confident70.5Confident21 Ų2149.6 Ų49.622%0.21627%0.272CS..Hα-helixtrans-62.4-47.8178.700000112.6L107 A108 G113 M114 C115L107-G111 PolarHBondContact O-N 2.97Å; A108-G111 PolarHBondContact O-N 2.86Å; G111-G113 VanDerWaalsContact C-N 3.34Å; G111-G113 PolarHBondContact O-N 3.42Å; G111-M114 PolarHBondContact O-N 3.28Å; G111-C115 PolarHBondContact O-N 3.23Å; G111-C115 VanDerWaalsContact O-N 3.12Å
112A67.7Low71.1Confident7 Ų746 Ų466%0.05825%0.254CS..Hα-helixtrans-59.8-45.2173.500000111.2F89 A108 M114 C115 Q116F89-A112 HydrophobicContact CB-CB 3.76Å; F89-A112 HydrophobicContact CD2-CB 4.46Å; F89-A112 HydrophobicContact CG-CB 4.04Å; A108-A112 VanDerWaalsContact O-CB 3.29Å; A108-A112 WeakPolarHBondContact O-CB 3.29Å; A108-A112 PolarHBondContact O-N 3.4Å; A112-M114 PolarHBondContact O-N 2.97Å; A112-C115 PolarHBondContact O-N 3.31Å; A112-Q116 WeakPolarHBondContact O-CB 3.34Å; A112-Q116 PolarHBondContact O-N 3.48Å
113G69.9Low71.4Confident8 Ų845.9 Ų45.98%0.08225%0.252CS..Hα-helixtrans-60.2-41.9176.300000113.1G109 C110 G111 Q116 V117G109-G113 PolarHBondContact O-N 3.25Å; C110-G113 PolarHBondContact O-N 2.95Å; G111-G113 VanDerWaalsContact C-N 3.34Å; G111-G113 PolarHBondContact O-N 3.42Å; G113-Q116 WeakPolarHBondContact O-CB 3.42Å; G113-Q116 PolarHBondContact O-N 3.34Å; G113-V117 VanDerWaalsContact O-CB 3.29Å; G113-V117 WeakPolarHBondContact O-CB 3.29Å; G113-V117 WeakPolarHBondContact O-CG2 3.33Å; G113-V117 PolarHBondContact O-N 3.13Å
114M74.9Confident71.6Confident93 Ų9338.5 Ų38.546%0.45822%0.22SC..Hα-helixtrans-64-49.9177.6-72.5-162.3-6100111.9C110 G111 A112 Q116 V117 V118 L190 I194C110-M114 VanDerWaalsContact O-CG 3.31Å; C110-M114 WeakPolarHBondContact O-CG 3.24Å; C110-M114 PolarHBondContact O-N 2.88Å; G111-M114 PolarHBondContact O-N 3.28Å; A112-M114 PolarHBondContact O-N 2.97Å; M114-Q116 VanDerWaalsContact C-N 3.34Å; M114-Q116 PolarHBondContact O-N 3.49Å; M114-V117 PolarHBondContact O-N 3.5Å; M114-V118 WeakPolarHBondContact O-CG2 3.35Å; M114-V118 PolarHBondContact O-N 2.88Å; M114-L190 HydrophobicContact CB-CD2 4.29Å; M114-L190 HydrophobicContact CG-CD2 3.98Å; M114-I194 HydrophobicContact CG-CD1 4.35Å
115C71.6Confident71.9Confident48 Ų4836.7 Ų36.732%0.32421%0.211SC..Hα-helixtrans-63.9-42.7178.6-172.90000111.4F89 G111 A112 V117 V118 V119F89-C115 HydrophobicContact CD2-CB 4.21Å; F89-C115 HydrophobicContact CE2-CB 3.23Å; F89-C115 WeakPolarHBondContact CE2-SG 3.46Å; F89-C115 HydrophobicContact CZ-CB 3.43Å; F89-C115 VanDerWaalsContact CZ-CB 3.43Å; G111-C115 PolarHBondContact O-N 3.23Å; G111-C115 VanDerWaalsContact O-N 3.12Å; A112-C115 PolarHBondContact O-N 3.31Å; C115-V117 VanDerWaalsContact C-N 3.31Å; C115-V117 PolarHBondContact O-N 2.9Å; C115-V118 PolarHBondContact O-N 2.91Å; C115-V119 WeakPolarHBondContact O-CG2 3.25Å; C115-V119 PolarHBondContact O-N 3.49Å; C115-V119 VanDerWaalsContact O-N 3.07Å
116Q71.7Confident72.1Confident38 Ų3834.5 Ų34.518%0.17820%0.202CC..Hα-helixtrans-53.6-49.4173.1-179.2-147.4-77.200111.3K82 A85 A112 G113 M114 V118 V119 T120K82-Q116 HydrophobicContact CB-CG 4.3Å; K82-Q116 HydrophobicContact CD-CG 4.43Å; K82-Q116 HydrophobicContact CG-CG 3.63Å; A85-Q116 HydrophobicContact CB-CB 4.49Å; A112-Q116 WeakPolarHBondContact O-CB 3.34Å; A112-Q116 PolarHBondContact O-N 3.48Å; G113-Q116 WeakPolarHBondContact O-CB 3.42Å; G113-Q116 PolarHBondContact O-N 3.34Å; M114-Q116 VanDerWaalsContact C-N 3.34Å; M114-Q116 PolarHBondContact O-N 3.49Å; Q116-V118 VanDerWaalsContact C-N 3.32Å; Q116-V118 PolarHBondContact O-N 3.34Å; Q116-V119 PolarHBondContact O-N 2.97Å; Q116-T120 HydrophobicContact CG-CG2 4.37Å; Q116-T120 WeakPolarHBondContact O-CB 3.45Å; Q116-T120 WeakPolarHBondContact O-CG2 3.33Å; Q116-T120 PolarHBondContact O-N 3.4Å; Q116-T120 PolarHBondContact O-OG1 3.25Å
117V73.3Confident72.3Confident0 Ų034.5 Ų34.50%020%0.201CC..Hα-helixtrans-65-37.6-178166.70000111G113 M114 C115 T120 S121 L186 T189 L190 D193G113-V117 VanDerWaalsContact O-CB 3.29Å; G113-V117 WeakPolarHBondContact O-CB 3.29Å; G113-V117 WeakPolarHBondContact O-CG2 3.33Å; G113-V117 PolarHBondContact O-N 3.13Å; M114-V117 PolarHBondContact O-N 3.5Å; C115-V117 VanDerWaalsContact C-N 3.31Å; C115-V117 PolarHBondContact O-N 2.9Å; V117-T120 PolarHBondContact O-N 2.88Å; V117-S121 WeakPolarHBondContact O-CA 3.42Å; V117-S121 WeakPolarHBondContact O-CB 3.32Å; V117-S121 PolarHBondContact O-N 2.95Å; V117-S121 PolarHBondContact O-OG 3.37Å; V117-L186 HydrophobicContact CG1-CD1 3.53Å; V117-T189 HydrophobicContact CB-CG2 4.2Å; V117-T189 HydrophobicContact CG1-CG2 3.47Å; V117-T189 VanDerWaalsContact CG1-CG2 3.47Å; V117-T189 HydrophobicContact CG2-CG2 3.66Å; V117-L190 HydrophobicContact CB-CD2 3.73Å; V117-L190 HydrophobicContact CG1-CD2 3.59Å; V117-L190 HydrophobicContact CG1-CG 3.81Å; V117-L190 HydrophobicContact CG2-CD2 4.21Å; V117-D193 HydrophobicContact CG2-CB 4.08Å; V117-D193 WeakPolarHBondContact CG2-OD2 3.41Å
118V78.1Confident72.1Confident65 Ų6530 Ų3039%0.39418%0.177SC..Hα-helixtrans-60.2-48.2173.9172.60000110.9M114 C115 Q116 Y183M114-V118 WeakPolarHBondContact O-CG2 3.35Å; M114-V118 PolarHBondContact O-N 2.88Å; C115-V118 PolarHBondContact O-N 2.91Å; Q116-V118 VanDerWaalsContact C-N 3.32Å; Q116-V118 PolarHBondContact O-N 3.34Å; V118-Y183 HydrophobicContact CG1-CE1 4.42Å; V118-Y183 WeakPolarHBondContact O-CE1 3.27Å
119V75.1Confident72.2Confident72 Ų7229.9 Ų29.944%0.43617%0.172SC..Hα-helixtrans-70.3-37.2-178.2-178.30000112.1I81 C115 Q116I81-V119 HydrophobicContact CG2-CB 4.3Å; I81-V119 HydrophobicContact CG2-CG1 3.55Å; C115-V119 WeakPolarHBondContact O-CG2 3.25Å; C115-V119 PolarHBondContact O-N 3.49Å; C115-V119 VanDerWaalsContact O-N 3.07Å; Q116-V119 PolarHBondContact O-N 2.97Å
120T74.7Confident72.2Confident0 Ų030.7 Ų30.70%018%0.175CC..Hα-helixtrans-92-15-172.858.50000114.2I81 K82 Q116 V117 M123 E124I81-T120 HydrophobicContact CB-CG2 4.48Å; I81-T120 HydrophobicContact CG2-CG2 3.88Å; K82-T120 HydrophobicContact CG-CG2 4.04Å; Q116-T120 HydrophobicContact CG-CG2 4.37Å; Q116-T120 WeakPolarHBondContact O-CB 3.45Å; Q116-T120 WeakPolarHBondContact O-CG2 3.33Å; Q116-T120 PolarHBondContact O-N 3.4Å; Q116-T120 PolarHBondContact O-OG1 3.25Å; V117-T120 PolarHBondContact O-N 2.88Å; T120-M123 WeakPolarHBondContact O-CB 3.32Å; T120-M123 PolarHBondContact O-N 3.42Å; T120-E124 PolarHBondContact O-N 2.99Å
121S76.3Confident71.8Confident5 Ų533.3 Ų33.34%0.03519%0.185CC..Hα-helixtrans-55.8-44.8-178.5-77.50000114.2V117 M123 E124 M125 L186V117-S121 WeakPolarHBondContact O-CA 3.42Å; V117-S121 WeakPolarHBondContact O-CB 3.32Å; V117-S121 PolarHBondContact O-N 2.95Å; V117-S121 PolarHBondContact O-OG 3.37Å; S121-M123 VanDerWaalsContact C-N 3.29Å; S121-M123 PolarHBondContact O-N 2.74Å; S121-E124 PolarHBondContact O-N 2.72Å; S121-M125 WeakPolarHBondContact O-CB 3.41Å; S121-M125 PolarHBondContact O-N 3.22Å; S121-L186 WeakPolarHBondContact OG-CD1 3.32Å
122P75.6Confident71.3Confident25 Ų2533.8 Ų33.816%0.16218%0.182CC..Hα-helixtrans-58.7-40.3175-27.937.6000113.1L126 L182 Y183P122-L126 VanDerWaalsContact O-CG 3.26Å; P122-L126 WeakPolarHBondContact O-CG 3.3Å; P122-L126 PolarHBondContact O-N 3.49Å; P122-L182 HydrophobicContact CB-CB 4.48Å; P122-L182 HydrophobicContact CB-CD2 4.22Å; P122-Y183 HydrophobicContact CG-CE1 4.22Å; P122-Y183 HydrophobicContact CG-CE2 4.38Å
123M72.5Confident71Confident72 Ų7234.6 Ų34.636%0.35519%0.189SC..Hα-helixtrans-70.2-41.9179.2-65.4-174.7176.100111.7I81 T120 S121 M125 L126 K127I81-M123 HydrophobicContact CD1-CE 3.44Å; I81-M123 VanDerWaalsContact CD1-CE 3.44Å; I81-M123 HydrophobicContact CD1-SD 3.73Å; T120-M123 WeakPolarHBondContact O-CB 3.32Å; T120-M123 PolarHBondContact O-N 3.42Å; S121-M123 VanDerWaalsContact C-N 3.29Å; S121-M123 PolarHBondContact O-N 2.74Å; M123-M125 VanDerWaalsContact C-N 3.34Å; M123-M125 PolarHBondContact O-N 2.98Å; M123-L126 PolarHBondContact O-N 3.32Å; M123-K127 WeakPolarHBondContact O-CB 3.11Å; M123-K127 PolarHBondContact O-N 3.25Å
124E71.3Confident70.5Confident14 Ų1435.7 Ų35.77%0.06520%0.2CC..Hα-helixtrans-61.4-43.4175.5-70.2-166.2169.500111K82 T120 S121 K127 I128 R192 K246K82-E124 IonicContact NZ-OE1 3.87Å; K82-E124 PolarHBondContact NZ-OE1 3.48Å; T120-E124 PolarHBondContact O-N 2.99Å; S121-E124 PolarHBondContact O-N 2.72Å; E124-K127 PolarHBondContact O-N 2.95Å; E124-I128 VanDerWaalsContact O-CG1 3.28Å; E124-I128 WeakPolarHBondContact O-CG1 3.42Å; E124-I128 PolarHBondContact O-N 3.31Å; E124-R192 IonicContact OE1-NH2 2.72Å; E124-K246 IonicContact OE2-NZ 2.84Å; E124-K246 PolarHBondContact OE2-NZ 3.35Å
125M72.1Confident69.7Low2 Ų236 Ų361%0.0120%0.196CC..Hα-helixtrans-59-51.1174.5177.859.57500111.1S121 M123 K127 I128 Q129 L173 K184 Q250 L252S121-M125 WeakPolarHBondContact O-CB 3.41Å; S121-M125 PolarHBondContact O-N 3.22Å; M123-M125 VanDerWaalsContact C-N 3.34Å; M123-M125 PolarHBondContact O-N 2.98Å; M125-K127 VanDerWaalsContact C-N 3.29Å; M125-K127 PolarHBondContact O-N 3.31Å; M125-I128 PolarHBondContact O-N 2.97Å; M125-Q129 WeakPolarHBondContact O-CG 3.43Å; M125-Q129 PolarHBondContact O-N 3.46Å; M125-Q129 HydrophobicContact SD-CG 4.2Å; M125-L173 HydrophobicContact CG-CD2 4.08Å; M125-K184 HydrophobicContact CE-CB 3.96Å; M125-K184 WeakPolarHBondContact CE-O 3.23Å; M125-Q250 HydrophobicContact CE-CG 4.42Å; M125-L252 HydrophobicContact SD-CD1 4.42Å
126L71.1Confident68.8Low30 Ų3037.4 Ų37.416%0.15720%0.2CC..Hα-helixtrans-61.1-38.2179.8-71.5172.7000112.7P122 M123 Q129 L130 I169 A170P122-L126 VanDerWaalsContact O-CG 3.26Å; P122-L126 WeakPolarHBondContact O-CG 3.3Å; P122-L126 PolarHBondContact O-N 3.49Å; M123-L126 PolarHBondContact O-N 3.32Å; L126-Q129 PolarHBondContact O-N 3.06Å; L126-L130 WeakPolarHBondContact O-CB 3.46Å; L126-L130 PolarHBondContact O-N 3.3Å; L126-I169 HydrophobicContact CD2-CG2 4.19Å; L126-A170 HydrophobicContact CD1-CB 4.14Å; L126-A170 HydrophobicContact CD2-CB 3.65Å
127K72.9Confident67.9Low45 Ų4537.5 Ų37.520%0.19621%0.207CC..Hα-helixtrans-63.1-47.5176-178.9-175.6177-171.60111.4L74 V75 E78 M123 E124 M125 Q129 L130 Q131L74-K127 HydrophobicContact CD1-CB 4.34Å; L74-K127 HydrophobicContact CD1-CG 4.43Å; V75-K127 HydrophobicContact CG2-CD 4.2Å; E78-K127 IonicContact OE2-NZ 2.8Å; M123-K127 WeakPolarHBondContact O-CB 3.11Å; M123-K127 PolarHBondContact O-N 3.25Å; E124-K127 PolarHBondContact O-N 2.95Å; M125-K127 VanDerWaalsContact C-N 3.29Å; M125-K127 PolarHBondContact O-N 3.31Å; K127-Q129 VanDerWaalsContact C-N 3.33Å; K127-Q129 PolarHBondContact O-N 3.29Å; K127-L130 PolarHBondContact O-N 3.13Å; K127-Q131 WeakPolarHBondContact O-CB 3.45Å; K127-Q131 VanDerWaalsContact O-CG 3.25Å; K127-Q131 WeakPolarHBondContact O-CG 3.37Å; K127-Q131 PolarHBondContact O-N 3.37Å
128I67.6Low66.8Low33 Ų3342.1 Ų42.117%0.16924%0.236CC..Hα-helixtrans-59.8-46.7177.1-67.3165.4000109.7E124 M125 L130 Q131 D132 Q250E124-I128 VanDerWaalsContact O-CG1 3.28Å; E124-I128 WeakPolarHBondContact O-CG1 3.42Å; E124-I128 PolarHBondContact O-N 3.31Å; M125-I128 PolarHBondContact O-N 2.97Å; I128-L130 PolarHBondContact O-N 3.47Å; I128-Q131 PolarHBondContact O-N 3.47Å; I128-D132 WeakPolarHBondContact O-CB 3.49Å; I128-D132 PolarHBondContact O-N 3.15Å; I128-Q250 HydrophobicContact CD1-CB 4.14Å
129Q68.4Low65.2Low19 Ų1944.8 Ų44.89%0.08924%0.243CC..Hα-helixtrans-61.7-40.7178.5-66.8-52.5-37.600113.2M125 L126 K127 D132 A133 I169 L252M125-Q129 WeakPolarHBondContact O-CG 3.43Å; M125-Q129 PolarHBondContact O-N 3.46Å; M125-Q129 HydrophobicContact SD-CG 4.2Å; L126-Q129 PolarHBondContact O-N 3.06Å; K127-Q129 VanDerWaalsContact C-N 3.33Å; K127-Q129 PolarHBondContact O-N 3.29Å; Q129-D132 PolarHBondContact O-N 3.33Å; Q129-A133 WeakPolarHBondContact O-CB 3.49Å; Q129-A133 PolarHBondContact O-N 3.21Å; Q129-I169 HydrophobicContact CB-CD1 4.48Å; Q129-I169 HydrophobicContact CB-CG2 3.77Å; Q129-I169 HydrophobicContact CG-CG2 4.19Å; Q129-L252 VanDerWaalsContact NE2-CG 3.32Å
130L67.4Low63.6Low25 Ų2548.1 Ų48.113%0.13125%0.254CS..Hα-helixtrans-72.2-37.5-179.3-160.4161.1000110.9V70 L74 L126 K127 I128 A133 G134 A166 I169V70-L130 HydrophobicContact CB-CD2 4.5Å; V70-L130 HydrophobicContact CG1-CD1 4.44Å; V70-L130 HydrophobicContact CG1-CD2 3.36Å; V70-L130 HydrophobicContact CG1-CG 4.44Å; V70-L130 HydrophobicContact CG2-CD2 4.35Å; L74-L130 HydrophobicContact CD1-CD1 4.18Å; L126-L130 WeakPolarHBondContact O-CB 3.46Å; L126-L130 PolarHBondContact O-N 3.3Å; K127-L130 PolarHBondContact O-N 3.13Å; I128-L130 PolarHBondContact O-N 3.47Å; L130-A133 PolarHBondContact O-N 2.73Å; L130-G134 PolarHBondContact O-N 3.17Å; L130-A166 HydrophobicContact CD1-CB 3.84Å; L130-I169 HydrophobicContact CB-CD1 4.3Å; L130-I169 HydrophobicContact CG-CD1 4.46Å
131Q63.7Low62Low78 Ų7855.6 Ų55.636%0.36429%0.289SS..Hα-helixtrans-63.3-42.5172.3-72.5179.4-9.100111.8N71 K127 I128 G134 R135N71-Q131 PolarHBondContact OD1-NE2 3.4Å; K127-Q131 WeakPolarHBondContact O-CB 3.45Å; K127-Q131 VanDerWaalsContact O-CG 3.25Å; K127-Q131 WeakPolarHBondContact O-CG 3.37Å; K127-Q131 PolarHBondContact O-N 3.37Å; I128-Q131 PolarHBondContact O-N 3.47Å; Q131-G134 PolarHBondContact O-N 3.18Å; Q131-R135 PolarHBondContact O-N 3.41Å
