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NADH-ubiquinone oxidoreductase chain 4

Core subunit of the mitochondrial membrane respiratory chain NADH dehydrogenase (Complex I) which catalyzes electron transfer from NADH through the respiratory chain, using ubiquinone as an electron acceptor. Essential for the catalytic activity and assembly of complex I.

AlphaFold DB , UniProt , Accession A0A075DCI1, Species MOUSE (Mus musculus, Mouse), Gene ND4, Length 460 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
1M91Very high95.3Very high9 Ų950.2 Ų50.24%0.04426%0.256CS..  0-310-66.7-51.3-69.300115.7K3 I4 I5 L41 F53 F57 I67 I108M1-K3 PolarHBondContact O-N 2.9Å; M1-K3 VanDerWaalsContact O-N 3.11Å; M1-I4 HydrophobicContact CE-CD1 4.34Å; M1-I4 PolarHBondContact O-N 3.06Å; M1-I5 HydrophobicContact CB-CD1 3.85Å; M1-I5 HydrophobicContact CB-CG1 4.5Å; M1-I5 PolarHBondContact O-N 2.83Å; M1-I5 VanDerWaalsContact O-N 3.15Å; M1-L41 HydrophobicContact CE-CD1 4.31Å; M1-L41 HydrophobicContact SD-CD1 4.24Å; M1-L41 HydrophobicContact SD-CD2 3.96Å; M1-F53 HydrophobicContact CG-CD2 3.75Å; M1-F53 HydrophobicContact CG-CE2 3.94Å; M1-F53 HydrophobicContact SD-CD2 4.12Å; M1-F53 HydrophobicContact SD-CE2 3.65Å; M1-F53 HydrophobicContact SD-CZ 4.43Å; M1-F57 HydrophobicContact CB-CB 3.82Å; M1-F57 HydrophobicContact CB-CD1 4.35Å; M1-F57 HydrophobicContact CB-CD2 4.42Å; M1-F57 HydrophobicContact CB-CG 3.96Å; M1-F57 HydrophobicContact CG-CB 3.73Å; M1-F57 HydrophobicContact CG-CG 4.27Å; M1-I67 HydrophobicContact CE-CD1 3.86Å; M1-I67 HydrophobicContact CE-CG2 4.08Å; M1-I108 HydrophobicContact CE-CG2 3.67Å
2L93Very high95.4Very high104 Ų10450.1 Ų50.155%0.54526%0.256SS..Hα-helixtrans-53.8-33.2-178.5-70.2171.6000114.9I4 I5 I6L2-I4 PolarHBondContact O-N 3.38Å; L2-I4 VanDerWaalsContact O-N 3.12Å; L2-I5 PolarHBondContact O-N 3.47Å; L2-I6 HydrophobicContact CB-CD1 4.15Å; L2-I6 WeakPolarHBondContact O-CB 3.3Å; L2-I6 WeakPolarHBondContact O-CG1 3.48Å; L2-I6 PolarHBondContact O-N 3.44Å
3K92.9Very high95.5Very high98 Ų9850.5 Ų50.543%0.42626%0.264SS..Hα-helixtrans-57.3-22.1173.562.3165.2-179.9176.90115M1 P7 T40M1-K3 PolarHBondContact O-N 2.9Å; M1-K3 VanDerWaalsContact O-N 3.11Å; K3-P7 WeakPolarHBondContact O-CD 3.43Å; K3-P7 WeakPolarHBondContact O-CG 3.33Å; K3-T40 PolarHBondContact NZ-OG1 3.05Å