132D62Low60Low31 Ų3157.8 Ų57.817%0.16631%0.313CS..Hα-helixtrans-68-43.3176.2-76.1-13.1000111.9I128 Q129 G134 R135 L136I128-D132 WeakPolarHBondContact O-CB 3.49Å; I128-D132 PolarHBondContact O-N 3.15Å; Q129-D132 PolarHBondContact O-N 3.33Å; D132-G134 VanDerWaalsContact C-N 3.28Å; D132-G134 PolarHBondContact O-N 3.49Å; D132-R135 WeakPolarHBondContact O-CB 3.36Å; D132-R135 PolarHBondContact O-N 3.02Å; D132-R135 VanDerWaalsContact O-N 3.16Å; D132-L136 WeakPolarHBondContact O-CG 3.23Å; D132-L136 PolarHBondContact O-N 3.18Å
133A60.7Low58Low24 Ų2461.6 Ų61.620%0.19834%0.339CS..Hα-helixtrans-61.5-37.3175.200000111.9Q129 L130 A137 P164 I169Q129-A133 WeakPolarHBondContact O-CB 3.49Å; Q129-A133 PolarHBondContact O-N 3.21Å; L130-A133 PolarHBondContact O-N 2.73Å; A133-A137 PolarHBondContact O-N 3.26Å; A133-A137 VanDerWaalsContact O-N 3.13Å; A133-P164 HydrophobicContact CB-CB 4Å; A133-P164 HydrophobicContact CB-CG 3.91Å; A133-I169 HydrophobicContact CB-CD1 4.42Å
134G60Low56.2Low31 Ų3162.1 Ų62.132%0.3236%0.356SS..Hα-helixtrans-63.4-43.3172.900000112.6L130 Q131 D132 L136 A137 V138L130-G134 PolarHBondContact O-N 3.17Å; Q131-G134 PolarHBondContact O-N 3.18Å; D132-G134 VanDerWaalsContact C-N 3.28Å; D132-G134 PolarHBondContact O-N 3.49Å; G134-L136 PolarHBondContact O-N 3.46Å; G134-A137 PolarHBondContact O-N 3Å; G134-V138 WeakPolarHBondContact O-CG2 3.45Å; G134-V138 PolarHBondContact O-N 3.48Å
135R56.8Low54.4Low98 Ų9866.6 Ų66.637%0.3739%0.389SS..Hα-helixtrans-59.9-44.5175.8-80.1179153.9-179-6.5112.6Q131 D132 V138 H139Q131-R135 PolarHBondContact O-N 3.41Å; D132-R135 WeakPolarHBondContact O-CB 3.36Å; D132-R135 PolarHBondContact O-N 3.02Å; D132-R135 VanDerWaalsContact O-N 3.16Å; R135-V138 PolarHBondContact O-N 2.92Å; R135-H139 PolarHBondContact O-N 3.34Å
136L54.1Low52.4Low79 Ų7970.3 Ų70.341%0.41442%0.419SS..Hα-helixtrans-65.9-40.1179.5-67.3170.6000112.1D132 G134 V138 H139 H140 K253D132-L136 WeakPolarHBondContact O-CG 3.23Å; D132-L136 PolarHBondContact O-N 3.18Å; G134-L136 PolarHBondContact O-N 3.46Å; L136-V138 VanDerWaalsContact C-N 3.27Å; L136-V138 PolarHBondContact O-N 3.48Å; L136-H139 PolarHBondContact O-N 2.94Å; L136-H140 PolarHBondContact O-CD2 3.18Å; L136-H140 VanDerWaalsContact O-CD2 3.25Å; L136-H140 PolarHBondContact O-N 3.46Å; L136-K253 HydrophobicContact CD1-CD 3.89Å
137A52.7Low50.8Low39 Ų3975.3 Ų75.332%0.32245%0.454SS..Hα-helixtrans-61.9-34.5176.700000112.7A133 G134 Q141A133-A137 PolarHBondContact O-N 3.26Å; A133-A137 VanDerWaalsContact O-N 3.13Å; G134-A137 PolarHBondContact O-N 3Å; A137-Q141 PolarHBondContact O-N 3.33Å
138V49.3Very low48.8Very low98 Ų9878.1 Ų78.159%0.59448%0.479SS*.Hα-helixtrans-72.4-38.7177.1173.60000111.8G134 R135 L136 H140 Q141 G142G134-V138 WeakPolarHBondContact O-CG2 3.45Å; G134-V138 PolarHBondContact O-N 3.48Å; R135-V138 PolarHBondContact O-N 2.92Å; L136-V138 VanDerWaalsContact C-N 3.27Å; L136-V138 PolarHBondContact O-N 3.48Å; V138-H140 VanDerWaalsContact C-N 3.35Å; V138-H140 PolarHBondContact O-N 2.89Å; V138-Q141 PolarHBondContact O-N 2.98Å; V138-G142 PolarHBondContact O-N 3.19Å; V138-G142 VanDerWaalsContact O-N 3.08Å
139H44.1Very low47.3Very low121 Ų12183.5 Ų83.556%0.5651%0.513SS*.Hα-helixtrans-64.4-36.3176.2-91.4-76.9000113.1R135 L136 Q141 G142 S143R135-H139 PolarHBondContact O-N 3.34Å; L136-H139 PolarHBondContact O-N 2.94Å; H139-Q141 VanDerWaalsContact C-N 3.3Å; H139-Q141 PolarHBondContact O-N 3.41Å; H139-G142 PolarHBondContact O-N 2.97Å; H139-S143 PolarHBondContact O-N 3.38Å; H139-S143 PolarHBondContact O-OG 3.47Å
140H42.3Very low45.5Very low141 Ų14187.7 Ų87.765%0.65355%0.545SS*.Hα-helixtrans-69.9-25.1175.5-77.8-70000113.6L136 V138L136-H140 PolarHBondContact O-CD2 3.18Å; L136-H140 VanDerWaalsContact O-CD2 3.25Å; L136-H140 PolarHBondContact O-N 3.46Å; V138-H140 VanDerWaalsContact C-N 3.35Å; V138-H140 PolarHBondContact O-N 2.89Å
141Q40.7Very low44Very low157 Ų15798.4 Ų98.473%0.73458%0.584SS**Hα-helixtrans-82.1-29.5174-73.1-177.6-7.500113A137 V138 H139A137-Q141 PolarHBondContact O-N 3.33Å; V138-Q141 PolarHBondContact O-N 2.98Å; H139-Q141 VanDerWaalsContact C-N 3.3Å; H139-Q141 PolarHBondContact O-N 3.41Å
142G35.9Very low42.2Very low52 Ų52100.2 Ų100.254%0.53661%0.605SS.*Hα-helixtrans-71.9-26.217800000114.7V138 H139V138-G142 PolarHBondContact O-N 3.19Å; V138-G142 VanDerWaalsContact O-N 3.08Å; H139-G142 PolarHBondContact O-N 2.97Å
143S32Very low40.7Very low104 Ų104109.4 Ų109.473%0.72764%0.639SS**THydrogen-bonded Turntrans-87.73.5-179.3-55.50000114.6H139H139-S143 PolarHBondContact O-N 3.38Å; H139-S143 PolarHBondContact O-OG 3.47Å
144A35.8Very low39.2Very low84 Ų84115 Ų11569%0.69467%0.671SS**  trans-98.834.3179.500000113.2
145S32.8Very low38Very low108 Ų108120.4 Ų120.476%0.75570%0.698SS**  trans-117.460.9173.751.90000111.4
146A30.1Very low36.5Very low79 Ų79119.2 Ų119.265%0.65372%0.716SS**  trans-125.7119.9159.600000108.1S148A146-S148 PolarHBondContact O-N 3.05Å
147P37.3Very low35Very low136 Ų136121 Ų12188%0.88374%0.735SS**  trans-81.294.4174.630.6-27.8000108.6
148S30.3Very low33.8Very low103 Ų103123.5 Ų123.572%0.7276%0.756SS**  trans-103.8105.9163.446.90000109.7A146 S150A146-S148 PolarHBondContact O-N 3.05Å; S148-S150 PolarHBondContact O-N 3.45Å; S148-S150 VanDerWaalsContact O-N 3.17Å
149T37.5Very low33Very low146 Ų146123.5 Ų123.590%0.89676%0.76SS**  trans-58.7103.9163.933.10000110.9
150S31.1Very low32.4Very low108 Ų108123 Ų12376%0.75577%0.766SS**  trans-160.3118.2149.347.60000111S148S148-S150 PolarHBondContact O-N 3.45Å; S148-S150 VanDerWaalsContact O-N 3.17Å
151R35.9Very low32.2Very low250 Ų250123.8 Ų123.894%0.94377%0.77SS**  trans-64.8134.9166.5-74.6174178.8164.6-0.8109
152S25.5Very low32.3Very low116 Ų116124.3 Ų124.381%0.81177%0.769SS**  trans-156.3131142.6-160.80000111.1
153Y30.1Very low33Very low223 Ų223132.7 Ų132.788%0.87579%0.785SS**  trans-63.6137171.4-88.2-108.3000110.6
154T28.7Very low34.2Very low142 Ų142130.4 Ų130.487%0.87177%0.767SS**  trans-173.5135.5136.918.40000110.9
155T34.6Very low35.6Very low145 Ų145128.7 Ų128.789%0.8975%0.75SS**  trans-64.112917942.40000112.9
156G24.8Very low37.1Very low73 Ų73124.8 Ų124.875%0.75372%0.724SS**  trans166.198.3167.900000114.3
157S23.9Very low39.1Very low115 Ų115125.8 Ų125.880%0.80472%0.722SS**  trans55.497.6164.1-159.90000117S159S157-S159 VanDerWaalsContact C-N 3.35Å; S157-S159 PolarHBondContact O-N 2.89Å
158A27.9Very low40.8Very low92 Ų92123.7 Ų123.776%0.7670%0.704SS**  trans-56101.215600000108.3T160A158-T160 PolarHBondContact O-N 3Å
159S32.1Very low42.7Very low99 Ų99120.4 Ų120.469%0.69268%0.677SS**  trans-67.387.2169.355.10000107.6S157 H161S157-S159 VanDerWaalsContact C-N 3.35Å; S157-S159 PolarHBondContact O-N 2.89Å; S159-H161 VanDerWaalsContact C-N 3.34Å; S159-H161 PolarHBondContact O-N 3.47Å
160T31.9Very low44.2Very low111 Ų111114.4 Ų114.468%0.68164%0.643SS**  trans-52.7103.8163.447.30000106.6A158 K162A158-T160 PolarHBondContact O-N 3Å; T160-K162 PolarHBondContact O-N 2.8Å
161H37.8Very low46.4Very low157 Ų157117.9 Ų117.973%0.72764%0.639SS**  trans-61.286.5169.3-107.9-70.7000106.9S159 R163S159-H161 VanDerWaalsContact C-N 3.34Å; S159-H161 PolarHBondContact O-N 3.47Å; H161-R163 PolarHBondContact O-N 2.67Å; H161-R163 VanDerWaalsContact O-N 3.08Å
162K41.4Very low48.3Very low167 Ų167111.4 Ų111.473%0.72662%0.62SS**  trans-60.5116.8173.3-83.8-177177.31770106.1T160T160-K162 PolarHBondContact O-N 2.8Å
163R51.9Low50.5Low229 Ų229106.5 Ų106.586%0.86458%0.584SS**  trans-50.5130172.1-73.8-177.6176.21730.2107.7H161 S165H161-R163 PolarHBondContact O-N 2.67Å; H161-R163 VanDerWaalsContact O-N 3.08Å; R163-S165 PolarHBondContact O-N 2.83Å
164P57.9Low52.8Low55 Ų5599.8 Ų99.836%0.35756%0.563SS.*  trans-62.4107.4-179.722.6-30.2000108.8A133 I169A133-P164 HydrophobicContact CB-CB 4Å; A133-P164 HydrophobicContact CB-CG 3.91Å; P164-I169 HydrophobicContact CB-CD1 4.16Å
165S64.6Low55.2Low49 Ų49102.9 Ų102.934%0.34356%0.559SS.*  trans-83.1137.9174.8178.70000109.3R163 T167 L168 I169R163-S165 PolarHBondContact O-N 2.83Å; S165-T167 PolarHBondContact O-N 3.34Å; S165-T167 VanDerWaalsContact O-N 3.15Å; S165-T167 PolarHBondContact OG-OG1 3.46Å; S165-L168 PolarHBondContact O-N 3.45Å; S165-I169 PolarHBondContact O-N 2.89Å; S165-I169 VanDerWaalsContact O-N 3.11Å
166A64.4Low57.2Low25 Ų25100.1 Ų100.121%0.20754%0.542CS..Hα-helixtrans-52.5-37.1176.600000112.2L130 I169 A170L130-A166 HydrophobicContact CD1-CB 3.84Å; A166-I169 PolarHBondContact O-N 3.35Å; A166-A170 VanDerWaalsContact O-CB 3.31Å; A166-A170 WeakPolarHBondContact O-CB 3.46Å; A166-A170 PolarHBondContact O-N 2.93Å
167T71.3Confident59.4Low100 Ų100100.6 Ų100.661%0.61353%0.525SS*.Hα-helixtrans-69.6-33.9179.653.40000113.3S165 R171S165-T167 PolarHBondContact O-N 3.34Å; S165-T167 VanDerWaalsContact O-N 3.15Å; S165-T167 PolarHBondContact OG-OG1 3.46Å; T167-R171 VanDerWaalsContact O-CB 3.29Å; T167-R171 WeakPolarHBondContact O-CB 3.41Å; T167-R171 PolarHBondContact O-N 3.49Å
168L72.6Confident62.1Low93 Ų9396.5 Ų96.549%0.48750%0.501SS..Hα-helixtrans-72.5-43176.3-68.3176.1000110.8S165 A170 R171 E172S165-L168 PolarHBondContact O-N 3.45Å; L168-A170 VanDerWaalsContact C-N 3.33Å; L168-A170 PolarHBondContact O-N 2.69Å; L168-R171 PolarHBondContact O-N 3.45Å; L168-E172 VanDerWaalsContact O-CB 3.29Å; L168-E172 WeakPolarHBondContact O-CB 3.11Å; L168-E172 PolarHBondContact O-N 3.09Å
169I71.1Confident64.4Low33 Ų3398.1 Ų98.117%0.16950%0.496CS..Hα-helixtrans-60.8-45.5174.4-63174.1000110.1L126 Q129 L130 A133 P164 S165 A166 R171 E172 L173L126-I169 HydrophobicContact CD2-CG2 4.19Å; Q129-I169 HydrophobicContact CB-CD1 4.48Å; Q129-I169 HydrophobicContact CB-CG2 3.77Å; Q129-I169 HydrophobicContact CG-CG2 4.19Å; L130-I169 HydrophobicContact CB-CD1 4.3Å; L130-I169 HydrophobicContact CG-CD1 4.46Å; A133-I169 HydrophobicContact CB-CD1 4.42Å; P164-I169 HydrophobicContact CB-CD1 4.16Å; S165-I169 PolarHBondContact O-N 2.89Å; S165-I169 VanDerWaalsContact O-N 3.11Å; A166-I169 PolarHBondContact O-N 3.35Å; I169-R171 PolarHBondContact O-N 2.99Å; I169-E172 PolarHBondContact O-N 2.95Å; I169-L173 VanDerWaalsContact O-CB 3.24Å; I169-L173 WeakPolarHBondContact O-CB 3.32Å; I169-L173 PolarHBondContact O-N 2.94Å
170A69.8Low66.3Low20 Ų2097.1 Ų97.117%0.16549%0.494CS..Hα-helixtrans-60.2-46.1177.300000112.1L126 A166 L168 L173 L174L126-A170 HydrophobicContact CD1-CB 4.14Å; L126-A170 HydrophobicContact CD2-CB 3.65Å; A166-A170 VanDerWaalsContact O-CB 3.31Å; A166-A170 WeakPolarHBondContact O-CB 3.46Å; A166-A170 PolarHBondContact O-N 2.93Å; L168-A170 VanDerWaalsContact C-N 3.33Å; L168-A170 PolarHBondContact O-N 2.69Å; A170-L173 PolarHBondContact O-N 2.87Å; A170-L174 WeakPolarHBondContact O-CB 2.82Å; A170-L174 WeakPolarHBondContact O-CG 3.46Å; A170-L174 PolarHBondContact O-N 2.89Å
171R77.2Confident68.1Low182 Ų18291.9 Ų91.969%0.68746%0.462SS*.Hα-helixtrans-65.3-41.1179.3-171.7176.7-177.6169.30.8112.1T167 L168 I169 R175T167-R171 VanDerWaalsContact O-CB 3.29Å; T167-R171 WeakPolarHBondContact O-CB 3.41Å; T167-R171 PolarHBondContact O-N 3.49Å; L168-R171 PolarHBondContact O-N 3.45Å; I169-R171 PolarHBondContact O-N 2.99Å; R171-R175 WeakPolarHBondContact O-CB 3.45Å; R171-R175 PolarHBondContact O-N 3.26Å
172E75.3Confident69.7Low113 Ų11385.5 Ų85.553%0.52843%0.433SS..Hα-helixtrans-66.7-42.1177.2-170.660-156.400111.4L168 I169 R175 T176L168-E172 VanDerWaalsContact O-CB 3.29Å; L168-E172 WeakPolarHBondContact O-CB 3.11Å; L168-E172 PolarHBondContact O-N 3.09Å; I169-E172 PolarHBondContact O-N 2.95Å; E172-R175 PolarHBondContact O-N 2.83Å; E172-T176 WeakPolarHBondContact O-CB 3.28Å; E172-T176 WeakPolarHBondContact O-CG2 3.35Å; E172-T176 PolarHBondContact O-N 3.19Å; E172-T176 PolarHBondContact O-OG1 3.38Å
173L72.1Confident71.2Confident14 Ų1481.8 Ų81.87%0.07342%0.415CS..Hα-helixtrans-66-42.6177.8-169.864.9000111.7M125 I169 A170 R175 T176 Q177 G178 L182 L252M125-L173 HydrophobicContact CG-CD2 4.08Å; I169-L173 VanDerWaalsContact O-CB 3.24Å; I169-L173 WeakPolarHBondContact O-CB 3.32Å; I169-L173 PolarHBondContact O-N 2.94Å; A170-L173 PolarHBondContact O-N 2.87Å; L173-R175 VanDerWaalsContact C-N 3.3Å; L173-R175 PolarHBondContact O-N 2.88Å; L173-T176 PolarHBondContact O-N 3.37Å; L173-T176 PolarHBondContact O-OG1 3.37Å; L173-Q177 HydrophobicContact CD1-CB 4.39Å; L173-Q177 HydrophobicContact CD1-CG 4.46Å; L173-Q177 PolarHBondContact O-N 2.85Å; L173-G178 PolarHBondContact O-N 2.82Å; L173-L182 HydrophobicContact CB-CD1 4.39Å; L173-L182 HydrophobicContact CD2-CD1 3.86Å; L173-L182 HydrophobicContact CD2-CG 4.27Å; L173-L182 HydrophobicContact CG-CD1 4Å; L173-L252 HydrophobicContact CD1-CD1 3.78Å
174L78.3Confident72.1Confident81 Ų8175 Ų7542%0.42439%0.391SS..Hα-helixtrans-62.2-37.8173.5-78169.2000112A170 G178 L179 L182A170-L174 WeakPolarHBondContact O-CB 2.82Å; A170-L174 WeakPolarHBondContact O-CG 3.46Å; A170-L174 PolarHBondContact O-N 2.89Å; L174-G178 WeakPolarHBondContact O-CA 3.4Å; L174-G178 PolarHBondContact O-N 3.43Å; L174-G178 VanDerWaalsContact O-N 3.15Å; L174-L179 HydrophobicContact CD2-CG 4.47Å; L174-L182 HydrophobicContact CD2-CD1 3.59Å; L174-L182 HydrophobicContact CD2-CD2 4.09Å; L174-L182 HydrophobicContact CG-CD1 3.78Å; L174-L182 HydrophobicContact CG-CD2 4.4Å
175R78.8Confident72.6Confident207 Ų20773 Ų7378%0.78138%0.381SS*.Hα-helixtrans-73.9-32.1-179.9-167.3179.1-179.9118.60.4112.8R171 E172 L173R171-R175 WeakPolarHBondContact O-CB 3.45Å; R171-R175 PolarHBondContact O-N 3.26Å; E172-R175 PolarHBondContact O-N 2.83Å; L173-R175 VanDerWaalsContact C-N 3.3Å; L173-R175 PolarHBondContact O-N 2.88Å
176T76.9Confident73.2Confident88 Ų8872.8 Ų72.854%0.5438%0.376SS..Hα-helixtrans-93.9-43.2-174.851.80000113.7E172 L173E172-T176 WeakPolarHBondContact O-CB 3.28Å; E172-T176 WeakPolarHBondContact O-CG2 3.35Å; E172-T176 PolarHBondContact O-N 3.19Å; E172-T176 PolarHBondContact O-OG1 3.38Å; L173-T176 PolarHBondContact O-N 3.37Å; L173-T176 PolarHBondContact O-OG1 3.37Å
177Q71.3Confident73.7Confident83 Ų8373.5 Ų73.539%0.38839%0.386SS..Hα-helixtrans-118.61.1-175.2-64.2-166.24.400113.4L173 G181L173-Q177 HydrophobicContact CD1-CB 4.39Å; L173-Q177 HydrophobicContact CD1-CG 4.46Å; L173-Q177 PolarHBondContact O-N 2.85Å; Q177-G181 PolarHBondContact O-N 2.93Å
178G79Confident73.8Confident29 Ų2969 Ų6930%0.29936%0.359SS..Hα-helixtrans62.8-158.4-177.800000113.1L173 L174 A180 G181L173-G178 PolarHBondContact O-N 2.82Å; L174-G178 WeakPolarHBondContact O-CA 3.4Å; L174-G178 PolarHBondContact O-N 3.43Å; L174-G178 VanDerWaalsContact O-N 3.15Å; G178-A180 VanDerWaalsContact C-N 3.28Å; G178-A180 PolarHBondContact O-N 3.21Å; G178-G181 PolarHBondContact O-N 3.5Å
179L75.9Confident73.9Confident125 Ų12564.6 Ų64.665%0.65434%0.336SS*.Hα-helixtrans-64-31.5175.6-81.5133.4000112.6L174 G181 L182 Y183L174-L179 HydrophobicContact CD2-CG 4.47Å; L179-G181 PolarHBondContact O-N 3.37Å; L179-L182 PolarHBondContact O-N 3.32Å; L179-L182 VanDerWaalsContact O-N 3.13Å; L179-Y183 WeakPolarHBondContact O-CD2 3.18Å; L179-Y183 PolarHBondContact O-N 2.9Å
180A72.3Confident74.3Confident79 Ų7964.8 Ų64.865%0.65334%0.337SS*.Hα-helixtrans-62.1-31.2178.200000112.5G178 Y183 K184G178-A180 VanDerWaalsContact C-N 3.28Å; G178-A180 PolarHBondContact O-N 3.21Å; A180-Y183 PolarHBondContact O-N 3.47Å; A180-K184 PolarHBondContact O-N 3.33Å
181G69.5Low74.7Confident1 Ų167 Ų671%0.0135%0.345CS..Hα-helixtrans-63.8-37.3174.100000113.6Q177 G178 L179 Y183 K184Q177-G181 PolarHBondContact O-N 2.93Å; G178-G181 PolarHBondContact O-N 3.5Å; L179-G181 PolarHBondContact O-N 3.37Å; G181-Y183 VanDerWaalsContact C-N 3.35Å; G181-K184 WeakPolarHBondContact O-CB 3.38Å; G181-K184 PolarHBondContact O-N 3.01Å
182L71.4Confident74.9Confident22 Ų2260.1 Ų60.112%0.11532%0.32CS..Hα-helixtrans-71.8-30.8179.9-83.871.4000112.3P122 L173 L174 L179P122-L182 HydrophobicContact CB-CB 4.48Å; P122-L182 HydrophobicContact CB-CD2 4.22Å; L173-L182 HydrophobicContact CB-CD1 4.39Å; L173-L182 HydrophobicContact CD2-CD1 3.86Å; L173-L182 HydrophobicContact CD2-CG 4.27Å; L173-L182 HydrophobicContact CG-CD1 4Å; L174-L182 HydrophobicContact CD2-CD1 3.59Å; L174-L182 HydrophobicContact CD2-CD2 4.09Å; L174-L182 HydrophobicContact CG-CD1 3.78Å; L174-L182 HydrophobicContact CG-CD2 4.4Å; L179-L182 PolarHBondContact O-N 3.32Å; L179-L182 VanDerWaalsContact O-N 3.13Å
183Y74.1Confident75Confident89 Ų8955.7 Ų55.735%0.34930%0.299SS..THydrogen-bonded Turntrans-966.4176.8-69.5-84.9000113.1V118 P122 L179 A180 G181 G185 L186V118-Y183 HydrophobicContact CG1-CE1 4.42Å; V118-Y183 WeakPolarHBondContact O-CE1 3.27Å; P122-Y183 HydrophobicContact CG-CE1 4.22Å; P122-Y183 HydrophobicContact CG-CE2 4.38Å; L179-Y183 WeakPolarHBondContact O-CD2 3.18Å; L179-Y183 PolarHBondContact O-N 2.9Å; A180-Y183 PolarHBondContact O-N 3.47Å; G181-Y183 VanDerWaalsContact C-N 3.35Å; Y183-G185 PolarHBondContact O-N 2.92Å; Y183-G185 VanDerWaalsContact O-N 3.16Å; Y183-L186 HydrophobicContact CD1-CD1 4.36Å; Y183-L186 HydrophobicContact CD1-CD2 4.15Å; Y183-L186 WeakPolarHBondContact O-CB 3.12Å; Y183-L186 PolarHBondContact O-N 3.45Å
184K69.6Low75.4Confident86 Ų8657.4 Ų57.437%0.37431%0.308SS..THydrogen-bonded Turntrans-62121.2177.9-168.3174.8180175.20109.6M125 A180 G181 L252M125-K184 HydrophobicContact CE-CB 3.96Å; M125-K184 WeakPolarHBondContact CE-O 3.23Å; A180-K184 PolarHBondContact O-N 3.33Å; G181-K184 WeakPolarHBondContact O-CB 3.38Å; G181-K184 PolarHBondContact O-N 3.01Å; K184-L252 HydrophobicContact CD-CD2 3.99Å
185G68.8Low75.7Confident14 Ų1455.2 Ų55.214%0.14430%0.299CS..THydrogen-bonded Turntrans86.97.8-174.100000115.1Y183 G187 A188 T189 Q250Y183-G185 PolarHBondContact O-N 2.92Å; Y183-G185 VanDerWaalsContact O-N 3.16Å; G185-G187 VanDerWaalsContact C-N 3.26Å; G185-G187 PolarHBondContact O-N 3.15Å; G185-A188 WeakPolarHBondContact O-CA 3.44Å; G185-A188 WeakPolarHBondContact O-CB 3.45Å; G185-A188 PolarHBondContact O-N 2.88Å; G185-T189 PolarHBondContact O-N 2.96Å; G185-T189 PolarHBondContact O-OG1 3.5Å; G185-Q250 PolarHBondContact O-NE2 2.99Å
186L77.1Confident75.9Confident44 Ų4447.1 Ų47.123%0.2327%0.269CS..Hα-helixtrans-49.6-48.2169.1176.469.1000111.3V117 S121 Y183 A188 T189 L190V117-L186 HydrophobicContact CG1-CD1 3.53Å; S121-L186 WeakPolarHBondContact OG-CD1 3.32Å; Y183-L186 HydrophobicContact CD1-CD1 4.36Å; Y183-L186 HydrophobicContact CD1-CD2 4.15Å; Y183-L186 WeakPolarHBondContact O-CB 3.12Å; Y183-L186 PolarHBondContact O-N 3.45Å; L186-A188 VanDerWaalsContact C-N 3.27Å; L186-A188 PolarHBondContact O-N 3.41Å; L186-T189 WeakPolarHBondContact O-CB 3.36Å; L186-T189 PolarHBondContact O-N 3.29Å; L186-T189 VanDerWaalsContact O-N 3.09Å; L186-L190 HydrophobicContact CG-CD1 4.24Å; L186-L190 WeakPolarHBondContact O-CG 2.91Å; L186-L190 PolarHBondContact O-N 2.95Å
187G76.2Confident75.9Confident41 Ų4143.6 Ų43.642%0.42325%0.249SC..Hα-helixtrans-60.6-3517700000113.2G185 L190 L191G185-G187 VanDerWaalsContact C-N 3.26Å; G185-G187 PolarHBondContact O-N 3.15Å; G187-L190 PolarHBondContact O-N 3.39Å; G187-L191 WeakPolarHBondContact O-CB 3.47Å; G187-L191 PolarHBondContact O-N 3.21Å
188A72.5Confident76.3Confident5 Ų543 Ų434%0.04125%0.247CC..Hα-helixtrans-73.4-31.8175.900000112.1G185 L186 R192 K246 I264G185-A188 WeakPolarHBondContact O-CA 3.44Å; G185-A188 WeakPolarHBondContact O-CB 3.45Å; G185-A188 PolarHBondContact O-N 2.88Å; L186-A188 VanDerWaalsContact C-N 3.27Å; L186-A188 PolarHBondContact O-N 3.41Å; A188-R192 PolarHBondContact O-N 2.88Å; A188-K246 HydrophobicContact CB-CB 3.83Å; A188-K246 HydrophobicContact CB-CG 4.01Å; A188-I264 HydrophobicContact CB-CD1 4.22Å; A188-I264 HydrophobicContact CB-CG1 4.47Å
189T73.8Confident76.6Confident0 Ų044.3 Ų44.30%025%0.247CC..Hα-helixtrans-66.8-46.3170.2-55.20000111.9V117 G185 L186 L191 R192 D193 K246 Q250V117-T189 HydrophobicContact CB-CG2 4.2Å; V117-T189 HydrophobicContact CG1-CG2 3.47Å; V117-T189 VanDerWaalsContact CG1-CG2 3.47Å; V117-T189 HydrophobicContact CG2-CG2 3.66Å; G185-T189 PolarHBondContact O-N 2.96Å; G185-T189 PolarHBondContact O-OG1 3.5Å; L186-T189 WeakPolarHBondContact O-CB 3.36Å; L186-T189 PolarHBondContact O-N 3.29Å; L186-T189 VanDerWaalsContact O-N 3.09Å; T189-L191 VanDerWaalsContact C-N 3.34Å; T189-L191 PolarHBondContact O-N 2.89Å; T189-R192 WeakPolarHBondContact O-CB 3.35Å; T189-R192 PolarHBondContact O-N 3.4Å; T189-R192 VanDerWaalsContact O-N 3.13Å; T189-D193 PolarHBondContact O-N 3.32Å; T189-K246 WeakPolarHBondContact OG1-CE 3.44Å; T189-K246 PolarHBondContact OG1-NZ 3.48Å; T189-Q250 PolarHBondContact OG1-NE2 3.27Å
190L79.5Confident76.9Confident38 Ų3839.3 Ų39.320%0.19922%0.219CC..Hα-helixtrans-62.4-43.2176.9-70.6175000111.6M114 V117 L186 G187 R192 D193 I194M114-L190 HydrophobicContact CB-CD2 4.29Å; M114-L190 HydrophobicContact CG-CD2 3.98Å; V117-L190 HydrophobicContact CB-CD2 3.73Å; V117-L190 HydrophobicContact CG1-CD2 3.59Å; V117-L190 HydrophobicContact CG1-CG 3.81Å; V117-L190 HydrophobicContact CG2-CD2 4.21Å; L186-L190 HydrophobicContact CG-CD1 4.24Å; L186-L190 WeakPolarHBondContact O-CG 2.91Å; L186-L190 PolarHBondContact O-N 2.95Å; G187-L190 PolarHBondContact O-N 3.39Å; L190-R192 PolarHBondContact O-N 3.05Å; L190-R192 VanDerWaalsContact O-N 3.16Å; L190-D193 PolarHBondContact O-N 3.44Å; L190-I194 HydrophobicContact CB-CD1 4.25Å; L190-I194 WeakPolarHBondContact O-CB 3.37Å; L190-I194 WeakPolarHBondContact O-CG1 3.38Å; L190-I194 PolarHBondContact O-N 2.88Å
191L79.9Confident77.2Confident65 Ų6537.2 Ų37.234%0.3420%0.195SC..Hα-helixtrans-59-26.6176.2-176.762.5000112.3G187 T189 P195 L242 I264G187-L191 WeakPolarHBondContact O-CB 3.47Å; G187-L191 PolarHBondContact O-N 3.21Å; T189-L191 VanDerWaalsContact C-N 3.34Å; T189-L191 PolarHBondContact O-N 2.89Å; L191-P195 WeakPolarHBondContact O-CD 3.26Å; L191-P195 WeakPolarHBondContact O-CG 3.38Å; L191-L242 HydrophobicContact CD2-CD2 4.03Å; L191-L242 HydrophobicContact CG-CD1 4.23Å; L191-L242 HydrophobicContact CG-CD2 4.05Å; L191-L242 WeakPolarHBondContact O-CD1 3.41Å; L191-I264 HydrophobicContact CD2-CD1 4.05Å; L191-I264 HydrophobicContact CD2-CG2 3.89Å
192R81Confident77.7Confident38 Ų3838 Ų3814%0.14320%0.201CC..Hα-helixtrans-84.7-50.3174.8-176.6-161.366.5177.50.8112.2E124 A188 T189 L190 P195 F196 V239 D243E124-R192 IonicContact OE1-NH2 2.72Å; A188-R192 PolarHBondContact O-N 2.88Å; T189-R192 WeakPolarHBondContact O-CB 3.35Å; T189-R192 PolarHBondContact O-N 3.4Å; T189-R192 VanDerWaalsContact O-N 3.13Å; L190-R192 PolarHBondContact O-N 3.05Å; L190-R192 VanDerWaalsContact O-N 3.16Å; R192-P195 WeakPolarHBondContact O-CD 3.33Å; R192-F196 WeakPolarHBondContact O-CB 3.39Å; R192-F196 PolarHBondContact O-N 3.43Å; R192-F196 VanDerWaalsContact O-N 3.13Å; R192-V239 HydrophobicContact CB-CG1 4.21Å; R192-V239 HydrophobicContact CG-CG1 3.33Å; R192-V239 WeakPolarHBondContact O-CG1 3.22Å; R192-D243 WeakPolarHBondContact CD-OD1 3.48Å; R192-D243 WeakPolarHBondContact CD-OD2 3.43Å; R192-D243 VanDerWaalsContact CG-OD2 3.32Å; R192-D243 WeakPolarHBondContact CG-OD2 3.31Å; R192-D243 IonicContact NE-OD1 2.98Å; R192-D243 IonicContact NH1-OD1 2.69Å; R192-D243 PolarHBondContact NH1-OD1 3.36Å
193D76.9Confident78.2Confident20 Ų2039.4 Ų39.411%0.10721%0.208CC..Hα-helixtrans-70.8-35.3-168.7-75.212.9000111.7V117 T189 L190 F196 S197V117-D193 HydrophobicContact CG2-CB 4.08Å; V117-D193 WeakPolarHBondContact CG2-OD2 3.41Å; T189-D193 PolarHBondContact O-N 3.32Å; L190-D193 PolarHBondContact O-N 3.44Å; D193-F196 PolarHBondContact O-N 3.37Å; D193-S197 PolarHBondContact O-N 3.23Å; D193-S197 PolarHBondContact O-OG 2.97Å
194I80.8Confident78.5Confident51 Ų5136.8 Ų36.826%0.26220%0.198SC..Hα-helixtrans-65.4-54.4179.3-66.2165.3000111.2M114 L190 F196 S197 I198M114-I194 HydrophobicContact CG-CD1 4.35Å; L190-I194 HydrophobicContact CB-CD1 4.25Å; L190-I194 WeakPolarHBondContact O-CB 3.37Å; L190-I194 WeakPolarHBondContact O-CG1 3.38Å; L190-I194 PolarHBondContact O-N 2.88Å; I194-F196 VanDerWaalsContact C-N 3.27Å; I194-F196 PolarHBondContact O-N 3.05Å; I194-S197 PolarHBondContact O-N 3.46Å; I194-I198 HydrophobicContact CG2-CD1 3.7Å; I194-I198 HydrophobicContact CG2-CG1 4.49Å; I194-I198 VanDerWaalsContact O-CG1 3.29Å; I194-I198 WeakPolarHBondContact O-CG1 3.29Å; I194-I198 PolarHBondContact O-N 3.49Å
195P84.6Confident78.8Confident34 Ų3434.4 Ų34.422%0.22119%0.194CC..Hα-helixtrans-60.7-34.2174.6-27.939.2000113.6L191 R192 I198 I199 V239 L242L191-P195 WeakPolarHBondContact O-CD 3.26Å; L191-P195 WeakPolarHBondContact O-CG 3.38Å; R192-P195 WeakPolarHBondContact O-CD 3.33Å; P195-I198 PolarHBondContact O-N 2.89Å; P195-I199 VanDerWaalsContact O-CG1 3.28Å; P195-I199 WeakPolarHBondContact O-CG1 3.36Å; P195-I199 PolarHBondContact O-N 2.95Å; P195-V239 HydrophobicContact CB-CG2 4.07Å; P195-L242 HydrophobicContact CB-CD1 4.22Å; P195-L242 HydrophobicContact CG-CD1 3.84Å
196F83.3Confident79.4Confident37 Ų3738.6 Ų38.616%0.16221%0.214CC..Hα-helixtrans-60.2-49.9175.8-177.5-91.7000111.2R192 D193 I194 I199 Y200 A235 V239 F295R192-F196 WeakPolarHBondContact O-CB 3.39Å; R192-F196 PolarHBondContact O-N 3.43Å; R192-F196 VanDerWaalsContact O-N 3.13Å; D193-F196 PolarHBondContact O-N 3.37Å; I194-F196 VanDerWaalsContact C-N 3.27Å; I194-F196 PolarHBondContact O-N 3.05Å; F196-I199 PolarHBondContact O-N 3.41Å; F196-Y200 HydrophobicContact CE1-CG 4.2Å; F196-Y200 HydrophobicContact CZ-CD2 4.28Å; F196-Y200 HydrophobicContact CZ-CG 4.38Å; F196-Y200 WeakPolarHBondContact O-CB 3.38Å; F196-Y200 PolarHBondContact O-N 3.46Å; F196-A235 HydrophobicContact CD2-CB 3.83Å; F196-A235 HydrophobicContact CE2-CB 3.66Å; F196-A235 HydrophobicContact CZ-CB 4.32Å; F196-V239 HydrophobicContact CB-CG1 4.5Å; F196-V239 HydrophobicContact CB-CG2 4.05Å; F196-F295 HydrophobicContact CE1-CZ 4.14Å; F196-F295 AromaticContact CZ-CE2 3.89Å; F196-F295 HydrophobicContact CZ-CE2 3.89Å; F196-F295 AromaticContact CZ-CZ 3.78Å; F196-F295 HydrophobicContact CZ-CZ 3.78Å
197S76.1Confident79.6Confident15 Ų1538.6 Ų38.611%0.10521%0.214CC..Hα-helixtrans-62.7-42.4177-67.40000112.3D193 I194 I199 Y200 F201D193-S197 PolarHBondContact O-N 3.23Å; D193-S197 PolarHBondContact O-OG 2.97Å; I194-S197 PolarHBondContact O-N 3.46Å; S197-I199 VanDerWaalsContact C-N 3.25Å; S197-I199 PolarHBondContact O-N 2.97Å; S197-Y200 PolarHBondContact O-N 3.41Å; S197-F201 VanDerWaalsContact O-CD2 3.29Å; S197-F201 WeakPolarHBondContact O-CD2 3.19Å; S197-F201 PolarHBondContact O-N 3.07Å; S197-F201 VanDerWaalsContact O-N 3.17Å