4I94.6Very high95.6Very high1 Ų149.6 Ų49.61%0.00526%0.26CS..Hα-helixtrans-101.1-40.5175.3-64.7164.1000109.8M1 L2 P7 S8 I34 V37 L41 I108M1-I4 HydrophobicContact CE-CD1 4.34Å; M1-I4 PolarHBondContact O-N 3.06Å; L2-I4 PolarHBondContact O-N 3.38Å; L2-I4 VanDerWaalsContact O-N 3.12Å; I4-P7 WeakPolarHBondContact O-CD 3.24Å; I4-S8 WeakPolarHBondContact O-CB 3.25Å; I4-S8 PolarHBondContact O-N 2.87Å; I4-S8 VanDerWaalsContact O-N 3.12Å; I4-S8 PolarHBondContact O-OG 3.14Å; I4-I34 HydrophobicContact CG2-CG2 4.13Å; I4-V37 HydrophobicContact CG1-CG1 4.28Å; I4-L41 HydrophobicContact CD1-CD1 3.57Å; I4-L41 HydrophobicContact CD1-CD2 4.23Å; I4-L41 HydrophobicContact CD1-CG 3.87Å; I4-I108 HydrophobicContact CG2-CD1 3.91Å; I4-I108 HydrophobicContact CG2-CG2 4.11Å
5I95.3Very high95.7Very high7 Ų746.3 Ų46.34%0.03624%0.242CC..Hα-helixtrans-63.8-46.4-177.6-61.2166.6000111.3M1 L2 S8 L9 F57 I108 M109M1-I5 HydrophobicContact CB-CD1 3.85Å; M1-I5 HydrophobicContact CB-CG1 4.5Å; M1-I5 PolarHBondContact O-N 2.83Å; M1-I5 VanDerWaalsContact O-N 3.15Å; L2-I5 PolarHBondContact O-N 3.47Å; I5-S8 WeakPolarHBondContact CA-OG 3.16Å; I5-S8 PolarHBondContact O-N 2.96Å; I5-S8 PolarHBondContact O-OG 2.99Å; I5-L9 HydrophobicContact CG2-CD1 3.91Å; I5-L9 HydrophobicContact CG2-CG 4.44Å; I5-L9 PolarHBondContact O-N 3.44Å; I5-F57 HydrophobicContact CD1-CE1 4.1Å; I5-F57 HydrophobicContact CD1-CE2 4.08Å; I5-F57 HydrophobicContact CD1-CZ 3.85Å; I5-I108 HydrophobicContact CG1-CG2 4.27Å; I5-M109 HydrophobicContact CD1-CG 3.89Å; I5-M109 HydrophobicContact CG1-CG 4.23Å; I5-M109 HydrophobicContact CG2-SD 4.41Å
6I96.8Very high95.7Very high86 Ų8650.8 Ų50.844%0.44126%0.255SS..Hα-helixtrans-62.7-50.3-177.9-64.3166.7000111.1L2 S8 L9 M10L2-I6 HydrophobicContact CB-CD1 4.15Å; L2-I6 WeakPolarHBondContact O-CB 3.3Å; L2-I6 WeakPolarHBondContact O-CG1 3.48Å; L2-I6 PolarHBondContact O-N 3.44Å; I6-S8 VanDerWaalsContact C-N 3.28Å; I6-S8 PolarHBondContact O-N 3.5Å; I6-L9 WeakPolarHBondContact O-CB 3.43Å; I6-L9 PolarHBondContact O-N 2.71Å; I6-L9 VanDerWaalsContact O-N 3.17Å; I6-M10 HydrophobicContact CG2-CE 4.48Å; I6-M10 HydrophobicContact CG2-CG 4.42Å; I6-M10 WeakPolarHBondContact O-CG 3.17Å; I6-M10 PolarHBondContact O-N 3.11Å
7P96.7Very high95.7Very high51 Ų5156.7 Ų56.733%0.33129%0.287SS..Hα-helixtrans-56.6-39.5173-3037.9000113.8K3 I4 M10 L11 I34K3-P7 WeakPolarHBondContact O-CD 3.43Å; K3-P7 WeakPolarHBondContact O-CG 3.33Å; I4-P7 WeakPolarHBondContact O-CD 3.24Å; P7-M10 PolarHBondContact O-N 3.46Å; P7-L11 PolarHBondContact O-N 3.33Å; P7-I34 HydrophobicContact CB-CD1 4.01Å; P7-I34 HydrophobicContact CB-CG1 3.85Å
8S96.1Very high95.7Very high0 Ų054.2 Ų54.20%028%0.275CS..Hα-helixtrans-65.8-37.9177.165.10000112.8I4 I5 I6 M10 L11 I101 I105I4-S8 WeakPolarHBondContact O-CB 3.25Å; I4-S8 PolarHBondContact O-N 2.87Å; I4-S8 VanDerWaalsContact O-N 3.12Å; I4-S8 PolarHBondContact O-OG 3.14Å; I5-S8 WeakPolarHBondContact CA-OG 3.16Å; I5-S8 PolarHBondContact O-N 2.96Å; I5-S8 PolarHBondContact O-OG 2.99Å; I6-S8 VanDerWaalsContact C-N 3.28Å; I6-S8 PolarHBondContact O-N 3.5Å; S8-M10 VanDerWaalsContact C-N 3.34Å; S8-L11 WeakPolarHBondContact O-CB 3.15Å; S8-L11 PolarHBondContact O-N 3.09Å; S8-I101 WeakPolarHBondContact O-CG2 3.46Å; S8-I105 WeakPolarHBondContact OG-CG1 3.4Å