198I80.9Confident79.6Confident71 Ų7138.6 Ų38.636%0.36420%0.204SC..Hα-helixtrans-59.5-35.1178.6-74170.4000112M106 I194 P195 P202M106-I198 HydrophobicContact CE-CB 4.03Å; M106-I198 HydrophobicContact CE-CG1 4.09Å; M106-I198 HydrophobicContact CE-CG2 3.6Å; I194-I198 HydrophobicContact CG2-CD1 3.7Å; I194-I198 HydrophobicContact CG2-CG1 4.49Å; I194-I198 VanDerWaalsContact O-CG1 3.29Å; I194-I198 WeakPolarHBondContact O-CG1 3.29Å; I194-I198 PolarHBondContact O-N 3.49Å; P195-I198 PolarHBondContact O-N 2.89Å; I198-P202 WeakPolarHBondContact O-CD 3.3Å; I198-P202 WeakPolarHBondContact O-CG 3.43Å
199I85.3Confident79.9Confident55 Ų5545.1 Ų45.128%0.28223%0.233SC..Hα-helixtrans-88.4-43.4-179.3-62.2167.7000110.7P195 F196 S197 L203 A235 A238 V239P195-I199 VanDerWaalsContact O-CG1 3.28Å; P195-I199 WeakPolarHBondContact O-CG1 3.36Å; P195-I199 PolarHBondContact O-N 2.95Å; F196-I199 PolarHBondContact O-N 3.41Å; S197-I199 VanDerWaalsContact C-N 3.25Å; S197-I199 PolarHBondContact O-N 2.97Å; I199-L203 WeakPolarHBondContact O-CB 3.3Å; I199-L203 PolarHBondContact O-N 2.84Å; I199-A235 HydrophobicContact CB-CB 4.18Å; I199-A235 HydrophobicContact CG2-CB 3.92Å; I199-A238 HydrophobicContact CD1-CB 3.57Å; I199-V239 HydrophobicContact CD1-CG2 4.38Å
200Y82Confident80.1Confident20 Ų2051.7 Ų51.78%0.07827%0.268CS..Hα-helixtrans-65.6-53.3-173174.5-97.2000112.8F196 S197 L203 F204 A231 F295F196-Y200 HydrophobicContact CE1-CG 4.2Å; F196-Y200 HydrophobicContact CZ-CD2 4.28Å; F196-Y200 HydrophobicContact CZ-CG 4.38Å; F196-Y200 WeakPolarHBondContact O-CB 3.38Å; F196-Y200 PolarHBondContact O-N 3.46Å; S197-Y200 PolarHBondContact O-N 3.41Å; Y200-L203 PolarHBondContact O-N 2.92Å; Y200-F204 HydrophobicContact CE1-CB 4.46Å; Y200-F204 VanDerWaalsContact O-CB 3.24Å; Y200-F204 WeakPolarHBondContact O-CB 3.19Å; Y200-F204 PolarHBondContact O-N 2.87Å; Y200-A231 HydrophobicContact CD2-CB 4.16Å; Y200-A231 HydrophobicContact CE2-CB 4.26Å; Y200-F295 HydrophobicContact CD2-CZ 4.48Å; Y200-F295 HydrophobicContact CE2-CD1 4.37Å; Y200-F295 HydrophobicContact CE2-CE1 4.08Å; Y200-F295 HydrophobicContact CE2-CE2 4.28Å; Y200-F295 HydrophobicContact CE2-CZ 4.04Å; Y200-F295 AromaticContact CZ-CE1 3.94Å
201F78.3Confident79.5Confident35 Ų3550.7 Ų50.715%0.15427%0.266CS..Hα-helixtrans-62.7-47.6-172.6-72.9-68.9000112.7S197 L203 F204 A205S197-F201 VanDerWaalsContact O-CD2 3.29Å; S197-F201 WeakPolarHBondContact O-CD2 3.19Å; S197-F201 PolarHBondContact O-N 3.07Å; S197-F201 VanDerWaalsContact O-N 3.17Å; F201-L203 PolarHBondContact O-N 2.86Å; F201-F204 PolarHBondContact O-N 3.47Å; F201-A205 VanDerWaalsContact O-CB 3.31Å; F201-A205 WeakPolarHBondContact O-CB 3.49Å; F201-A205 PolarHBondContact O-N 2.88Å
202P80.3Confident79Confident19 Ų1952.4 Ų52.412%0.12327%0.272CS..Hα-helixtrans-63.8-40.6176.1-24.236.2000114.3L102 M106 I198 A205 N206L102-P202 HydrophobicContact CD1-CB 3.76Å; L102-P202 HydrophobicContact CD1-CG 3.86Å; L102-P202 HydrophobicContact CD2-CB 4.11Å; L102-P202 HydrophobicContact CD2-CG 4.49Å; L102-P202 HydrophobicContact CG-CB 4.33Å; L102-P202 HydrophobicContact CG-CG 4.32Å; M106-P202 HydrophobicContact CE-CG 4.03Å; M106-P202 HydrophobicContact CG-CG 3.89Å; M106-P202 HydrophobicContact SD-CG 3.69Å; I198-P202 WeakPolarHBondContact O-CD 3.3Å; I198-P202 WeakPolarHBondContact O-CG 3.43Å; P202-A205 PolarHBondContact O-N 3.41Å; P202-N206 WeakPolarHBondContact O-CB 3.28Å; P202-N206 PolarHBondContact O-N 3.01Å; P202-N206 PolarHBondContact O-ND2 3.16Å; P202-N206 VanDerWaalsContact O-ND2 3.1Å
203L81.8Confident78.2Confident50 Ų5055.6 Ų55.626%0.26229%0.291SS..Hα-helixtrans-68.6-41.7-179-173.857.8000110.8I199 Y200 F201 L207 A231 V234I199-L203 WeakPolarHBondContact O-CB 3.3Å; I199-L203 PolarHBondContact O-N 2.84Å; Y200-L203 PolarHBondContact O-N 2.92Å; F201-L203 PolarHBondContact O-N 2.86Å; L203-L207 HydrophobicContact CD1-CD1 4.03Å; L203-L207 HydrophobicContact CD1-CG 4.21Å; L203-L207 HydrophobicContact CG-CD1 3.97Å; L203-L207 VanDerWaalsContact O-CB 3.28Å; L203-L207 WeakPolarHBondContact O-CB 3.41Å; L203-L207 WeakPolarHBondContact O-CG 3.49Å; L203-L207 PolarHBondContact O-N 3.28Å; L203-A231 HydrophobicContact CB-CB 4.1Å; L203-A231 HydrophobicContact CD2-CB 4.16Å; L203-A231 HydrophobicContact CG-CB 3.9Å; L203-V234 HydrophobicContact CD2-CB 3.6Å; L203-V234 HydrophobicContact CD2-CG1 3.63Å; L203-V234 HydrophobicContact CD2-CG2 4.13Å
204F80.6Confident77.3Confident35 Ų3563 Ų6315%0.15433%0.326CS..Hα-helixtrans-62.9-46.6173.7178.6-104.8000111.6Y200 F201 N206 L207 N208 S227 A231Y200-F204 HydrophobicContact CE1-CB 4.46Å; Y200-F204 VanDerWaalsContact O-CB 3.24Å; Y200-F204 WeakPolarHBondContact O-CB 3.19Å; Y200-F204 PolarHBondContact O-N 2.87Å; F201-F204 PolarHBondContact O-N 3.47Å; F204-N206 PolarHBondContact O-N 3.43Å; F204-L207 PolarHBondContact O-N 2.93Å; F204-N208 HydrophobicContact CZ-CB 4.4Å; F204-N208 WeakPolarHBondContact O-CB 3.27Å; F204-N208 PolarHBondContact O-N 3.47Å; F204-S227 WeakPolarHBondContact CE2-OG 3.27Å; F204-A231 HydrophobicContact CB-CB 3.96Å
205A75.6Confident76Confident35 Ų3569.1 Ų69.129%0.28936%0.357SS..Hα-helixtrans-60.4-46.9179.800000112F201 P202 N208 H209F201-A205 VanDerWaalsContact O-CB 3.31Å; F201-A205 WeakPolarHBondContact O-CB 3.49Å; F201-A205 PolarHBondContact O-N 2.88Å; P202-A205 PolarHBondContact O-N 3.41Å; A205-N208 PolarHBondContact O-N 3.4Å; A205-H209 WeakPolarHBondContact O-CB 3.38Å; A205-H209 PolarHBondContact O-N 3.43Å
206N81.8Confident74.7Confident102 Ų10271 Ų7155%0.54538%0.376SS..Hα-helixtrans-64.4-48.3177.6-78.6-43.6000111.9P202 F204 N208 H209 L210P202-N206 WeakPolarHBondContact O-CB 3.28Å; P202-N206 PolarHBondContact O-N 3.01Å; P202-N206 PolarHBondContact O-ND2 3.16Å; P202-N206 VanDerWaalsContact O-ND2 3.1Å; F204-N206 PolarHBondContact O-N 3.43Å; N206-N208 VanDerWaalsContact C-N 3.32Å; N206-N208 PolarHBondContact O-N 3.3Å; N206-H209 PolarHBondContact O-N 3.13Å; N206-L210 WeakPolarHBondContact O-CG 3.49Å; N206-L210 PolarHBondContact O-N 3.49Å
207L81.2Confident73.5Confident45 Ų4571.5 Ų71.524%0.23639%0.392CS..Hα-helixtrans-63.9-39.4178.9-71.2174.2000111.5L203 F204 L210 H223 V230 A231L203-L207 HydrophobicContact CD1-CD1 4.03Å; L203-L207 HydrophobicContact CD1-CG 4.21Å; L203-L207 HydrophobicContact CG-CD1 3.97Å; L203-L207 VanDerWaalsContact O-CB 3.28Å; L203-L207 WeakPolarHBondContact O-CB 3.41Å; L203-L207 WeakPolarHBondContact O-CG 3.49Å; L203-L207 PolarHBondContact O-N 3.28Å; F204-L207 PolarHBondContact O-N 2.93Å; L207-L210 HydrophobicContact CD2-CD1 4.5Å; L207-L210 PolarHBondContact O-N 3.49Å; L207-H223 PolarHBondContact O-CE1 3.31Å; L207-V230 HydrophobicContact CD1-CB 4.03Å; L207-V230 HydrophobicContact CD1-CG1 3.73Å; L207-A231 HydrophobicContact CD1-CB 4.32Å
208N76.1Confident72.7Confident40 Ų4078.5 Ų78.521%0.21442%0.42CS..Hα-helixtrans-72.3-31.7-179.2-156.639.4000112.6F204 A205 N206 L210 G211 A219 S224F204-N208 HydrophobicContact CZ-CB 4.4Å; F204-N208 WeakPolarHBondContact O-CB 3.27Å; F204-N208 PolarHBondContact O-N 3.47Å; A205-N208 PolarHBondContact O-N 3.4Å; N206-N208 VanDerWaalsContact C-N 3.32Å; N206-N208 PolarHBondContact O-N 3.3Å; N208-L210 VanDerWaalsContact C-N 3.3Å; N208-L210 PolarHBondContact O-N 2.98Å; N208-G211 PolarHBondContact O-N 2.72Å; N208-A219 WeakPolarHBondContact OD1-CB 3.43Å; N208-S224 WeakPolarHBondContact OD1-CA 3.39Å; N208-S224 PolarHBondContact OD1-OG 3.16Å
209H77.4Confident71.7Confident142 Ų14275.9 Ų75.966%0.65741%0.409SS*.Hα-helixtrans-64.5-33.6175.1-170.7-109.4000112.3A205 N206 G211 F212A205-H209 WeakPolarHBondContact O-CB 3.38Å; A205-H209 PolarHBondContact O-N 3.43Å; N206-H209 PolarHBondContact O-N 3.13Å; H209-G211 PolarHBondContact O-N 3.32Å; H209-F212 VanDerWaalsContact O-CB 3.27Å; H209-F212 WeakPolarHBondContact O-CB 3.42Å; H209-F212 PolarHBondContact O-N 3Å
210L78.6Confident71.2Confident138 Ų13876.9 Ų76.972%0.72342%0.421SS*.Hα-helixtrans-65.1-23.9177.8-67.4171000113.9N206 L207 N208N206-L210 WeakPolarHBondContact O-CG 3.49Å; N206-L210 PolarHBondContact O-N 3.49Å; L207-L210 HydrophobicContact CD2-CD1 4.5Å; L207-L210 PolarHBondContact O-N 3.49Å; N208-L210 VanDerWaalsContact C-N 3.3Å; N208-L210 PolarHBondContact O-N 2.98Å
211G66.9Low70.8Confident17 Ų1779.1 Ų79.118%0.17543%0.431CS..THydrogen-bonded Turntrans-10516.5176.400000113.9N208 H209 N213 A219 H223N208-G211 PolarHBondContact O-N 2.72Å; H209-G211 PolarHBondContact O-N 3.32Å; G211-N213 PolarHBondContact O-N 3.09Å; G211-A219 WeakPolarHBondContact O-CA 3.08Å; G211-H223 WeakPolarHBondContact CA-CE1 3.36Å; G211-H223 WeakPolarHBondContact CA-ND1 3.16Å; G211-H223 WeakPolarHBondContact CA-NE2 3.41Å; G211-H223 PolarHBondContact N-CE1 2.94Å; G211-H223 VanDerWaalsContact N-CE1 3.26Å
212F70.2Confident70.6Confident102 Ų10280.2 Ų80.245%0.44745%0.447SS..EExtended strand (participates in β ladder)trans-70.2121.1175.7-168.5-95.9000109.2H209 G217H209-F212 VanDerWaalsContact O-CB 3.27Å; H209-F212 WeakPolarHBondContact O-CB 3.42Å; H209-F212 PolarHBondContact O-N 3Å; F212-G217 WeakPolarHBondContact CE2-O 3.32Å
213N63.8Low70.6Confident104 Ų10482.8 Ų82.856%0.55646%0.457SS*.EExtended strand (participates in β ladder)trans-107114.2-179.9-135.6-4.2000108.5G211 L215 A216 G217G211-N213 PolarHBondContact O-N 3.09Å; N213-L215 PolarHBondContact O-N 3.33Å; N213-A216 PolarHBondContact O-N 3.34Å; N213-G217 PolarHBondContact O-N 3.24Å
214E57Low70.4Confident177 Ų17781.2 Ų81.283%0.82745%0.45SS*.THydrogen-bonded Turntrans-60.8-30.7-170.8-138.7174.7177.600112.6A216E214-A216 PolarHBondContact O-N 3.21Å
215L53.6Low70.3Confident178 Ų17883 Ų8393%0.93246%0.458SS*.THydrogen-bonded Turntrans-68.7-24.5176-87.5119.2000115N213N213-L215 PolarHBondContact O-N 3.33Å
216A57.3Low70.7Confident73 Ų7385.3 Ų85.360%0.60347%0.468SS*.THydrogen-bonded Turntrans-106.6-7.6-176.400000113.2N213 E214 K218N213-A216 PolarHBondContact O-N 3.34Å; E214-A216 PolarHBondContact O-N 3.21Å; A216-K218 PolarHBondContact O-N 2.99Å
217G59.3Low70.6Confident48 Ų4880.6 Ų80.650%0.49544%0.443SS..THydrogen-bonded Turntrans62.63-176.600000115.3F212 N213F212-G217 WeakPolarHBondContact CE2-O 3.32Å; N213-G217 PolarHBondContact O-N 3.24Å
218K58Low70.6Confident163 Ų16378.5 Ų78.571%0.70943%0.433SS*.EExtended strand (participates in β ladder)trans-150.3152-179.2-65.4-176.6-177.4172.30110A216A216-K218 PolarHBondContact O-N 2.99Å
219A61.6Low70.8Confident16 Ų1677.5 Ų77.513%0.13243%0.429CS..EExtended strand (participates in β ladder)trans-65.1142.2169.300000110.3N208 G211N208-A219 WeakPolarHBondContact OD1-CB 3.43Å; G211-A219 WeakPolarHBondContact O-CA 3.08Å
220S74.4Confident71.2Confident75 Ų7574 Ų7452%0.52442%0.417SS..  trans-55.2143174.4178.60000110.2A222 H223 S224S220-A222 PolarHBondContact O-N 3.15Å; S220-H223 WeakPolarHBondContact O-CA 3.48Å; S220-H223 WeakPolarHBondContact O-CB 3.01Å; S220-H223 PolarHBondContact O-N 3.24Å; S220-S224 PolarHBondContact O-N 3.35Å
221F72.5Confident71.4Confident67 Ų6767.4 Ų67.429%0.29438%0.382SS..Hα-helixtrans-51.2-44.6179.7171-102.1000111.7H223 S224 F225 Q299 F303F221-H223 VanDerWaalsContact C-N 3.26Å; F221-H223 PolarHBondContact O-N 2.82Å; F221-S224 PolarHBondContact O-N 2.91Å; F221-F225 HydrophobicContact CZ-CD2 4.2Å; F221-F225 VanDerWaalsContact O-CB 3.23Å; F221-F225 WeakPolarHBondContact O-CB 3.44Å; F221-F225 PolarHBondContact O-N 2.87Å; F221-Q299 HydrophobicContact CE2-CB 4.29Å; F221-F303 HydrophobicContact CB-CD2 4.11Å; F221-F303 HydrophobicContact CB-CE1 4.46Å; F221-F303 HydrophobicContact CB-CE2 3.98Å; F221-F303 HydrophobicContact CB-CG 4.4Å; F221-F303 HydrophobicContact CB-CZ 4.17Å; F221-F303 HydrophobicContact CD2-CB 3.56Å; F221-F303 AromaticContact CD2-CD1 3.98Å; F221-F303 HydrophobicContact CD2-CD1 3.98Å; F221-F303 AromaticContact CD2-CD2 3.75Å; F221-F303 HydrophobicContact CD2-CD2 3.75Å; F221-F303 HydrophobicContact CD2-CE2 4.46Å; F221-F303 AromaticContact CD2-CG 3.47Å; F221-F303 HydrophobicContact CD2-CG 3.47Å; F221-F303 VanDerWaalsContact CD2-CG 3.47Å; F221-F303 HydrophobicContact CE2-CB 3.64Å; F221-F303 HydrophobicContact CE2-CD1 4.45Å; F221-F303 HydrophobicContact CE2-CG 4.02Å; F221-F303 HydrophobicContact CG-CD1 4.22Å; F221-F303 HydrophobicContact CG-CD2 4.24Å; F221-F303 HydrophobicContact CG-CE1 4.5Å; F221-F303 HydrophobicContact CG-CG 4.08Å
222A75.8Confident72.2Confident58 Ų5866.6 Ų66.648%0.47937%0.374SS..Hα-helixtrans-60.5-37177.800000112.1S220 F225 V226S220-A222 PolarHBondContact O-N 3.15Å; A222-F225 PolarHBondContact O-N 2.65Å; A222-V226 WeakPolarHBondContact O-CB 3.5Å; A222-V226 VanDerWaalsContact O-CG2 3.25Å; A222-V226 WeakPolarHBondContact O-CG2 3.05Å; A222-V226 PolarHBondContact O-N 2.95Å
223H80.1Confident72.8Confident73 Ų7363.1 Ų63.134%0.33836%0.362SS..Hα-helixtrans-72.4-42.8178.6-161.3-74.4000112.1L207 G211 S220 F221 F225 V226 S227L207-H223 PolarHBondContact O-CE1 3.31Å; G211-H223 WeakPolarHBondContact CA-CE1 3.36Å; G211-H223 WeakPolarHBondContact CA-ND1 3.16Å; G211-H223 WeakPolarHBondContact CA-NE2 3.41Å; G211-H223 PolarHBondContact N-CE1 2.94Å; G211-H223 VanDerWaalsContact N-CE1 3.26Å; S220-H223 WeakPolarHBondContact O-CA 3.48Å; S220-H223 WeakPolarHBondContact O-CB 3.01Å; S220-H223 PolarHBondContact O-N 3.24Å; F221-H223 VanDerWaalsContact C-N 3.26Å; F221-H223 PolarHBondContact O-N 2.82Å; H223-F225 VanDerWaalsContact C-N 3.28Å; H223-F225 PolarHBondContact O-N 2.81Å; H223-V226 PolarHBondContact O-N 2.99Å; H223-S227 VanDerWaalsContact O-CB 3.3Å; H223-S227 WeakPolarHBondContact O-CB 3.36Å; H223-S227 PolarHBondContact O-N 2.96Å; H223-S227 PolarHBondContact O-OG 3.35Å; H223-S227 VanDerWaalsContact O-OG 3.05Å
224S76Confident74Confident17 Ų1761.7 Ų61.712%0.11936%0.357CS..Hα-helixtrans-63.9-34.5174-650000112.1N208 S220 F221 S227 G228N208-S224 WeakPolarHBondContact OD1-CA 3.39Å; N208-S224 PolarHBondContact OD1-OG 3.16Å; S220-S224 PolarHBondContact O-N 3.35Å; F221-S224 PolarHBondContact O-N 2.91Å; S224-S227 WeakPolarHBondContact CA-OG 3.46Å; S224-S227 PolarHBondContact O-OG 3Å; S224-G228 PolarHBondContact O-N 2.66Å
225F79.7Confident75.3Confident74 Ų7453.2 Ų53.233%0.32532%0.318SS..Hα-helixtrans-67.7-49.2175.3177.2-81.8000111.5F221 A222 H223 G228 C229 G296F221-F225 HydrophobicContact CZ-CD2 4.2Å; F221-F225 VanDerWaalsContact O-CB 3.23Å; F221-F225 WeakPolarHBondContact O-CB 3.44Å; F221-F225 PolarHBondContact O-N 2.87Å; A222-F225 PolarHBondContact O-N 2.65Å; H223-F225 VanDerWaalsContact C-N 3.28Å; H223-F225 PolarHBondContact O-N 2.81Å; F225-G228 PolarHBondContact O-N 2.58Å; F225-C229 VanDerWaalsContact CE1-SG 3.6Å; F225-C229 PolarHBondContact O-N 3.33Å; F225-C229 PolarHBondContact O-SG 2.85Å; F225-G296 WeakPolarHBondContact CD2-O 3.5Å; F225-G296 WeakPolarHBondContact CE2-O 3.32Å
226V82.8Confident76.6Confident82 Ų8244.8 Ų44.850%0.49727%0.273SS..Hα-helixtrans-66.8-42.6-179.7171.30000110.6A222 H223 G228 C229 V230A222-V226 WeakPolarHBondContact O-CB 3.5Å; A222-V226 VanDerWaalsContact O-CG2 3.25Å; A222-V226 WeakPolarHBondContact O-CG2 3.05Å; A222-V226 PolarHBondContact O-N 2.95Å; H223-V226 PolarHBondContact O-N 2.99Å; V226-G228 VanDerWaalsContact C-N 3.33Å; V226-G228 PolarHBondContact O-N 3.36Å; V226-C229 PolarHBondContact O-N 3.37Å; V226-V230 HydrophobicContact CG1-CG2 4.24Å; V226-V230 WeakPolarHBondContact O-CB 3.35Å; V226-V230 VanDerWaalsContact O-CG2 3.3Å; V226-V230 WeakPolarHBondContact O-CG2 3.34Å; V226-V230 PolarHBondContact O-N 2.91Å
227S81Confident78Confident4 Ų444 Ų443%0.02826%0.261CS..Hα-helixtrans-61.1-41.517666.10000111.7F204 H223 S224 V230 A231F204-S227 WeakPolarHBondContact CE2-OG 3.27Å; H223-S227 VanDerWaalsContact O-CB 3.3Å; H223-S227 WeakPolarHBondContact O-CB 3.36Å; H223-S227 PolarHBondContact O-N 2.96Å; H223-S227 PolarHBondContact O-OG 3.35Å; H223-S227 VanDerWaalsContact O-OG 3.05Å; S224-S227 WeakPolarHBondContact CA-OG 3.46Å; S224-S227 PolarHBondContact O-OG 3Å; S227-V230 PolarHBondContact O-N 3.16Å; S227-A231 WeakPolarHBondContact O-CB 3.14Å; S227-A231 PolarHBondContact O-N 3.35Å
228G79.6Confident79.3Confident1 Ų144.3 Ų44.31%0.0126%0.259CS..Hα-helixtrans-62-4517300000113.2S224 F225 V226 G232S224-G228 PolarHBondContact O-N 2.66Å; F225-G228 PolarHBondContact O-N 2.58Å; V226-G228 VanDerWaalsContact C-N 3.33Å; V226-G228 PolarHBondContact O-N 3.36Å; G228-G232 WeakPolarHBondContact O-CA 3.17Å; G228-G232 PolarHBondContact O-N 2.87Å
229C81.4Confident80.7Confident19 Ų1936.6 Ų36.613%0.12823%0.225CC..Hα-helixtrans-62.6-44.9177-70.70000112.3F225 V226 S233 A292F225-C229 VanDerWaalsContact CE1-SG 3.6Å; F225-C229 PolarHBondContact O-N 3.33Å; F225-C229 PolarHBondContact O-SG 2.85Å; V226-C229 PolarHBondContact O-N 3.37Å; C229-S233 VanDerWaalsContact O-CB 3.27Å; C229-S233 WeakPolarHBondContact O-CB 3.46Å; C229-S233 PolarHBondContact O-N 3.06Å; C229-S233 PolarHBondContact O-OG 3.49Å; C229-A292 HydrophobicContact CB-CB 4.21Å; C229-A292 PolarHBondContact SG-O 3.41Å; C229-A292 VanDerWaalsContact SG-O 3.37Å
230V86.2Confident81.7Confident68 Ų6836 Ų3641%0.41222%0.22SC..Hα-helixtrans-68.1-51-179.9173.30000110.3L207 V226 S227 G232 S233 V234L207-V230 HydrophobicContact CD1-CB 4.03Å; L207-V230 HydrophobicContact CD1-CG1 3.73Å; V226-V230 HydrophobicContact CG1-CG2 4.24Å; V226-V230 WeakPolarHBondContact O-CB 3.35Å; V226-V230 VanDerWaalsContact O-CG2 3.3Å; V226-V230 WeakPolarHBondContact O-CG2 3.34Å; V226-V230 PolarHBondContact O-N 2.91Å; S227-V230 PolarHBondContact O-N 3.16Å; V230-G232 VanDerWaalsContact C-N 3.34Å; V230-G232 PolarHBondContact O-N 3.05Å; V230-S233 PolarHBondContact O-N 3.3Å; V230-V234 WeakPolarHBondContact O-CG2 3.16Å; V230-V234 PolarHBondContact O-N 3.02Å
231A83.1Confident82.1Confident0 Ų034.3 Ų34.30%021%0.207CC..Hα-helixtrans-60.2-44.6178.800000111.8Y200 L203 F204 L207 S227 S233 V234 A235Y200-A231 HydrophobicContact CD2-CB 4.16Å; Y200-A231 HydrophobicContact CE2-CB 4.26Å; L203-A231 HydrophobicContact CB-CB 4.1Å; L203-A231 HydrophobicContact CD2-CB 4.16Å; L203-A231 HydrophobicContact CG-CB 3.9Å; F204-A231 HydrophobicContact CB-CB 3.96Å; L207-A231 HydrophobicContact CD1-CB 4.32Å; S227-A231 WeakPolarHBondContact O-CB 3.14Å; S227-A231 PolarHBondContact O-N 3.35Å; A231-S233 PolarHBondContact O-N 3.45Å; A231-V234 PolarHBondContact O-N 3.43Å; A231-A235 VanDerWaalsContact O-CB 3.28Å; A231-A235 WeakPolarHBondContact O-CB 3.14Å; A231-A235 PolarHBondContact O-N 3.14Å
232G82.4Confident82.7Confident0 Ų033 Ų330%020%0.203CC..Hα-helixtrans-61.8-41.4176.600000112.7G228 V230 A236G228-G232 WeakPolarHBondContact O-CA 3.17Å; G228-G232 PolarHBondContact O-N 2.87Å; V230-G232 VanDerWaalsContact C-N 3.34Å; V230-G232 PolarHBondContact O-N 3.05Å; G232-A236 WeakPolarHBondContact O-CB 3.45Å; G232-A236 PolarHBondContact O-N 3.08Å
233S83.6Confident82.7Confident29 Ų2931 Ų3120%0.20318%0.184CC..Hα-helixtrans-67.4-44.7178.3-61.90000112.2C229 V230 A231 A236 V237C229-S233 VanDerWaalsContact O-CB 3.27Å; C229-S233 WeakPolarHBondContact O-CB 3.46Å; C229-S233 PolarHBondContact O-N 3.06Å; C229-S233 PolarHBondContact O-OG 3.49Å; V230-S233 PolarHBondContact O-N 3.3Å; A231-S233 PolarHBondContact O-N 3.45Å; S233-A236 WeakPolarHBondContact O-CB 3.48Å; S233-A236 PolarHBondContact O-N 3.16Å; S233-V237 WeakPolarHBondContact O-CG2 3.29Å; S233-V237 PolarHBondContact O-N 3.4Å
234V87.9Confident82.5Confident73 Ų7328.3 Ų28.344%0.44217%0.173SC..Hα-helixtrans-64.3-47.1178.2173.20000110.6L203 V230 A231 A236 V237 A238L203-V234 HydrophobicContact CD2-CB 3.6Å; L203-V234 HydrophobicContact CD2-CG1 3.63Å; L203-V234 HydrophobicContact CD2-CG2 4.13Å; V230-V234 WeakPolarHBondContact O-CG2 3.16Å; V230-V234 PolarHBondContact O-N 3.02Å; A231-V234 PolarHBondContact O-N 3.43Å; V234-A236 VanDerWaalsContact C-N 3.31Å; V234-A236 PolarHBondContact O-N 2.89Å; V234-V237 PolarHBondContact O-N 3.13Å; V234-A238 WeakPolarHBondContact O-CB 3.49Å; V234-A238 PolarHBondContact O-N 3.25Å
235A84.6Confident82.6Confident0 Ų028 Ų280%017%0.17CC..Hα-helixtrans-61.3-40.5175.600000111.7F196 I199 A231 V237 A238 V239F196-A235 HydrophobicContact CD2-CB 3.83Å; F196-A235 HydrophobicContact CE2-CB 3.66Å; F196-A235 HydrophobicContact CZ-CB 4.32Å; I199-A235 HydrophobicContact CB-CB 4.18Å; I199-A235 HydrophobicContact CG2-CB 3.92Å; A231-A235 VanDerWaalsContact O-CB 3.28Å; A231-A235 WeakPolarHBondContact O-CB 3.14Å; A231-A235 PolarHBondContact O-N 3.14Å; A235-V237 PolarHBondContact O-N 3.29Å; A235-A238 PolarHBondContact O-N 3.03Å; A235-V239 WeakPolarHBondContact O-CB 3.32Å; A235-V239 VanDerWaalsContact O-CG2 3.27Å; A235-V239 WeakPolarHBondContact O-CG2 3.46Å; A235-V239 PolarHBondContact O-N 3.28Å; A235-V239 VanDerWaalsContact O-N 3.07Å
236A81.3Confident82.5Confident0 Ų024.7 Ų24.70%016%0.156CC..Hα-helixtrans-60.8-45.317700000112.8G232 S233 V234 T240 R287 I291G232-A236 WeakPolarHBondContact O-CB 3.45Å; G232-A236 PolarHBondContact O-N 3.08Å; S233-A236 WeakPolarHBondContact O-CB 3.48Å; S233-A236 PolarHBondContact O-N 3.16Å; V234-A236 VanDerWaalsContact C-N 3.31Å; V234-A236 PolarHBondContact O-N 2.89Å; A236-T240 PolarHBondContact O-N 2.93Å; A236-T240 VanDerWaalsContact O-N 3.17Å; A236-T240 PolarHBondContact O-OG1 3.44Å; A236-R287 HydrophobicContact CB-CG 4.17Å; A236-I291 HydrophobicContact CB-CB 4.31Å; A236-I291 HydrophobicContact CB-CD1 3.56Å; A236-I291 HydrophobicContact CB-CG1 4.41Å; A236-I291 HydrophobicContact CB-CG2 4.31Å
237V86.4Confident82Confident57 Ų5724.1 Ų24.135%0.34515%0.152SC..Hα-helixtrans-66.8-46.8179.1172.10000110.3S233 V234 A235 V239 T240 A288S233-V237 WeakPolarHBondContact O-CG2 3.29Å; S233-V237 PolarHBondContact O-N 3.4Å; V234-V237 PolarHBondContact O-N 3.13Å; A235-V237 PolarHBondContact O-N 3.29Å; V237-V239 PolarHBondContact O-N 3.33Å; V237-T240 WeakPolarHBondContact O-CB 3.38Å; V237-T240 PolarHBondContact O-N 3.27Å; V237-T240 VanDerWaalsContact O-N 3.13Å; V237-T240 PolarHBondContact O-OG1 3.42Å; V237-A288 HydrophobicContact CG2-CB 4.26Å
238A87.5Confident81.6Confident54 Ų5428.7 Ų28.745%0.44617%0.169SC..Hα-helixtrans-59.4-35.3-179.800000113I199 V234 A235I199-A238 HydrophobicContact CD1-CB 3.57Å; V234-A238 WeakPolarHBondContact O-CB 3.49Å; V234-A238 PolarHBondContact O-N 3.25Å; A235-A238 PolarHBondContact O-N 3.03Å
239V86.1Confident81.3Confident1 Ų129.9 Ų29.91%0.00618%0.175CC..Hα-helixtrans-90.8-6.2-177.8178.30000113R192 P195 F196 I199 A235 V237 P241 L242 D243R192-V239 HydrophobicContact CB-CG1 4.21Å; R192-V239 HydrophobicContact CG-CG1 3.33Å; R192-V239 WeakPolarHBondContact O-CG1 3.22Å; P195-V239 HydrophobicContact CB-CG2 4.07Å; F196-V239 HydrophobicContact CB-CG1 4.5Å; F196-V239 HydrophobicContact CB-CG2 4.05Å; I199-V239 HydrophobicContact CD1-CG2 4.38Å; A235-V239 WeakPolarHBondContact O-CB 3.32Å; A235-V239 VanDerWaalsContact O-CG2 3.27Å; A235-V239 WeakPolarHBondContact O-CG2 3.46Å; A235-V239 PolarHBondContact O-N 3.28Å; A235-V239 VanDerWaalsContact O-N 3.07Å; V237-V239 PolarHBondContact O-N 3.33Å; V239-P241 VanDerWaalsContact C-CD 3.45Å; V239-L242 HydrophobicContact CG1-CB 4.38Å; V239-L242 WeakPolarHBondContact O-CB 3.43Å; V239-L242 PolarHBondContact O-N 3.32Å; V239-D243 PolarHBondContact O-N 3.18Å
240T83.3Confident80.5Confident4 Ų429.2 Ų29.23%0.02517%0.17CC..Hα-helixtrans-53.6-41.9-177.8-64.20000114.2A236 V237 L242 D243 V244 A284A236-T240 PolarHBondContact O-N 2.93Å; A236-T240 VanDerWaalsContact O-N 3.17Å; A236-T240 PolarHBondContact O-OG1 3.44Å; V237-T240 WeakPolarHBondContact O-CB 3.38Å; V237-T240 PolarHBondContact O-N 3.27Å; V237-T240 VanDerWaalsContact O-N 3.13Å; V237-T240 PolarHBondContact O-OG1 3.42Å; T240-L242 VanDerWaalsContact C-N 3.25Å; T240-L242 PolarHBondContact O-N 3.26Å; T240-D243 WeakPolarHBondContact O-CB 3.46Å; T240-D243 PolarHBondContact O-N 3.41Å; T240-V244 HydrophobicContact CG2-CG2 4.41Å; T240-V244 WeakPolarHBondContact O-CG2 3.2Å; T240-V244 PolarHBondContact O-N 2.98Å; T240-A284 HydrophobicContact CG2-CB 3.89Å
241P83.4Confident79.5Confident39 Ų3928.2 Ų28.225%0.25316%0.164SC..Hα-helixtrans-56.3-38.7176.1-2837.4000113.6V239 V244 L245 F280V239-P241 VanDerWaalsContact C-CD 3.45Å; P241-V244 PolarHBondContact O-N 3.03Å; P241-L245 WeakPolarHBondContact O-CG 3.4Å; P241-L245 PolarHBondContact O-N 3.47Å; P241-F280 WeakPolarHBondContact CA-O 3.19Å; P241-F280 HydrophobicContact CB-CB 4.09Å; P241-F280 HydrophobicContact CB-CD1 4.15Å; P241-F280 HydrophobicContact CG-CB 4.41Å
242L84.3Confident78Confident40 Ų4030.5 Ų30.521%0.20918%0.176CC..Hα-helixtrans-74.3-34-178.1-52.9178.8000111.1L191 P195 V239 T240 L245 K246L191-L242 HydrophobicContact CD2-CD2 4.03Å; L191-L242 HydrophobicContact CG-CD1 4.23Å; L191-L242 HydrophobicContact CG-CD2 4.05Å; L191-L242 WeakPolarHBondContact O-CD1 3.41Å; P195-L242 HydrophobicContact CB-CD1 4.22Å; P195-L242 HydrophobicContact CG-CD1 3.84Å; V239-L242 HydrophobicContact CG1-CB 4.38Å; V239-L242 WeakPolarHBondContact O-CB 3.43Å; V239-L242 PolarHBondContact O-N 3.32Å; T240-L242 VanDerWaalsContact C-N 3.25Å; T240-L242 PolarHBondContact O-N 3.26Å; L242-L245 PolarHBondContact O-N 2.8Å; L242-K246 WeakPolarHBondContact O-CB 3.46Å; L242-K246 PolarHBondContact O-N 3.48Å
243D76.6Confident76.4Confident15 Ų1537.4 Ų37.48%0.0821%0.206CC..Hα-helixtrans-65-41170.8-87.4-83.6000113.3R192 V239 T240 L245 K246 T247 R287R192-D243 WeakPolarHBondContact CD-OD1 3.48Å; R192-D243 WeakPolarHBondContact CD-OD2 3.43Å; R192-D243 VanDerWaalsContact CG-OD2 3.32Å; R192-D243 WeakPolarHBondContact CG-OD2 3.31Å; R192-D243 IonicContact NE-OD1 2.98Å; R192-D243 IonicContact NH1-OD1 2.69Å; R192-D243 PolarHBondContact NH1-OD1 3.36Å; V239-D243 PolarHBondContact O-N 3.18Å; T240-D243 WeakPolarHBondContact O-CB 3.46Å; T240-D243 PolarHBondContact O-N 3.41Å; D243-L245 VanDerWaalsContact C-N 3.32Å; D243-L245 PolarHBondContact O-N 3.43Å; D243-K246 PolarHBondContact O-N 3.47Å; D243-T247 WeakPolarHBondContact O-CB 3.41Å; D243-T247 WeakPolarHBondContact O-CG2 3.36Å; D243-T247 PolarHBondContact O-N 3.17Å; D243-T247 PolarHBondContact O-OG1 3.26Å; D243-R287 VanDerWaalsContact CG-CZ 3.42Å; D243-R287 IonicContact OD1-CZ 2.98Å; D243-R287 IonicContact OD1-NH1 3.59Å; D243-R287 PolarHBondContact OD1-NH1 2.9Å; D243-R287 IonicContact OD1-NH2 2.77Å; D243-R287 IonicContact OD2-CZ 3.99Å; D243-R287 IonicContact OD2-NE 2.77Å; D243-R287 IonicContact OD2-NH1 3.88Å; D243-R287 PolarHBondContact OD2-NH1 2.89Å; D243-R287 IonicContact OD2-NH2 3.59Å; D243-R287 PolarHBondContact OD2-NH2 3.33Å