9L96.9Very high95.4Very high78 Ų7853.4 Ų53.441%0.40828%0.282SS..Hα-helixtrans-64.2-39.4171.6-78164.3000111.5I5 I6 L11 L12 P13 I105I5-L9 HydrophobicContact CG2-CD1 3.91Å; I5-L9 HydrophobicContact CG2-CG 4.44Å; I5-L9 PolarHBondContact O-N 3.44Å; I6-L9 WeakPolarHBondContact O-CB 3.43Å; I6-L9 PolarHBondContact O-N 2.71Å; I6-L9 VanDerWaalsContact O-N 3.17Å; L9-L11 PolarHBondContact O-N 2.84Å; L9-L12 WeakPolarHBondContact O-CB 3.47Å; L9-L12 PolarHBondContact O-N 2.91Å; L9-P13 WeakPolarHBondContact O-CD 3.16Å; L9-I105 HydrophobicContact CD2-CD1 3.8Å; L9-I105 HydrophobicContact CD2-CG2 4.3Å; L9-I105 HydrophobicContact CG-CD1 4.15Å; L9-I105 HydrophobicContact CG-CG2 4.42Å
10M97.3Very high94.9Very high116 Ų11654.7 Ų54.757%0.57129%0.294SS*.Hα-helixtrans-68-12.8177.8-67.1-62.6159.300113.6I6 P7 S8 L12 P13 L14I6-M10 HydrophobicContact CG2-CE 4.48Å; I6-M10 HydrophobicContact CG2-CG 4.42Å; I6-M10 WeakPolarHBondContact O-CG 3.17Å; I6-M10 PolarHBondContact O-N 3.11Å; P7-M10 PolarHBondContact O-N 3.46Å; S8-M10 VanDerWaalsContact C-N 3.34Å; M10-L12 VanDerWaalsContact C-N 3.26Å; M10-L12 PolarHBondContact O-N 3.09Å; M10-P13 VanDerWaalsContact O-CD 3.31Å; M10-P13 WeakPolarHBondContact O-CD 3.34Å; M10-P13 WeakPolarHBondContact O-CG 3.45Å; M10-P13 HydrophobicContact SD-CG 4.11Å; M10-L14 WeakPolarHBondContact O-CB 3.21Å; M10-L14 PolarHBondContact O-N 3.14Å
11L97.3Very high94.5Very high2 Ų261.5 Ų61.51%0.0132%0.321CS..Hα-helixtrans-65.9-29.2167.9-66.2178.8000112.2P7 S8 L9 L14 T15 I34 L74 I101P7-L11 PolarHBondContact O-N 3.33Å; S8-L11 WeakPolarHBondContact O-CB 3.15Å; S8-L11 PolarHBondContact O-N 3.09Å; L9-L11 PolarHBondContact O-N 2.84Å; L11-L14 WeakPolarHBondContact O-CB 3.36Å; L11-L14 PolarHBondContact O-N 3.33Å; L11-T15 VanDerWaalsContact O-CG2 3.31Å; L11-T15 WeakPolarHBondContact O-CG2 3.4Å; L11-T15 PolarHBondContact O-N 3.28Å; L11-I34 HydrophobicContact CD1-CD1 3.65Å; L11-I34 HydrophobicContact CD2-CD1 4.15Å; L11-I34 HydrophobicContact CG-CD1 3.81Å; L11-L74 HydrophobicContact CD1-CD2 3.64Å; L11-I101 HydrophobicContact CB-CD1 3.66Å; L11-I101 HydrophobicContact CB-CG1 4.06Å; L11-I101 HydrophobicContact CB-CG2 3.9Å; L11-I101 HydrophobicContact CD1-CG1 4.17Å; L11-I101 HydrophobicContact CD1-CG2 4.45Å