244V75.3Confident74.8Confident17 Ų1738.8 Ų38.810%0.10321%0.208CC..Hα-helixtrans-60.8-46176.2173.70000109.7T240 P241 T247 R248 L271 F280T240-V244 HydrophobicContact CG2-CG2 4.41Å; T240-V244 WeakPolarHBondContact O-CG2 3.2Å; T240-V244 PolarHBondContact O-N 2.98Å; P241-V244 PolarHBondContact O-N 3.03Å; V244-T247 PolarHBondContact O-N 3.47Å; V244-T247 PolarHBondContact O-OG1 3.41Å; V244-R248 HydrophobicContact CG1-CG 4.36Å; V244-R248 WeakPolarHBondContact O-CB 3.38Å; V244-R248 WeakPolarHBondContact O-CG 3.14Å; V244-R248 PolarHBondContact O-N 3.13Å; V244-L271 HydrophobicContact CG1-CD2 3.81Å; V244-F280 WeakPolarHBondContact CG2-O 3.48Å
245L78.3Confident72.6Confident11 Ų1137.4 Ų37.46%0.05821%0.209CC..Hα-helixtrans-61.2-47.3175.9-66.8173.5000112.3P241 L242 D243 T247 R248 I249 I264 C267 A268 L271 F280P241-L245 WeakPolarHBondContact O-CG 3.4Å; P241-L245 PolarHBondContact O-N 3.47Å; L242-L245 PolarHBondContact O-N 2.8Å; D243-L245 VanDerWaalsContact C-N 3.32Å; D243-L245 PolarHBondContact O-N 3.43Å; L245-T247 PolarHBondContact O-N 2.86Å; L245-R248 PolarHBondContact O-N 3.33Å; L245-I249 WeakPolarHBondContact O-CD1 3.16Å; L245-I249 VanDerWaalsContact O-CG1 3.28Å; L245-I249 WeakPolarHBondContact O-CG1 3.28Å; L245-I249 PolarHBondContact O-N 2.95Å; L245-I249 VanDerWaalsContact O-N 3.09Å; L245-I264 HydrophobicContact CD1-CG2 4.23Å; L245-C267 HydrophobicContact CD2-CB 4.3Å; L245-A268 HydrophobicContact CD1-CB 4.16Å; L245-A268 HydrophobicContact CD2-CB 3.85Å; L245-L271 HydrophobicContact CD2-CD2 4.18Å; L245-F280 HydrophobicContact CD1-CE1 4.3Å; L245-F280 HydrophobicContact CD2-CE1 3.95Å; L245-F280 HydrophobicContact CG-CE1 4.21Å
246K77.7Confident70.1Confident5 Ų546.7 Ų46.72%0.02226%0.258CS..Hα-helixtrans-55.6-52.5177.2173.8-176173.21670111.6E124 A188 T189 L242 D243 R248 I249 Q250E124-K246 IonicContact OE2-NZ 2.84Å; E124-K246 PolarHBondContact OE2-NZ 3.35Å; A188-K246 HydrophobicContact CB-CB 3.83Å; A188-K246 HydrophobicContact CB-CG 4.01Å; T189-K246 WeakPolarHBondContact OG1-CE 3.44Å; T189-K246 PolarHBondContact OG1-NZ 3.48Å; L242-K246 WeakPolarHBondContact O-CB 3.46Å; L242-K246 PolarHBondContact O-N 3.48Å; D243-K246 PolarHBondContact O-N 3.47Å; K246-R248 VanDerWaalsContact C-N 3.35Å; K246-R248 PolarHBondContact O-N 3.4Å; K246-I249 PolarHBondContact O-N 2.84Å; K246-Q250 HydrophobicContact CG-CG 4.42Å; K246-Q250 WeakPolarHBondContact O-CB 3.28Å; K246-Q250 WeakPolarHBondContact O-CG 3.24Å; K246-Q250 PolarHBondContact O-N 3.3Å
247T71.8Confident68.6Low70 Ų7050.9 Ų50.943%0.42930%0.301SS..Hα-helixtrans-62.7-42-176.850.60000111.4D243 V244 L245 I249 Q250 T251D243-T247 WeakPolarHBondContact O-CB 3.41Å; D243-T247 WeakPolarHBondContact O-CG2 3.36Å; D243-T247 PolarHBondContact O-N 3.17Å; D243-T247 PolarHBondContact O-OG1 3.26Å; V244-T247 PolarHBondContact O-N 3.47Å; V244-T247 PolarHBondContact O-OG1 3.41Å; L245-T247 PolarHBondContact O-N 2.86Å; T247-I249 VanDerWaalsContact C-N 3.33Å; T247-I249 PolarHBondContact O-N 3.33Å; T247-Q250 PolarHBondContact O-N 3.06Å; T247-T251 PolarHBondContact O-N 3.3Å; T247-T251 PolarHBondContact O-OG1 3.02Å
248R72.5Confident67.1Low99 Ų9953.5 Ų53.537%0.37431%0.31SS..Hα-helixtrans-65.6-30.3177.4-69.4-65.1-161.1-168.47.9114.2V244 L245 K246 Y261 E275V244-R248 HydrophobicContact CG1-CG 4.36Å; V244-R248 WeakPolarHBondContact O-CB 3.38Å; V244-R248 WeakPolarHBondContact O-CG 3.14Å; V244-R248 PolarHBondContact O-N 3.13Å; L245-R248 PolarHBondContact O-N 3.33Å; K246-R248 VanDerWaalsContact C-N 3.35Å; K246-R248 PolarHBondContact O-N 3.4Å; R248-Y261 HydrophobicContact CB-CE2 4.08Å; R248-E275 IonicContact CZ-OE1 3.85Å; R248-E275 IonicContact NE-OE1 3.34Å; R248-E275 IonicContact NH2-OE1 2.83Å; R248-E275 PolarHBondContact NH2-OE1 3.02Å; R248-E275 IonicContact NH2-OE2 2.8Å
249I73.8Confident65.6Low26 Ų2653.8 Ų53.813%0.13330%0.304CS..Hα-helixtrans-82.6-33.4178.4-68.3166.5000111.9L245 K246 T247 Y261 I264 C267L245-I249 WeakPolarHBondContact O-CD1 3.16Å; L245-I249 VanDerWaalsContact O-CG1 3.28Å; L245-I249 WeakPolarHBondContact O-CG1 3.28Å; L245-I249 PolarHBondContact O-N 2.95Å; L245-I249 VanDerWaalsContact O-N 3.09Å; K246-I249 PolarHBondContact O-N 2.84Å; T247-I249 VanDerWaalsContact C-N 3.33Å; T247-I249 PolarHBondContact O-N 3.33Å; I249-Y261 HydrophobicContact CG1-CD2 4.49Å; I249-I264 HydrophobicContact CD1-CB 4.2Å; I249-I264 HydrophobicContact CD1-CG1 3.76Å; I249-C267 HydrophobicContact CD1-CB 3.86Å; I249-C267 HydrophobicContact CG1-CB 3.82Å
250Q64.7Low64.3Low5 Ų559.4 Ų59.42%0.02334%0.338CS..Hα-helixtrans-81.6-14.7-177.8-72.6-178.1-30.300113.8M125 I128 G185 T189 K246 T247 L252M125-Q250 HydrophobicContact CE-CG 4.42Å; I128-Q250 HydrophobicContact CD1-CB 4.14Å; G185-Q250 PolarHBondContact O-NE2 2.99Å; T189-Q250 PolarHBondContact OG1-NE2 3.27Å; K246-Q250 HydrophobicContact CG-CG 4.42Å; K246-Q250 WeakPolarHBondContact O-CB 3.28Å; K246-Q250 WeakPolarHBondContact O-CG 3.24Å; K246-Q250 PolarHBondContact O-N 3.3Å; T247-Q250 PolarHBondContact O-N 3.06Å; Q250-L252 PolarHBondContact O-N 3.03Å; Q250-L252 VanDerWaalsContact O-N 3.13Å
251T65.1Low63.6Low47 Ų4761 Ų6129%0.28834%0.344SS..  trans-69.3105.8170.7-540000110.2T247T247-T251 PolarHBondContact O-N 3.3Å; T247-T251 PolarHBondContact O-OG1 3.02Å
252L51.4Low62.7Low48 Ų4864.8 Ų64.825%0.25137%0.371SS..  trans-82.1-28.3-176.8-78.6178.4000113.7M125 Q129 L173 K184 Q250M125-L252 HydrophobicContact SD-CD1 4.42Å; Q129-L252 VanDerWaalsContact NE2-CG 3.32Å; L173-L252 HydrophobicContact CD1-CD1 3.78Å; K184-L252 HydrophobicContact CD-CD2 3.99Å; Q250-L252 PolarHBondContact O-N 3.03Å; Q250-L252 VanDerWaalsContact O-N 3.13Å
253K49.6Very low62.2Low145 Ų14564 Ų6463%0.6337%0.373SS*.  trans-100.898.7-179.6-78.7-171.7176.7-176.60109.8L136L136-K253 HydrophobicContact CD1-CD 3.89Å
254K49.9Very low62.3Low58 Ų5866 Ų6625%0.25238%0.383SS..  trans-98.2128.9169.7-84.3-175.4-176.3-162.20108.3E258 D259K254-E258 WeakPolarHBondContact CA-OE2 3.15Å; K254-E258 HydrophobicContact CB-CB 3.48Å; K254-E258 VanDerWaalsContact CB-CB 3.48Å; K254-E258 WeakPolarHBondContact CB-OE2 3.46Å; K254-E258 HydrophobicContact CD-CB 3.95Å; K254-E258 HydrophobicContact CG-CB 3.79Å; K254-E258 WeakPolarHBondContact CG-OE2 2.94Å; K254-D259 WeakPolarHBondContact CD-O 3.11Å; K254-D259 WeakPolarHBondContact CE-O 3.29Å; K254-D259 PolarHBondContact NZ-O 3.28Å
255G42.3Very low62.6Low45 Ų4570.9 Ų70.946%0.46441%0.413SS..  trans-55.9163.3176.900000111.1G257 E258G255-G257 PolarHBondContact O-N 3.5Å; G255-E258 PolarHBondContact N-OE2 2.9Å; G255-E258 PolarHBondContact O-N 3.49Å
256L32.1Very low62.7Low194 Ų19472.3 Ų72.3100%1.01642%0.421SS*.THydrogen-bonded Turntrans-53.3115.6173.8-87.495.9000109.4
257G49.8Very low62.7Low89 Ų8972.1 Ų72.192%0.91842%0.42SS*.THydrogen-bonded Turntrans103.50.7179.900000116.3G255G255-G257 PolarHBondContact O-N 3.5Å
258E54.1Low63.2Low112 Ų11270 Ų7052%0.52341%0.41SS..PPolyproline II helixtrans-89.6132.4176.9-86.9-175.5147.800112.7K254 G255 V260K254-E258 WeakPolarHBondContact CA-OE2 3.15Å; K254-E258 HydrophobicContact CB-CB 3.48Å; K254-E258 VanDerWaalsContact CB-CB 3.48Å; K254-E258 WeakPolarHBondContact CB-OE2 3.46Å; K254-E258 HydrophobicContact CD-CB 3.95Å; K254-E258 HydrophobicContact CG-CB 3.79Å; K254-E258 WeakPolarHBondContact CG-OE2 2.94Å; G255-E258 PolarHBondContact N-OE2 2.9Å; G255-E258 PolarHBondContact O-N 3.49Å; E258-V260 PolarHBondContact O-N 2.87Å
259D55.1Low63.8Low60 Ų6073.8 Ų73.832%0.32142%0.424SS..PPolyproline II helixtrans-55.1122.7-172.7-97.1-56.7000114.3K254 Y261 K270 Q274K254-D259 WeakPolarHBondContact CD-O 3.11Å; K254-D259 WeakPolarHBondContact CE-O 3.29Å; K254-D259 PolarHBondContact NZ-O 3.28Å; D259-Y261 HydrophobicContact CB-CE1 4.22Å; D259-K270 HydrophobicContact CB-CD 4.33Å; D259-K270 IonicContact OD1-NZ 2.72Å; D259-K270 PolarHBondContact OD1-NZ 3.07Å; D259-Q274 PolarHBondContact OD2-NE2 3.31Å
260V60.2Low64Low119 Ų11974.9 Ų74.972%0.72143%0.427SS*.PPolyproline II helixtrans-73.6131.7166.7-177.50000108.7E258 K270E258-V260 PolarHBondContact O-N 2.87Å; V260-K270 PolarHBondContact O-NZ 3.2Å
261Y67.2Low64.8Low37 Ų3774.7 Ų74.715%0.14543%0.427CS..PPolyproline II helixtrans-97.4123.5175.3-61-53.5000109.6R248 I249 D259 G263 D266 C267 K270R248-Y261 HydrophobicContact CB-CE2 4.08Å; I249-Y261 HydrophobicContact CG1-CD2 4.49Å; D259-Y261 HydrophobicContact CB-CE1 4.22Å; Y261-G263 VanDerWaalsContact C-N 3.33Å; Y261-D266 WeakPolarHBondContact CA-OD2 3.41Å; Y261-C267 HydrophobicContact CD1-CB 3.9Å; Y261-C267 HydrophobicContact CD2-CB 4.09Å; Y261-C267 HydrophobicContact CE1-CB 4.39Å; Y261-C267 HydrophobicContact CG-CB 3.77Å; Y261-K270 HydrophobicContact CD1-CD 3.85Å; Y261-K270 HydrophobicContact CE1-CB 3.88Å; Y261-K270 HydrophobicContact CE1-CD 3.68Å; Y261-K270 HydrophobicContact CE1-CG 4.39Å
262S65.9Low65.6Low118 Ų11879.9 Ų79.983%0.82544%0.441SS*.  trans-76.3-24.3178-173.30000112D266S262-D266 PolarHBondContact N-OD2 3.35Å
263G72.9Confident67.1Low25 Ų2583.6 Ų83.626%0.25846%0.46SS..SBendtrans-174.3-174.1178.300000114.1Y261 D266 C267Y261-G263 VanDerWaalsContact C-N 3.33Å; G263-D266 PolarHBondContact O-N 2.92Å; G263-C267 WeakPolarHBondContact O-CB 3.2Å; G263-C267 PolarHBondContact O-N 2.95Å
264I78.5Confident68.5Low56 Ų5682 Ų8229%0.28746%0.455SS..Hα-helixtrans-63.4-42.6-178.3-59.7171.9000111.4A188 L191 L245 I249 C267 A268A188-I264 HydrophobicContact CB-CD1 4.22Å; A188-I264 HydrophobicContact CB-CG1 4.47Å; L191-I264 HydrophobicContact CD2-CD1 4.05Å; L191-I264 HydrophobicContact CD2-CG2 3.89Å; L245-I264 HydrophobicContact CD1-CG2 4.23Å; I249-I264 HydrophobicContact CD1-CB 4.2Å; I249-I264 HydrophobicContact CD1-CG1 3.76Å; I264-C267 PolarHBondContact O-N 2.88Å; I264-A268 WeakPolarHBondContact O-CB 3.06Å; I264-A268 PolarHBondContact O-N 3.34Å
265T80.9Confident69.6Low119 Ų11982.1 Ų82.173%0.7346%0.456SS*.Hα-helixtrans-69.1-39.2-179.451.80000112.4A268 R269T265-A268 PolarHBondContact O-N 3.48Å; T265-R269 WeakPolarHBondContact O-CB 3.32Å; T265-R269 PolarHBondContact O-N 2.87Å
266D81.9Confident71.5Confident42 Ų4280.9 Ų80.923%0.22544%0.443CS..Hα-helixtrans-66-44.9174.5179.847.3000111.2Y261 S262 G263 A268 R269 K270Y261-D266 WeakPolarHBondContact CA-OD2 3.41Å; S262-D266 PolarHBondContact N-OD2 3.35Å; G263-D266 PolarHBondContact O-N 2.92Å; D266-A268 PolarHBondContact O-N 2.99Å; D266-R269 PolarHBondContact O-N 3.4Å; D266-K270 WeakPolarHBondContact O-CB 3.12Å; D266-K270 WeakPolarHBondContact O-CG 3.36Å; D266-K270 PolarHBondContact O-N 3.46Å; D266-K270 WeakPolarHBondContact OD1-CE 3.46Å
267C77.3Confident73.8Confident0 Ų075.4 Ų75.40%042%0.419CS..Hα-helixtrans-59.7-46.1173.7-172.60000111.8L245 I249 Y261 G263 I264 R269 K270 L271L245-C267 HydrophobicContact CD2-CB 4.3Å; I249-C267 HydrophobicContact CD1-CB 3.86Å; I249-C267 HydrophobicContact CG1-CB 3.82Å; Y261-C267 HydrophobicContact CD1-CB 3.9Å; Y261-C267 HydrophobicContact CD2-CB 4.09Å; Y261-C267 HydrophobicContact CE1-CB 4.39Å; Y261-C267 HydrophobicContact CG-CB 3.77Å; G263-C267 WeakPolarHBondContact O-CB 3.2Å; G263-C267 PolarHBondContact O-N 2.95Å; I264-C267 PolarHBondContact O-N 2.88Å; C267-R269 PolarHBondContact O-N 3.32Å; C267-K270 PolarHBondContact O-N 3.48Å; C267-L271 WeakPolarHBondContact O-CB 3.2Å; C267-L271 PolarHBondContact O-N 3.37Å
268A82.3Confident75Confident26 Ų2675.2 Ų75.222%0.21540%0.404CS..Hα-helixtrans-62.8-42.8178.200000112.2L245 I264 T265 D266 W272 F280L245-A268 HydrophobicContact CD1-CB 4.16Å; L245-A268 HydrophobicContact CD2-CB 3.85Å; I264-A268 WeakPolarHBondContact O-CB 3.06Å; I264-A268 PolarHBondContact O-N 3.34Å; T265-A268 PolarHBondContact O-N 3.48Å; D266-A268 PolarHBondContact O-N 2.99Å; A268-W272 WeakPolarHBondContact O-CB 3.22Å; A268-W272 PolarHBondContact O-N 3.02Å; A268-F280 HydrophobicContact CB-CE1 4.48Å
269R83.9Confident75.8Confident179 Ų17970 Ų7068%0.67538%0.38SS*.Hα-helixtrans-63.2-51.4177.2-177.5-175.5-66.2-171.9-1.2111.6T265 D266 C267 L271 W272 I273T265-R269 WeakPolarHBondContact O-CB 3.32Å; T265-R269 PolarHBondContact O-N 2.87Å; D266-R269 PolarHBondContact O-N 3.4Å; C267-R269 PolarHBondContact O-N 3.32Å; R269-L271 VanDerWaalsContact C-N 3.34Å; R269-L271 PolarHBondContact O-N 3.28Å; R269-W272 PolarHBondContact O-N 3.25Å; R269-I273 HydrophobicContact CG-CD1 3.79Å; R269-I273 WeakPolarHBondContact O-CG1 3.47Å; R269-I273 PolarHBondContact O-N 3.29Å
270K80.1Confident76.9Confident48 Ų4868.2 Ų68.221%0.20937%0.369CS..Hα-helixtrans-61.9-42.2179.7-73.1-176.1179.8-169.30111.4D259 V260 Y261 D266 C267 W272 I273 Q274D259-K270 HydrophobicContact CB-CD 4.33Å; D259-K270 IonicContact OD1-NZ 2.72Å; D259-K270 PolarHBondContact OD1-NZ 3.07Å; V260-K270 PolarHBondContact O-NZ 3.2Å; Y261-K270 HydrophobicContact CD1-CD 3.85Å; Y261-K270 HydrophobicContact CE1-CB 3.88Å; Y261-K270 HydrophobicContact CE1-CD 3.68Å; Y261-K270 HydrophobicContact CE1-CG 4.39Å; D266-K270 WeakPolarHBondContact O-CB 3.12Å; D266-K270 WeakPolarHBondContact O-CG 3.36Å; D266-K270 PolarHBondContact O-N 3.46Å; D266-K270 WeakPolarHBondContact OD1-CE 3.46Å; C267-K270 PolarHBondContact O-N 3.48Å; K270-W272 PolarHBondContact O-N 2.96Å; K270-I273 PolarHBondContact O-N 2.87Å; K270-Q274 VanDerWaalsContact O-CB 3.25Å; K270-Q274 WeakPolarHBondContact O-CB 3.4Å; K270-Q274 VanDerWaalsContact O-CG 3.3Å; K270-Q274 WeakPolarHBondContact O-CG 3.29Å; K270-Q274 PolarHBondContact O-N 3.44Å
271L79.9Confident77.9Confident1 Ų167.9 Ų67.91%0.00536%0.361CS..Hα-helixtrans-62.1-43.4177.2-173.165.1000112V244 L245 C267 R269 E275 G276 A279 F280V244-L271 HydrophobicContact CG1-CD2 3.81Å; L245-L271 HydrophobicContact CD2-CD2 4.18Å; C267-L271 WeakPolarHBondContact O-CB 3.2Å; C267-L271 PolarHBondContact O-N 3.37Å; R269-L271 VanDerWaalsContact C-N 3.34Å; R269-L271 PolarHBondContact O-N 3.28Å; L271-E275 HydrophobicContact CD1-CB 3.96Å; L271-E275 HydrophobicContact CD1-CG 3.9Å; L271-E275 WeakPolarHBondContact CD1-OE1 3.49Å; L271-E275 PolarHBondContact O-N 3.02Å; L271-G276 PolarHBondContact O-N 2.87Å; L271-A279 HydrophobicContact CD1-CB 3.88Å; L271-A279 HydrophobicContact CG-CB 4.15Å; L271-F280 HydrophobicContact CB-CE2 4.36Å; L271-F280 HydrophobicContact CB-CZ 4.09Å; L271-F280 HydrophobicContact CD2-CD1 3.96Å; L271-F280 HydrophobicContact CD2-CD2 4.2Å; L271-F280 HydrophobicContact CD2-CE1 3.76Å; L271-F280 HydrophobicContact CD2-CE2 3.98Å; L271-F280 HydrophobicContact CD2-CG 4.2Å; L271-F280 HydrophobicContact CD2-CZ 3.77Å; L271-F280 HydrophobicContact CG-CD2 4.47Å; L271-F280 HydrophobicContact CG-CE2 4.01Å; L271-F280 HydrophobicContact CG-CZ 4.06Å
272W82.3Confident78Confident156 Ų15671.7 Ų71.759%0.59138%0.379SS*.Hα-helixtrans-62.2-43177.1-173.4-83.8000112.4A268 R269 K270 G276 P277 F280A268-W272 WeakPolarHBondContact O-CB 3.22Å; A268-W272 PolarHBondContact O-N 3.02Å; R269-W272 PolarHBondContact O-N 3.25Å; K270-W272 PolarHBondContact O-N 2.96Å; W272-G276 VanDerWaalsContact O-CA 3.31Å; W272-G276 WeakPolarHBondContact O-CA 3.3Å; W272-G276 PolarHBondContact O-N 3.17Å; W272-P277 HydrophobicContact CE3-CB 4.35Å; W272-P277 HydrophobicContact CH2-CB 3.86Å; W272-P277 HydrophobicContact CZ2-CB 4.44Å; W272-P277 HydrophobicContact CZ3-CB 3.8Å; W272-F280 HydrophobicContact CB-CE2 4.19Å; W272-F280 HydrophobicContact CB-CZ 4.41Å; W272-F280 HydrophobicContact CE3-CD2 4.34Å; W272-F280 AromaticContact CE3-CE2 3.71Å; W272-F280 HydrophobicContact CE3-CE2 3.71Å; W272-F280 HydrophobicContact CE3-CZ 4.31Å
273I82.1Confident78.2Confident127 Ų12767 Ų6765%0.65135%0.349SS*.Hα-helixtrans-75.6-41.3-177.3-65.2169.9000111.6R269 K270R269-I273 HydrophobicContact CG-CD1 3.79Å; R269-I273 WeakPolarHBondContact O-CG1 3.47Å; R269-I273 PolarHBondContact O-N 3.29Å; K270-I273 PolarHBondContact O-N 2.87Å
274Q79.9Confident78.2Confident110 Ų11066.2 Ų66.251%0.51434%0.34SS..Hα-helixtrans-88.8-41.9-171.7-65.4175.3-6.700113.6D259 K270D259-Q274 PolarHBondContact OD2-NE2 3.31Å; K270-Q274 VanDerWaalsContact O-CB 3.25Å; K270-Q274 WeakPolarHBondContact O-CB 3.4Å; K270-Q274 VanDerWaalsContact O-CG 3.3Å; K270-Q274 WeakPolarHBondContact O-CG 3.29Å; K270-Q274 PolarHBondContact O-N 3.44Å
275E74.1Confident78Confident62 Ų6265.9 Ų65.929%0.2935%0.35SS..THydrogen-bonded Turntrans-109.4-13.2-175.7-61.2-166.4-142.300113.6R248 L271 A279 K282R248-E275 IonicContact CZ-OE1 3.85Å; R248-E275 IonicContact NE-OE1 3.34Å; R248-E275 IonicContact NH2-OE1 2.83Å; R248-E275 PolarHBondContact NH2-OE1 3.02Å; R248-E275 IonicContact NH2-OE2 2.8Å; L271-E275 HydrophobicContact CD1-CB 3.96Å; L271-E275 HydrophobicContact CD1-CG 3.9Å; L271-E275 WeakPolarHBondContact CD1-OE1 3.49Å; L271-E275 PolarHBondContact O-N 3.02Å; E275-A279 HydrophobicContact CB-CB 3.44Å; E275-A279 VanDerWaalsContact CB-CB 3.44Å; E275-A279 HydrophobicContact CG-CB 4.42Å; E275-K282 IonicContact OE2-NZ 3.21Å; E275-K282 PolarHBondContact OE2-NZ 2.98Å
276G81Confident77.3Confident18 Ų1861.1 Ų61.119%0.18632%0.321CS..  trans80.1177-179.400000114.9L271 W272 S278 A279L271-G276 PolarHBondContact O-N 2.87Å; W272-G276 VanDerWaalsContact O-CA 3.31Å; W272-G276 WeakPolarHBondContact O-CA 3.3Å; W272-G276 PolarHBondContact O-N 3.17Å; G276-S278 VanDerWaalsContact C-N 3.31Å; G276-S278 PolarHBondContact O-N 3.36Å; G276-A279 VanDerWaalsContact O-CB 3.28Å; G276-A279 WeakPolarHBondContact O-CB 3.45Å; G276-A279 PolarHBondContact O-N 3.43Å
277P79.9Confident76.8Confident80 Ų8060.8 Ų60.852%0.51932%0.317SS..G310 helixtrans-66.9-27.6-174.524.5-33.7000113.8W272 A279 F280W272-P277 HydrophobicContact CE3-CB 4.35Å; W272-P277 HydrophobicContact CH2-CB 3.86Å; W272-P277 HydrophobicContact CZ2-CB 4.44Å; W272-P277 HydrophobicContact CZ3-CB 3.8Å; P277-A279 PolarHBondContact O-N 3.33Å; P277-F280 PolarHBondContact O-N 3.46Å
278S75.5Confident76.7Confident85 Ų8561.7 Ų61.759%0.59432%0.324SS*.G310 helixtrans-66.7-21.2178.361.90000112.8G276 F280 M281 K282G276-S278 VanDerWaalsContact C-N 3.31Å; G276-S278 PolarHBondContact O-N 3.36Å; S278-F280 VanDerWaalsContact C-N 3.31Å; S278-F280 PolarHBondContact O-N 3.1Å; S278-M281 PolarHBondContact O-N 3.44Å; S278-K282 PolarHBondContact O-N 3.2Å
279A71.8Confident76.2Confident1 Ų165 Ų651%0.00834%0.338CS..G310 helixtrans-64.8-33.5177.800000113.1L271 E275 G276 P277 M281 K282L271-A279 HydrophobicContact CD1-CB 3.88Å; L271-A279 HydrophobicContact CG-CB 4.15Å; E275-A279 HydrophobicContact CB-CB 3.44Å; E275-A279 VanDerWaalsContact CB-CB 3.44Å; E275-A279 HydrophobicContact CG-CB 4.42Å; G276-A279 VanDerWaalsContact O-CB 3.28Å; G276-A279 WeakPolarHBondContact O-CB 3.45Å; G276-A279 PolarHBondContact O-N 3.43Å; P277-A279 PolarHBondContact O-N 3.33Å; A279-M281 PolarHBondContact O-N 3.05Å; A279-K282 HydrophobicContact CB-CD 4.42Å; A279-K282 WeakPolarHBondContact O-CB 3.37Å; A279-K282 PolarHBondContact O-N 3.29Å
280F78.4Confident75.6Confident23 Ų2357.1 Ų57.110%0.10131%0.31CS..G310 helixtrans-66.8-25.8178.8-70.8-93000113.1P241 V244 L245 A268 L271 W272 P277 S278P241-F280 WeakPolarHBondContact CA-O 3.19Å; P241-F280 HydrophobicContact CB-CB 4.09Å; P241-F280 HydrophobicContact CB-CD1 4.15Å; P241-F280 HydrophobicContact CG-CB 4.41Å; V244-F280 WeakPolarHBondContact CG2-O 3.48Å; L245-F280 HydrophobicContact CD1-CE1 4.3Å; L245-F280 HydrophobicContact CD2-CE1 3.95Å; L245-F280 HydrophobicContact CG-CE1 4.21Å; A268-F280 HydrophobicContact CB-CE1 4.48Å; L271-F280 HydrophobicContact CB-CE2 4.36Å; L271-F280 HydrophobicContact CB-CZ 4.09Å; L271-F280 HydrophobicContact CD2-CD1 3.96Å; L271-F280 HydrophobicContact CD2-CD2 4.2Å; L271-F280 HydrophobicContact CD2-CE1 3.76Å; L271-F280 HydrophobicContact CD2-CE2 3.98Å; L271-F280 HydrophobicContact CD2-CG 4.2Å; L271-F280 HydrophobicContact CD2-CZ 3.77Å; L271-F280 HydrophobicContact CG-CD2 4.47Å; L271-F280 HydrophobicContact CG-CE2 4.01Å; L271-F280 HydrophobicContact CG-CZ 4.06Å; W272-F280 HydrophobicContact CB-CE2 4.19Å; W272-F280 HydrophobicContact CB-CZ 4.41Å; W272-F280 HydrophobicContact CE3-CD2 4.34Å; W272-F280 AromaticContact CE3-CE2 3.71Å; W272-F280 HydrophobicContact CE3-CE2 3.71Å; W272-F280 HydrophobicContact CE3-CZ 4.31Å; P277-F280 PolarHBondContact O-N 3.46Å; S278-F280 VanDerWaalsContact C-N 3.31Å; S278-F280 PolarHBondContact O-N 3.1Å
281M80.4Confident75.2Confident113 Ų11355.7 Ų55.756%0.55730%0.304SS*.G310 helixtrans-99.52.3178.2-73.2-166.15900113.5S278 A279 G283 A284S278-M281 PolarHBondContact O-N 3.44Å; A279-M281 PolarHBondContact O-N 3.05Å; M281-G283 PolarHBondContact O-N 2.98Å; M281-A284 HydrophobicContact CE-CB 4.24Å; M281-A284 WeakPolarHBondContact O-CB 3.42Å; M281-A284 PolarHBondContact O-N 2.9Å
282K69.9Low74.8Confident117 Ų11756.7 Ų56.751%0.50931%0.312SS..THydrogen-bonded Turntrans-57.9115.9176.6-78.9177.3-174.8170.40109.6E275 S278 A279E275-K282 IonicContact OE2-NZ 3.21Å; E275-K282 PolarHBondContact OE2-NZ 2.98Å; S278-K282 PolarHBondContact O-N 3.2Å; A279-K282 HydrophobicContact CB-CD 4.42Å; A279-K282 WeakPolarHBondContact O-CB 3.37Å; A279-K282 PolarHBondContact O-N 3.29Å
283G69.9Low74.4Confident20 Ų2051.2 Ų51.221%0.20630%0.297CS..THydrogen-bonded Turntrans934.8179.100000116.2M281 C286 R287M281-G283 PolarHBondContact O-N 2.98Å; G283-C286 PolarHBondContact O-N 2.87Å; G283-R287 WeakPolarHBondContact O-CB 3.41Å; G283-R287 PolarHBondContact O-N 3.45Å
284A73Confident73.8Confident7 Ų747.8 Ų47.86%0.05828%0.28CS..Hα-helixtrans-55.8-50.7175.900000112.2T240 M281 C286 R287 A288T240-A284 HydrophobicContact CG2-CB 3.89Å; M281-A284 HydrophobicContact CE-CB 4.24Å; M281-A284 WeakPolarHBondContact O-CB 3.42Å; M281-A284 PolarHBondContact O-N 2.9Å; A284-C286 PolarHBondContact O-N 3.33Å; A284-R287 WeakPolarHBondContact O-CB 3.41Å; A284-R287 PolarHBondContact O-N 3.45Å; A284-R287 VanDerWaalsContact O-N 3.07Å; A284-A288 PolarHBondContact O-N 2.98Å
285G73Confident73.2Confident49 Ų4944.7 Ų44.751%0.50527%0.265SS..Hα-helixtrans-61.5-42.7178.800000112.8R287 A288 L289G285-R287 VanDerWaalsContact C-N 3.25Å; G285-R287 PolarHBondContact O-N 2.93Å; G285-A288 PolarHBondContact O-N 3.33Å; G285-L289 WeakPolarHBondContact O-CG 3.18Å; G285-L289 PolarHBondContact O-N 3.22Å; G285-L289 VanDerWaalsContact O-N 3.1Å
286C67.5Low72.9Confident19 Ų1941.9 Ų41.913%0.12825%0.252CS..Hα-helixtrans-66.1-29.7175.7-57.20000112.5K33 M48 G283 A284 V290K33-C286 HydrophobicContact CB-CB 4.11Å; K33-C286 HydrophobicContact CD-CB 3.59Å; K33-C286 HydrophobicContact CG-CB 3.54Å; M48-C286 HydrophobicContact CE-CB 4.02Å; G283-C286 PolarHBondContact O-N 2.87Å; A284-C286 PolarHBondContact O-N 3.33Å; C286-V290 VanDerWaalsContact O-CG2 3.28Å; C286-V290 WeakPolarHBondContact O-CG2 3.27Å; C286-V290 PolarHBondContact O-N 2.83Å
287R70.1Confident72.4Confident35 Ų3542.7 Ų42.713%0.13225%0.252CS..Hα-helixtrans-73.4-43.7177.2-168.5-172.3168.799.6-10.2111.4A236 D243 G283 A284 G285 L289 V290 I291A236-R287 HydrophobicContact CB-CG 4.17Å; D243-R287 VanDerWaalsContact CG-CZ 3.42Å; D243-R287 IonicContact OD1-CZ 2.98Å; D243-R287 IonicContact OD1-NH1 3.59Å; D243-R287 PolarHBondContact OD1-NH1 2.9Å; D243-R287 IonicContact OD1-NH2 2.77Å; D243-R287 IonicContact OD2-CZ 3.99Å; D243-R287 IonicContact OD2-NE 2.77Å; D243-R287 IonicContact OD2-NH1 3.88Å; D243-R287 PolarHBondContact OD2-NH1 2.89Å; D243-R287 IonicContact OD2-NH2 3.59Å; D243-R287 PolarHBondContact OD2-NH2 3.33Å; G283-R287 WeakPolarHBondContact O-CB 3.41Å; G283-R287 PolarHBondContact O-N 3.45Å; A284-R287 WeakPolarHBondContact O-CB 3.41Å; A284-R287 PolarHBondContact O-N 3.45Å; A284-R287 VanDerWaalsContact O-N 3.07Å; G285-R287 VanDerWaalsContact C-N 3.25Å; G285-R287 PolarHBondContact O-N 2.93Å; R287-L289 VanDerWaalsContact C-N 3.28Å; R287-L289 PolarHBondContact O-N 3.3Å; R287-V290 PolarHBondContact O-N 3.48Å; R287-I291 HydrophobicContact CG-CD1 3.79Å; R287-I291 HydrophobicContact CG-CG1 4.33Å; R287-I291 WeakPolarHBondContact O-CB 3.4Å; R287-I291 WeakPolarHBondContact O-CG1 3.32Å; R287-I291 PolarHBondContact O-N 3.44Å
288A76.4Confident71.7Confident19 Ų1940.2 Ų40.216%0.15724%0.238CC..Hα-helixtrans-56.7-44.117300000111.3V237 A284 G285 V290 I291 A292V237-A288 HydrophobicContact CG2-CB 4.26Å; A284-A288 PolarHBondContact O-N 2.98Å; G285-A288 PolarHBondContact O-N 3.33Å; A288-V290 VanDerWaalsContact C-N 3.31Å; A288-V290 PolarHBondContact O-N 3.3Å; A288-I291 PolarHBondContact O-N 2.86Å; A288-A292 WeakPolarHBondContact O-CB 3.31Å; A288-A292 PolarHBondContact O-N 3.46Å
289L71.5Confident71.2Confident95 Ų9538.8 Ų38.850%0.49722%0.222SC..Hα-helixtrans-65.4-27.3178.5-77.8167.5000114.9M48 G285 R287 P293M48-L289 HydrophobicContact CE-CB 4.16Å; M48-L289 HydrophobicContact CE-CD1 3.33Å; M48-L289 HydrophobicContact CE-CG 4.38Å; M48-L289 HydrophobicContact SD-CB 4.4Å; M48-L289 HydrophobicContact SD-CD1 3.96Å; G285-L289 WeakPolarHBondContact O-CG 3.18Å; G285-L289 PolarHBondContact O-N 3.22Å; G285-L289 VanDerWaalsContact O-N 3.1Å; R287-L289 VanDerWaalsContact C-N 3.28Å; R287-L289 PolarHBondContact O-N 3.3Å; L289-P293 WeakPolarHBondContact O-CD 3.35Å; L289-P293 VanDerWaalsContact O-CG 3.25Å; L289-P293 WeakPolarHBondContact O-CG 3.32Å
290V70.6Confident71Confident14 Ų1439.3 Ų39.39%0.08523%0.228CC..Hα-helixtrans-84.7-39.1176164.50000111.1V26 I29 D30 K33 C286 R287 A288 P293 L294V26-V290 HydrophobicContact CG1-CB 4.46Å; V26-V290 HydrophobicContact CG1-CG1 3.66Å; I29-V290 HydrophobicContact CB-CG2 4.35Å; I29-V290 HydrophobicContact CG2-CG2 3.61Å; D30-V290 WeakPolarHBondContact OD1-CG1 3.11Å; D30-V290 VanDerWaalsContact OD1-CG2 3.32Å; D30-V290 WeakPolarHBondContact OD1-CG2 3.29Å; K33-V290 HydrophobicContact CD-CG2 4.07Å; C286-V290 VanDerWaalsContact O-CG2 3.28Å; C286-V290 WeakPolarHBondContact O-CG2 3.27Å; C286-V290 PolarHBondContact O-N 2.83Å; R287-V290 PolarHBondContact O-N 3.48Å; A288-V290 VanDerWaalsContact C-N 3.31Å; A288-V290 PolarHBondContact O-N 3.3Å; V290-P293 WeakPolarHBondContact O-CD 3.29Å; V290-L294 PolarHBondContact O-N 3.43Å
291I71.7Confident70.4Confident19 Ų1938.6 Ų38.610%0.09723%0.226CC..Hα-helixtrans-75.2-37-173.8-75.7-172.9000111.9A236 R287 A288 L294 F295A236-I291 HydrophobicContact CB-CB 4.31Å; A236-I291 HydrophobicContact CB-CD1 3.56Å; A236-I291 HydrophobicContact CB-CG1 4.41Å; A236-I291 HydrophobicContact CB-CG2 4.31Å; R287-I291 HydrophobicContact CG-CD1 3.79Å; R287-I291 HydrophobicContact CG-CG1 4.33Å; R287-I291 WeakPolarHBondContact O-CB 3.4Å; R287-I291 WeakPolarHBondContact O-CG1 3.32Å; R287-I291 PolarHBondContact O-N 3.44Å; A288-I291 PolarHBondContact O-N 2.86Å; I291-L294 PolarHBondContact O-N 3.12Å; I291-F295 HydrophobicContact CG2-CD2 3.43Å; I291-F295 VanDerWaalsContact CG2-CD2 3.43Å; I291-F295 HydrophobicContact CG2-CE2 3.35Å; I291-F295 VanDerWaalsContact O-CD2 3.3Å; I291-F295 WeakPolarHBondContact O-CD2 3.21Å; I291-F295 PolarHBondContact O-N 3.32Å; I291-F295 VanDerWaalsContact O-N 3.15Å