12L97.3Very high94.6Very high49 Ų4967.6 Ų67.626%0.25735%0.347SS..Hα-helixtrans-63.7-56.6177.4-66.9171.8000112.5L9 M10 L14 T15 W16 I101 I105L9-L12 WeakPolarHBondContact O-CB 3.47Å; L9-L12 PolarHBondContact O-N 2.91Å; M10-L12 VanDerWaalsContact C-N 3.26Å; M10-L12 PolarHBondContact O-N 3.09Å; L12-L14 PolarHBondContact O-N 3.26Å; L12-T15 PolarHBondContact O-N 3.3Å; L12-T15 PolarHBondContact O-OG1 3.05Å; L12-W16 VanDerWaalsContact O-CD1 3.23Å; L12-W16 PolarHBondContact O-N 3.45Å; L12-I101 HydrophobicContact CD2-CB 4.11Å; L12-I101 HydrophobicContact CD2-CG2 3.86Å; L12-I101 HydrophobicContact CG-CG2 3.9Å; L12-I105 HydrophobicContact CD1-CD1 4.31Å
13P96.9Very high94.7Very high55 Ų5562.7 Ų62.736%0.35732%0.321SS..Hα-helixtrans-60.4-32.9175.323.3-31.9000111.5L9 M10 T15 W16 L17L9-P13 WeakPolarHBondContact O-CD 3.16Å; M10-P13 VanDerWaalsContact O-CD 3.31Å; M10-P13 WeakPolarHBondContact O-CD 3.34Å; M10-P13 WeakPolarHBondContact O-CG 3.45Å; M10-P13 HydrophobicContact SD-CG 4.11Å; P13-T15 PolarHBondContact O-N 2.77Å; P13-W16 PolarHBondContact O-N 3.45Å; P13-L17 HydrophobicContact CB-CD1 4.32Å; P13-L17 VanDerWaalsContact O-CB 3.25Å; P13-L17 WeakPolarHBondContact O-CB 3.32Å; P13-L17 VanDerWaalsContact O-CG 3.24Å; P13-L17 WeakPolarHBondContact O-CG 3.45Å; P13-L17 PolarHBondContact O-N 2.97Å
14L96.9Very high94.8Very high39 Ų3959.4 Ų59.420%0.20431%0.306CS..Hα-helixtrans-62.8-39.5176.3-175.4143000113.2M10 L11 L12 S18 N26 V27 Y30M10-L14 WeakPolarHBondContact O-CB 3.21Å; M10-L14 PolarHBondContact O-N 3.14Å; L11-L14 WeakPolarHBondContact O-CB 3.36Å; L11-L14 PolarHBondContact O-N 3.33Å; L12-L14 PolarHBondContact O-N 3.26Å; L14-S18 WeakPolarHBondContact O-CB 3.3Å; L14-S18 PolarHBondContact O-N 3.08Å; L14-S18 VanDerWaalsContact O-N 3.11Å; L14-S18 PolarHBondContact O-OG 3.01Å; L14-N26 HydrophobicContact CD2-CB 3.9Å; L14-V27 HydrophobicContact CD2-CB 4.29Å; L14-V27 HydrophobicContact CD2-CG2 3.51Å; L14-Y30 HydrophobicContact CD1-CD2 3.25Å; L14-Y30 HydrophobicContact CD1-CE2 3.49Å; L14-Y30 VanDerWaalsContact CD1-CE2 3.49Å; L14-Y30 HydrophobicContact CD1-CG 3.95Å; L14-Y30 HydrophobicContact CD2-CD2 4.37Å; L14-Y30 HydrophobicContact CG-CD2 4.43Å
15T96.3Very high94.8Very high0 Ų063 Ų630%033%0.329CS..Hα-helixtrans-66.1-42.1175.858.10000111.8L11 L12 P13 S18 V27 K94 I97 I101L11-T15 VanDerWaalsContact O-CG2 3.31Å; L11-T15 WeakPolarHBondContact O-CG2 3.4Å; L11-T15 PolarHBondContact O-N 3.28Å; L12-T15 PolarHBondContact O-N 3.3Å; L12-T15 PolarHBondContact O-OG1 3.05Å; P13-T15 PolarHBondContact O-N 2.77Å; T15-S18 PolarHBondContact O-OG 2.95Å; T15-S18 VanDerWaalsContact O-OG 3.09Å; T15-V27 HydrophobicContact CG2-CG1 4.32Å; T15-V27 HydrophobicContact CG2-CG2 3.46Å; T15-V27 VanDerWaalsContact CG2-CG2 3.46Å; T15-K94 WeakPolarHBondContact O-CD 3.21Å; T15-K94 WeakPolarHBondContact O-CE 3.27Å; T15-K94 PolarHBondContact O-NZ 3.24Å; T15-I97 HydrophobicContact CG2-CB 4.19Å; T15-I97 HydrophobicContact CG2-CG2 3.42Å; T15-I97 VanDerWaalsContact CG2-CG2 3.42Å; T15-I101 HydrophobicContact CG2-CD1 3.38Å