292A72.8Confident69.5Low21 Ų2138.8 Ų38.817%0.17422%0.221CC..Hα-helixtrans-59.6-50.9178.800000113.2C229 A288 L294 F295 G296C229-A292 HydrophobicContact CB-CB 4.21Å; C229-A292 PolarHBondContact SG-O 3.41Å; C229-A292 VanDerWaalsContact SG-O 3.37Å; A288-A292 WeakPolarHBondContact O-CB 3.31Å; A288-A292 PolarHBondContact O-N 3.46Å; A292-L294 VanDerWaalsContact C-N 3.34Å; A292-L294 PolarHBondContact O-N 2.93Å; A292-F295 PolarHBondContact O-N 2.95Å; A292-G296 PolarHBondContact O-N 2.9Å
293P72.5Confident69.3Low41 Ų4140.2 Ų40.227%0.26623%0.227SC..Hα-helixtrans-63.3-36.6176.2-22.232.7000113.3V26 I29 L289 V290 F295 G296 I297V26-P293 HydrophobicContact CG2-CB 4.17Å; I29-P293 HydrophobicContact CD1-CG 4.05Å; L289-P293 WeakPolarHBondContact O-CD 3.35Å; L289-P293 VanDerWaalsContact O-CG 3.25Å; L289-P293 WeakPolarHBondContact O-CG 3.32Å; V290-P293 WeakPolarHBondContact O-CD 3.29Å; P293-F295 PolarHBondContact O-N 3.29Å; P293-G296 PolarHBondContact O-N 3.04Å; P293-I297 WeakPolarHBondContact O-CB 3.42Å; P293-I297 WeakPolarHBondContact O-CD1 3.38Å; P293-I297 WeakPolarHBondContact O-CG1 3.44Å; P293-I297 PolarHBondContact O-N 3.46Å
294L69.9Low69.1Low55 Ų5544.1 Ų44.129%0.28824%0.242SC..Hα-helixtrans-60.9-47.2-179.5-170.775.4000111.6V26 V290 I291 A292 A298V26-L294 HydrophobicContact CG2-CB 4.22Å; V26-L294 HydrophobicContact CG2-CD1 4.16Å; V290-L294 PolarHBondContact O-N 3.43Å; I291-L294 PolarHBondContact O-N 3.12Å; A292-L294 VanDerWaalsContact C-N 3.34Å; A292-L294 PolarHBondContact O-N 2.93Å; L294-A298 WeakPolarHBondContact O-CB 3.09Å; L294-A298 PolarHBondContact O-N 3.41Å
295F68.2Low68.6Low46 Ų4644.5 Ų44.520%0.20225%0.247CC..Hα-helixtrans-69.3-37177.2-79-64.8000112.4F196 Y200 I291 A292 P293 A298 Q299F196-F295 HydrophobicContact CE1-CZ 4.14Å; F196-F295 AromaticContact CZ-CE2 3.89Å; F196-F295 HydrophobicContact CZ-CE2 3.89Å; F196-F295 AromaticContact CZ-CZ 3.78Å; F196-F295 HydrophobicContact CZ-CZ 3.78Å; Y200-F295 HydrophobicContact CD2-CZ 4.48Å; Y200-F295 HydrophobicContact CE2-CD1 4.37Å; Y200-F295 HydrophobicContact CE2-CE1 4.08Å; Y200-F295 HydrophobicContact CE2-CE2 4.28Å; Y200-F295 HydrophobicContact CE2-CZ 4.04Å; Y200-F295 AromaticContact CZ-CE1 3.94Å; I291-F295 HydrophobicContact CG2-CD2 3.43Å; I291-F295 VanDerWaalsContact CG2-CD2 3.43Å; I291-F295 HydrophobicContact CG2-CE2 3.35Å; I291-F295 VanDerWaalsContact O-CD2 3.3Å; I291-F295 WeakPolarHBondContact O-CD2 3.21Å; I291-F295 PolarHBondContact O-N 3.32Å; I291-F295 VanDerWaalsContact O-N 3.15Å; A292-F295 PolarHBondContact O-N 2.95Å; P293-F295 PolarHBondContact O-N 3.29Å; F295-A298 PolarHBondContact O-N 3.37Å; F295-Q299 WeakPolarHBondContact O-CG 3.31Å; F295-Q299 PolarHBondContact O-N 3.38Å
296G67.8Low68.1Low2 Ų244.3 Ų44.32%0.02123%0.234CC..Hα-helixtrans-60.6-45.1175.300000113.3F225 A292 P293 Q299 G300F225-G296 WeakPolarHBondContact CD2-O 3.5Å; F225-G296 WeakPolarHBondContact CE2-O 3.32Å; A292-G296 PolarHBondContact O-N 2.9Å; P293-G296 PolarHBondContact O-N 3.04Å; G296-Q299 PolarHBondContact O-N 3.44Å; G296-G300 PolarHBondContact O-N 3.44Å
297I68.9Low67.7Low35 Ų3543.4 Ų43.418%0.17923%0.228CC..Hα-helixtrans-68.1-41.3177.6-65.6160.3000110.9V21 C25 V26 P293 Q299 G300 V301V21-I297 HydrophobicContact CG1-CG2 3.93Å; C25-I297 HydrophobicContact CB-CD1 3.33Å; V26-I297 HydrophobicContact CG2-CD1 4.37Å; P293-I297 WeakPolarHBondContact O-CB 3.42Å; P293-I297 WeakPolarHBondContact O-CD1 3.38Å; P293-I297 WeakPolarHBondContact O-CG1 3.44Å; P293-I297 PolarHBondContact O-N 3.46Å; I297-Q299 PolarHBondContact O-N 3.26Å; I297-G300 PolarHBondContact O-N 3.09Å; I297-V301 HydrophobicContact CG2-CG2 4.2Å; I297-V301 WeakPolarHBondContact O-CG2 3.47Å; I297-V301 PolarHBondContact O-N 3.22Å
298A65.2Low67.3Low29 Ų2947.8 Ų47.824%0.2425%0.25CC..Hα-helixtrans-56.6-50.6175.700000110.8L294 F295 G300 V301 Y302L294-A298 WeakPolarHBondContact O-CB 3.09Å; L294-A298 PolarHBondContact O-N 3.41Å; F295-A298 PolarHBondContact O-N 3.37Å; A298-G300 VanDerWaalsContact C-N 3.33Å; A298-G300 PolarHBondContact O-N 3.42Å; A298-V301 PolarHBondContact O-N 3.45Å; A298-Y302 WeakPolarHBondContact O-CD2 3.36Å; A298-Y302 PolarHBondContact O-N 3.43Å
299Q65.3Low66.7Low54 Ų5455.8 Ų55.825%0.25228%0.276SS..Hα-helixtrans-60-41.7176.2-71.4-63.3-34.800112.2F221 F295 G296 I297 Y302 F303F221-Q299 HydrophobicContact CE2-CB 4.29Å; F295-Q299 WeakPolarHBondContact O-CG 3.31Å; F295-Q299 PolarHBondContact O-N 3.38Å; G296-Q299 PolarHBondContact O-N 3.44Å; I297-Q299 PolarHBondContact O-N 3.26Å; Q299-Y302 PolarHBondContact O-N 3Å; Q299-F303 WeakPolarHBondContact O-CB 3.26Å; Q299-F303 PolarHBondContact O-N 2.81Å
300G67.3Low66.2Low13 Ų1354.1 Ų54.113%0.13427%0.267CS..Hα-helixtrans-60.3-44.7176.500000113.5G296 I297 A298 F303 I304G296-G300 PolarHBondContact O-N 3.44Å; I297-G300 PolarHBondContact O-N 3.09Å; A298-G300 VanDerWaalsContact C-N 3.33Å; A298-G300 PolarHBondContact O-N 3.42Å; G300-F303 PolarHBondContact O-N 3.35Å; G300-I304 WeakPolarHBondContact O-CB 3.4Å; G300-I304 WeakPolarHBondContact O-CD1 3.4Å; G300-I304 VanDerWaalsContact O-CG1 3.23Å; G300-I304 WeakPolarHBondContact O-CG1 3.48Å; G300-I304 PolarHBondContact O-N 2.97Å
301V66.1Low65.5Low8 Ų855.2 Ų55.25%0.04827%0.272CS..Hα-helixtrans-68.3-40179.1174.50000111.4A18 I297 A298 F303 I304 G305 I306A18-V301 HydrophobicContact CB-CB 3.86Å; A18-V301 HydrophobicContact CB-CG1 3.55Å; A18-V301 HydrophobicContact CB-CG2 4.31Å; I297-V301 HydrophobicContact CG2-CG2 4.2Å; I297-V301 WeakPolarHBondContact O-CG2 3.47Å; I297-V301 PolarHBondContact O-N 3.22Å; A298-V301 PolarHBondContact O-N 3.45Å; V301-F303 VanDerWaalsContact C-N 3.35Å; V301-I304 PolarHBondContact O-N 2.85Å; V301-G305 PolarHBondContact O-N 3.48Å; V301-G305 VanDerWaalsContact O-N 3.16Å; V301-I306 HydrophobicContact CB-CD1 4.48Å; V301-I306 HydrophobicContact CG1-CB 4.41Å; V301-I306 HydrophobicContact CG1-CD1 4.06Å; V301-I306 HydrophobicContact CG1-CG1 4.43Å; V301-I306 HydrophobicContact CG2-CD1 4.23Å
302Y62.6Low64.9Low116 Ų11661.6 Ų61.646%0.45530%0.299SS..Hα-helixtrans-63.4-39.7173.4-82.1-66.1000112.4L83 A298 Q299 G305L83-Y302 WeakPolarHBondContact CD1-OH 3.48Å; A298-Y302 WeakPolarHBondContact O-CD2 3.36Å; A298-Y302 PolarHBondContact O-N 3.43Å; Q299-Y302 PolarHBondContact O-N 3Å; Y302-G305 PolarHBondContact O-N 3.31Å
303F64.3Low64Low147 Ų14765.6 Ų65.665%0.64533%0.325SS*.Hα-helixtrans-68.9-38.8178.9-175.7-98000112.7F221 Q299 G300 V301 G305F221-F303 HydrophobicContact CB-CD2 4.11Å; F221-F303 HydrophobicContact CB-CE1 4.46Å; F221-F303 HydrophobicContact CB-CE2 3.98Å; F221-F303 HydrophobicContact CB-CG 4.4Å; F221-F303 HydrophobicContact CB-CZ 4.17Å; F221-F303 HydrophobicContact CD2-CB 3.56Å; F221-F303 AromaticContact CD2-CD1 3.98Å; F221-F303 HydrophobicContact CD2-CD1 3.98Å; F221-F303 AromaticContact CD2-CD2 3.75Å; F221-F303 HydrophobicContact CD2-CD2 3.75Å; F221-F303 HydrophobicContact CD2-CE2 4.46Å; F221-F303 AromaticContact CD2-CG 3.47Å; F221-F303 HydrophobicContact CD2-CG 3.47Å; F221-F303 VanDerWaalsContact CD2-CG 3.47Å; F221-F303 HydrophobicContact CE2-CB 3.64Å; F221-F303 HydrophobicContact CE2-CD1 4.45Å; F221-F303 HydrophobicContact CE2-CG 4.02Å; F221-F303 HydrophobicContact CG-CD1 4.22Å; F221-F303 HydrophobicContact CG-CD2 4.24Å; F221-F303 HydrophobicContact CG-CE1 4.5Å; F221-F303 HydrophobicContact CG-CG 4.08Å; Q299-F303 WeakPolarHBondContact O-CB 3.26Å; Q299-F303 PolarHBondContact O-N 2.81Å; G300-F303 PolarHBondContact O-N 3.35Å; V301-F303 VanDerWaalsContact C-N 3.35Å; F303-G305 VanDerWaalsContact C-N 3.25Å; F303-G305 PolarHBondContact O-N 3.25Å
304I65.9Low63.2Low102 Ų10272.7 Ų72.752%0.52335%0.352SS..Hα-helixtrans-72.8-20.5178.7-65.3166.9000111.5G300 V301 I306G300-I304 WeakPolarHBondContact O-CB 3.4Å; G300-I304 WeakPolarHBondContact O-CD1 3.4Å; G300-I304 VanDerWaalsContact O-CG1 3.23Å; G300-I304 WeakPolarHBondContact O-CG1 3.48Å; G300-I304 PolarHBondContact O-N 2.97Å; V301-I304 PolarHBondContact O-N 2.85Å; I304-I306 VanDerWaalsContact C-N 3.3Å; I304-I306 HydrophobicContact CB-CD1 4.38Å; I304-I306 HydrophobicContact CB-CG1 3.86Å; I304-I306 HydrophobicContact CG2-CD1 4.1Å; I304-I306 HydrophobicContact CG2-CG1 3.41Å; I304-I306 VanDerWaalsContact CG2-CG1 3.41Å; I304-I306 PolarHBondContact O-N 2.9Å
305G62.8Low62Low16 Ų1679.6 Ų79.617%0.16538%0.383CS..THydrogen-bonded Turntrans63.836.4179.100000112.4V301 Y302 F303 G307 E308 R309V301-G305 PolarHBondContact O-N 3.48Å; V301-G305 VanDerWaalsContact O-N 3.16Å; Y302-G305 PolarHBondContact O-N 3.31Å; F303-G305 VanDerWaalsContact C-N 3.25Å; F303-G305 PolarHBondContact O-N 3.25Å; G305-G307 PolarHBondContact O-N 3.12Å; G305-G307 VanDerWaalsContact O-N 3.15Å; G305-E308 WeakPolarHBondContact O-CB 3.14Å; G305-E308 PolarHBondContact O-N 3.02Å; G305-R309 PolarHBondContact O-N 3.15Å
306I63.2Low61.7Low45 Ų4581.3 Ų81.323%0.23139%0.392CS..Hα-helixtrans-53.8-40.4-169.7-65.9-179.8000112.3V17 V301 I304 R309 I310V17-I306 HydrophobicContact CG1-CG2 4.08Å; V301-I306 HydrophobicContact CB-CD1 4.48Å; V301-I306 HydrophobicContact CG1-CB 4.41Å; V301-I306 HydrophobicContact CG1-CD1 4.06Å; V301-I306 HydrophobicContact CG1-CG1 4.43Å; V301-I306 HydrophobicContact CG2-CD1 4.23Å; I304-I306 VanDerWaalsContact C-N 3.3Å; I304-I306 HydrophobicContact CB-CD1 4.38Å; I304-I306 HydrophobicContact CB-CG1 3.86Å; I304-I306 HydrophobicContact CG2-CD1 4.1Å; I304-I306 HydrophobicContact CG2-CG1 3.41Å; I304-I306 VanDerWaalsContact CG2-CG1 3.41Å; I304-I306 PolarHBondContact O-N 2.9Å; I306-R309 WeakPolarHBondContact O-CB 3.41Å; I306-R309 PolarHBondContact O-N 2.7Å; I306-I310 HydrophobicContact CG2-CD1 3.64Å; I306-I310 HydrophobicContact CG2-CG1 4.23Å; I306-I310 VanDerWaalsContact O-CG1 3.32Å; I306-I310 WeakPolarHBondContact O-CG1 3.22Å; I306-I310 PolarHBondContact O-N 3.36Å
307G59Low61.4Low0 Ų085.5 Ų85.50%041%0.411CS..Hα-helixtrans-72.6-25.6-179.900000114.2N14 G305 L311N14-G307 VanDerWaalsContact CG-CA 3.43Å; N14-G307 WeakPolarHBondContact OD1-CA 3.11Å; N14-G307 PolarHBondContact OD1-N 3.32Å; G305-G307 PolarHBondContact O-N 3.12Å; G305-G307 VanDerWaalsContact O-N 3.15Å; G307-L311 PolarHBondContact O-N 3.14Å
308E62.3Low61Low126 Ų12688.3 Ų88.359%0.58942%0.424SS*.Hα-helixtrans-70.7-36.2169-67.1-177-179.200110.9G305 K312G305-E308 WeakPolarHBondContact O-CB 3.14Å; G305-E308 PolarHBondContact O-N 3.02Å; E308-K312 WeakPolarHBondContact O-CB 3.38Å; E308-K312 WeakPolarHBondContact O-CG 3.45Å; E308-K312 PolarHBondContact O-N 3.44Å; E308-K312 VanDerWaalsContact O-N 3.16Å
309R62.2Low60.7Low188 Ų18891.8 Ų91.871%0.70944%0.435SS*.Hα-helixtrans-70-36.7173.9-71.7-164.6175.5-159.5-0.9112.9G305 I306 C313G305-R309 PolarHBondContact O-N 3.15Å; I306-R309 WeakPolarHBondContact O-CB 3.41Å; I306-R309 PolarHBondContact O-N 2.7Å; R309-C313 PolarHBondContact O-N 2.93Å
310I61Low60.4Low59 Ų5994.1 Ų94.130%0.30345%0.447SS..Hα-helixtrans-68.1-45176.5-69.9169.6000110.3V17 I306 K312 C313 F314V17-I310 HydrophobicContact CG2-CD1 4.19Å; I306-I310 HydrophobicContact CG2-CD1 3.64Å; I306-I310 HydrophobicContact CG2-CG1 4.23Å; I306-I310 VanDerWaalsContact O-CG1 3.32Å; I306-I310 WeakPolarHBondContact O-CG1 3.22Å; I306-I310 PolarHBondContact O-N 3.36Å; I310-K312 PolarHBondContact O-N 3.19Å; I310-C313 WeakPolarHBondContact O-CB 3.17Å; I310-C313 PolarHBondContact O-N 3.27Å; I310-C313 VanDerWaalsContact O-N 3.08Å; I310-F314 HydrophobicContact CG2-CD2 4.16Å; I310-F314 HydrophobicContact CG2-CE2 4.26Å; I310-F314 WeakPolarHBondContact O-CD2 3.44Å; I310-F314 PolarHBondContact O-N 2.84Å
311L55.7Low60Low37 Ų3799.5 Ų99.519%0.19447%0.467CS..Hα-helixtrans-61.2-43.3177.4-110.498.1000112.2L6 A10 I13 G307 C313 F314 E315L6-L311 HydrophobicContact CD2-CD2 3.97Å; L6-L311 HydrophobicContact CG-CD2 4.34Å; A10-L311 HydrophobicContact CB-CD1 3.65Å; A10-L311 HydrophobicContact CB-CD2 4.27Å; I13-L311 HydrophobicContact CD1-CD1 3.95Å; G307-L311 PolarHBondContact O-N 3.14Å; L311-C313 PolarHBondContact O-N 3.15Å; L311-C313 VanDerWaalsContact O-N 3.14Å; L311-F314 PolarHBondContact O-N 2.84Å; L311-E315 PolarHBondContact O-N 3.38Å
312K59.2Low59.6Low153 Ų153106.1 Ų106.167%0.66550%0.497SS*.THydrogen-bonded Turntrans-63.8-15.4175.6-76.4179178.8178.40114.4E308 I310E308-K312 WeakPolarHBondContact O-CB 3.38Å; E308-K312 WeakPolarHBondContact O-CG 3.45Å; E308-K312 PolarHBondContact O-N 3.44Å; E308-K312 VanDerWaalsContact O-N 3.16Å; I310-K312 PolarHBondContact O-N 3.19Å
313C55Low59.3Low106 Ų106105.3 Ų105.372%0.71650%0.501SS*.THydrogen-bonded Turntrans-92.2-9.8177.5-150.90000112.2R309 I310 L311R309-C313 PolarHBondContact O-N 2.93Å; I310-C313 WeakPolarHBondContact O-CB 3.17Å; I310-C313 PolarHBondContact O-N 3.27Å; I310-C313 VanDerWaalsContact O-N 3.08Å; L311-C313 PolarHBondContact O-N 3.15Å; L311-C313 VanDerWaalsContact O-N 3.14Å
314F54.7Low58.9Low189 Ų189101.8 Ų101.883%0.82949%0.489SS*.THydrogen-bonded Turntrans-110.5-3.8178.7-87-81.7000113.4I310 L311I310-F314 HydrophobicContact CG2-CD2 4.16Å; I310-F314 HydrophobicContact CG2-CE2 4.26Å; I310-F314 WeakPolarHBondContact O-CD2 3.44Å; I310-F314 PolarHBondContact O-N 2.84Å; L311-F314 PolarHBondContact O-N 2.84Å
315E45.9Very low58.3Low201 Ų201101.8 Ų101.894%0.93949%0.485SS*.  trans-90.70161.7-80.5-179.1137.100110.3L311L311-E315 PolarHBondContact O-N 3.38Å

Retrieved 315 of 315 residues in 926.8 ms (Link to these results)