16W96.3Very high94.9Very high118 Ų11865.1 Ų65.145%0.44734%0.34SS..Hα-helixtrans-75.7-38.8-175.5-72.7101.4000112.4L12 P13 K94 L95L12-W16 VanDerWaalsContact O-CD1 3.23Å; L12-W16 PolarHBondContact O-N 3.45Å; P13-W16 PolarHBondContact O-N 3.45Å; W16-K94 HydrophobicContact CE3-CB 4.44Å; W16-K94 HydrophobicContact CE3-CD 4.19Å; W16-K94 HydrophobicContact CH2-CB 4.47Å; W16-K94 HydrophobicContact CZ3-CB 4.38Å; W16-K94 PolarHBondContact O-NZ 3.16Å; W16-L95 HydrophobicContact CH2-CD2 3.84Å; W16-L95 HydrophobicContact CH2-CG 3.98Å; W16-L95 HydrophobicContact CZ2-CD2 3.77Å; W16-L95 HydrophobicContact CZ2-CG 4.22Å
17L95.6Very high94.9Very high151 Ų15161 Ų6179%0.79132%0.319SS*.Hα-helixtrans-81.8-19.1-179.6-63.6172.8000113.8P13P13-L17 HydrophobicContact CB-CD1 4.32Å; P13-L17 VanDerWaalsContact O-CB 3.25Å; P13-L17 WeakPolarHBondContact O-CB 3.32Å; P13-L17 VanDerWaalsContact O-CG 3.24Å; P13-L17 WeakPolarHBondContact O-CG 3.45Å; P13-L17 PolarHBondContact O-N 2.97Å
18S94.7Very high94.9Very high11 Ų1159.7 Ų59.78%0.07731%0.31CS..SBendtrans-71.1141.7177.750.50000112.6L14 T15 T23 K94L14-S18 WeakPolarHBondContact O-CB 3.3Å; L14-S18 PolarHBondContact O-N 3.08Å; L14-S18 VanDerWaalsContact O-N 3.11Å; L14-S18 PolarHBondContact O-OG 3.01Å; T15-S18 PolarHBondContact O-OG 2.95Å; T15-S18 VanDerWaalsContact O-OG 3.09Å; S18-T23 WeakPolarHBondContact OG-CG2 3.38Å; S18-K94 WeakPolarHBondContact O-CE 3.41Å; S18-K94 PolarHBondContact O-NZ 3.31Å
19G90.9Very high94.9Very high40 Ų4062.4 Ų62.441%0.41233%0.329SS..  trans-66.4151.4174.400000112K21 K22 T23G19-K21 VanDerWaalsContact C-N 3.28Å; G19-K21 PolarHBondContact O-N 3.01Å; G19-K21 VanDerWaalsContact O-N 3.09Å; G19-K22 PolarHBondContact O-N 3.33Å; G19-T23 WeakPolarHBondContact O-CG2 3.46Å; G19-T23 PolarHBondContact O-N 2.64Å; G19-T23 VanDerWaalsContact O-N 3.14Å
20P85.7Confident94.9Very high79 Ų7964.2 Ų64.251%0.51333%0.331SS..THydrogen-bonded Turntrans-55.4-36.3-166.320.6-33.2000114.4T23P20-T23 PolarHBondContact O-OG1 3.38Å
21K87Confident94.9Very high198 Ų19858.7 Ų58.786%0.86130%0.304SS*.THydrogen-bonded Turntrans-76.5-24.5179.8-64-176.5179.8-179.80113.6G19G19-K21 VanDerWaalsContact C-N 3.28Å; G19-K21 PolarHBondContact O-N 3.01Å; G19-K21 VanDerWaalsContact O-N 3.09Å
22K92.8Very high94.9Very high137 Ų13760.7 Ų60.760%0.59631%0.313SS*.THydrogen-bonded Turntrans-103.7-3.7-174-65.1-173.2178.6-177.40113.4G19 W24 T25 N26G19-K22 PolarHBondContact O-N 3.33Å; K22-W24 PolarHBondContact O-N 2.9Å; K22-T25 WeakPolarHBondContact CA-OG1 3.15Å; K22-T25 PolarHBondContact O-N 3.17Å; K22-T25 PolarHBondContact O-OG1 3.21Å; K22-N26 VanDerWaalsContact O-CB 3.3Å; K22-N26 WeakPolarHBondContact O-CB 3.44Å; K22-N26 PolarHBondContact O-N 3.39Å; K22-N26 PolarHBondContact O-OD1 3.04Å
23T94.4Very high94.9Very high1 Ų163 Ų631%0.00632%0.324CS..Hα-helixtrans-54.7-56.5-179.552.40000110.9S18 G19 P20 T25 N26 V27 K94S18-T23 WeakPolarHBondContact OG-CG2 3.38Å; G19-T23 WeakPolarHBondContact O-CG2 3.46Å; G19-T23 PolarHBondContact O-N 2.64Å; G19-T23 VanDerWaalsContact O-N 3.14Å; P20-T23 PolarHBondContact O-OG1 3.38Å; T23-T25 PolarHBondContact O-N 3.32Å; T23-N26 PolarHBondContact O-N 3.02Å; T23-V27 WeakPolarHBondContact O-CB 3.5Å; T23-V27 WeakPolarHBondContact O-CG2 3.33Å; T23-V27 PolarHBondContact O-N 2.82Å; T23-K94 HydrophobicContact CG2-CG 4.38Å
24W94.8Very high95Very high29 Ų2960.7 Ų60.711%0.1131%0.309CS..Hα-helixtrans-62.8-41.6-178-67.898.2000113K22 T28 L78 S81 Q82 L85 Q93 Y96 I97K22-W24 PolarHBondContact O-N 2.9Å; W24-T28 VanDerWaalsContact O-CB 3.3Å; W24-T28 WeakPolarHBondContact O-CB 3.35Å; W24-T28 WeakPolarHBondContact O-CG2 3.1Å; W24-T28 PolarHBondContact O-N 3.22Å; W24-T28 PolarHBondContact O-OG1 3.03Å; W24-L78 HydrophobicContact CE3-CB 4.36Å; W24-L78 HydrophobicContact CE3-CD2 4.35Å; W24-L78 HydrophobicContact CZ3-CB 4.26Å; W24-L78 HydrophobicContact CZ3-CD2 3.87Å; W24-L78 WeakPolarHBondContact CZ3-O 3.21Å; W24-S81 WeakPolarHBondContact CZ3-OG 3.49Å; W24-Q82 HydrophobicContact CD2-CB 4.02Å; W24-Q82 HydrophobicContact CE3-CB 3.93Å; W24-Q82 HydrophobicContact CZ3-CB 4.19Å; W24-L85 HydrophobicContact CH2-CD1 3.69Å; W24-L85 HydrophobicContact CZ2-CB 4.28Å; W24-L85 HydrophobicContact CZ2-CD1 3.94Å; W24-Q93 HydrophobicContact CZ2-CB 4.42Å; W24-Y96 HydrophobicContact CH2-CD1 4.31Å; W24-I97 HydrophobicContact CD2-CD1 4.02Å; W24-I97 HydrophobicContact CE3-CD1 4.08Å; W24-I97 HydrophobicContact CE3-CG1 4.44Å; W24-I97 HydrophobicContact CH2-CD1 4.02Å; W24-I97 HydrophobicContact CH2-CG1 3.83Å; W24-I97 HydrophobicContact CZ2-CD1 3.97Å; W24-I97 HydrophobicContact CZ2-CG1 4.21Å; W24-I97 HydrophobicContact CZ3-CD1 4.08Å; W24-I97 HydrophobicContact CZ3-CG1 3.97Å
25T95.7Very high94.9Very high77 Ų7759 Ų5947%0.47230%0.301SS..Hα-helixtrans-70-41.8-178.654.90000112.2K22 T23 T28 S29K22-T25 WeakPolarHBondContact CA-OG1 3.15Å; K22-T25 PolarHBondContact O-N 3.17Å; K22-T25 PolarHBondContact O-OG1 3.21Å; T23-T25 PolarHBondContact O-N 3.32Å; T25-T28 WeakPolarHBondContact CA-OG1 3.49Å; T25-T28 PolarHBondContact O-OG1 2.94Å; T25-T28 VanDerWaalsContact O-OG1 3.06Å; T25-S29 WeakPolarHBondContact O-CB 3.3Å; T25-S29 PolarHBondContact O-N 3.2Å; T25-S29 PolarHBondContact O-OG 2.92Å
26N96.6Very high94.9Very high51 Ų5164.1 Ų64.127%0.27333%0.327SS..Hα-helixtrans-69-48.4-179.5-66.3-0.4000109.5L14 K22 T23 T28 S29 Y30L14-N26 HydrophobicContact CD2-CB 3.9Å; K22-N26 VanDerWaalsContact O-CB 3.3Å; K22-N26 WeakPolarHBondContact O-CB 3.44Å; K22-N26 PolarHBondContact O-N 3.39Å; K22-N26 PolarHBondContact O-OD1 3.04Å; T23-N26 PolarHBondContact O-N 3.02Å; N26-T28 VanDerWaalsContact C-N 3.34Å; N26-T28 PolarHBondContact O-N 3.29Å; N26-S29 PolarHBondContact O-N 2.76Å; N26-S29 PolarHBondContact O-OG 3.17Å; N26-Y30 WeakPolarHBondContact O-CD2 3.2Å; N26-Y30 PolarHBondContact O-N 3.37Å
27V97Very high94.8Very high0 Ų061.4 Ų61.40%032%0.324CS..Hα-helixtrans-65.8-39.2-177.6-174.50000111.2L14 T15 T23 S31 L78 I97 I101L14-V27 HydrophobicContact CD2-CB 4.29Å; L14-V27 HydrophobicContact CD2-CG2 3.51Å; T15-V27 HydrophobicContact CG2-CG1 4.32Å; T15-V27 HydrophobicContact CG2-CG2 3.46Å; T15-V27 VanDerWaalsContact CG2-CG2 3.46Å; T23-V27 WeakPolarHBondContact O-CB 3.5Å; T23-V27 WeakPolarHBondContact O-CG2 3.33Å; T23-V27 PolarHBondContact O-N 2.82Å; V27-S31 VanDerWaalsContact O-CB 3.24Å; V27-S31 WeakPolarHBondContact O-CB 3.33Å; V27-S31 PolarHBondContact O-N 3.23Å; V27-S31 PolarHBondContact O-OG 3.33Å; V27-L78 HydrophobicContact CB-CD1 4.2Å; V27-L78 HydrophobicContact CG1-CD1 3.54Å; V27-I97 HydrophobicContact CB-CG2 4.41Å; V27-I97 HydrophobicContact CG1-CG2 3.81Å; V27-I97 HydrophobicContact CG2-CG2 4.23Å; V27-I101 HydrophobicContact CG1-CD1 4.09Å
28T96.9Very high94.8Very high23 Ų2354.3 Ų54.314%0.14129%0.287CS..Hα-helixtrans-64.1-46.3175.849.60000112W24 T25 N26 S31 F32 L78W24-T28 VanDerWaalsContact O-CB 3.3Å; W24-T28 WeakPolarHBondContact O-CB 3.35Å; W24-T28 WeakPolarHBondContact O-CG2 3.1Å; W24-T28 PolarHBondContact O-N 3.22Å; W24-T28 PolarHBondContact O-OG1 3.03Å; T25-T28 WeakPolarHBondContact CA-OG1 3.49Å; T25-T28 PolarHBondContact O-OG1 2.94Å; T25-T28 VanDerWaalsContact O-OG1 3.06Å; N26-T28 VanDerWaalsContact C-N 3.34Å; N26-T28 PolarHBondContact O-N 3.29Å; T28-S31 WeakPolarHBondContact CA-OG 3.47Å; T28-S31 PolarHBondContact O-N 3.28Å; T28-S31 PolarHBondContact O-OG 3.45Å; T28-F32 WeakPolarHBondContact O-CD2 3.31Å; T28-F32 PolarHBondContact O-N 3.39Å; T28-L78 HydrophobicContact CG2-CB 3.55Å; T28-L78 HydrophobicContact CG2-CD1 4Å; T28-L78 HydrophobicContact CG2-CG 4.44Å
29S96.4Very high94.7Very high57 Ų5757.6 Ų57.640%0.39930%0.303SS..Hα-helixtrans-63-47.5178.752.30000113T25 N26 S31 F32 L33T25-S29 WeakPolarHBondContact O-CB 3.3Å; T25-S29 PolarHBondContact O-N 3.2Å; T25-S29 PolarHBondContact O-OG 2.92Å; N26-S29 PolarHBondContact O-N 2.76Å; N26-S29 PolarHBondContact O-OG 3.17Å; S29-S31 VanDerWaalsContact C-N 3.34Å; S29-S31 PolarHBondContact O-N 2.95Å; S29-F32 PolarHBondContact O-N 3.11Å; S29-L33 PolarHBondContact O-N 2.9Å; S29-L33 VanDerWaalsContact O-N 3.08Å
30Y97.1Very high94.7Very high115 Ų11558.7 Ų58.745%0.45130%0.302SS..Hα-helixtrans-68.7-31178.1-73.5-73.2000112.9L14 N26 L33 I34L14-Y30 HydrophobicContact CD1-CD2 3.25Å; L14-Y30 HydrophobicContact CD1-CE2 3.49Å; L14-Y30 VanDerWaalsContact CD1-CE2 3.49Å; L14-Y30 HydrophobicContact CD1-CG 3.95Å; L14-Y30 HydrophobicContact CD2-CD2 4.37Å; L14-Y30 HydrophobicContact CG-CD2 4.43Å; N26-Y30 WeakPolarHBondContact O-CD2 3.2Å; N26-Y30 PolarHBondContact O-N 3.37Å; Y30-L33 HydrophobicContact CD1-CD1 3.82Å; Y30-L33 HydrophobicContact CE1-CD1 4.22Å; Y30-L33 WeakPolarHBondContact O-CB 3.42Å; Y30-L33 PolarHBondContact O-N 3.12Å; Y30-I34 WeakPolarHBondContact O-CG1 3.31Å; Y30-I34 PolarHBondContact O-N 3.3Å
31S97.4Very high94.9Very high0 Ų055 Ų550%028%0.277CS..Hα-helixtrans-69.6-34.1173.656.80000113.1V27 T28 S29 I34 S35 L74 P75V27-S31 VanDerWaalsContact O-CB 3.24Å; V27-S31 WeakPolarHBondContact O-CB 3.33Å; V27-S31 PolarHBondContact O-N 3.23Å; V27-S31 PolarHBondContact O-OG 3.33Å; T28-S31 WeakPolarHBondContact CA-OG 3.47Å; T28-S31 PolarHBondContact O-N 3.28Å; T28-S31 PolarHBondContact O-OG 3.45Å; S29-S31 VanDerWaalsContact C-N 3.34Å; S29-S31 PolarHBondContact O-N 2.95Å; S31-I34 PolarHBondContact O-N 3.4Å; S31-S35 PolarHBondContact O-N 2.95Å; S31-L74 VanDerWaalsContact CB-CD2 3.4Å; S31-P75 WeakPolarHBondContact OG-CB 3.38Å
32F97.4Very high94.9Very high45 Ų4548.2 Ų48.220%0.19725%0.25CS..Hα-helixtrans-65.2-36.3167.7-79-63.5000112.8T28 S29 I34 S35 L36 W72 P75 L76 M79 L440T28-F32 WeakPolarHBondContact O-CD2 3.31Å; T28-F32 PolarHBondContact O-N 3.39Å; S29-F32 PolarHBondContact O-N 3.11Å; F32-I34 VanDerWaalsContact C-N 3.3Å; F32-I34 PolarHBondContact O-N 2.97Å; F32-S35 WeakPolarHBondContact CA-OG 3.38Å; F32-S35 PolarHBondContact O-N 3.31Å; F32-S35 PolarHBondContact O-OG 2.74Å; F32-L36 WeakPolarHBondContact O-CG 3.5Å; F32-L36 PolarHBondContact O-N 2.61Å; F32-W72 HydrophobicContact CD1-CZ3 4.21Å; F32-W72 HydrophobicContact CE1-CH2 4.22Å; F32-W72 HydrophobicContact CE1-CZ3 4.23Å; F32-P75 HydrophobicContact CD1-CB 3.79Å; F32-P75 HydrophobicContact CD1-CG 3.63Å; F32-P75 HydrophobicContact CD2-CB 3.75Å; F32-P75 HydrophobicContact CD2-CG 4.45Å; F32-P75 HydrophobicContact CE1-CB 3.6Å; F32-P75 HydrophobicContact CE1-CG 3.61Å; F32-P75 HydrophobicContact CE2-CB 3.56Å; F32-P75 HydrophobicContact CE2-CG 4.44Å; F32-P75 HydrophobicContact CG-CB 3.86Å; F32-P75 HydrophobicContact CG-CG 4.07Å; F32-P75 HydrophobicContact CZ-CB 3.49Å; F32-P75 VanDerWaalsContact CZ-CB 3.49Å; F32-P75 HydrophobicContact CZ-CG 4.05Å; F32-L76 HydrophobicContact CE1-CD1 4.27Å; F32-M79 HydrophobicContact CE2-CE 3.54Å; F32-M79 HydrophobicContact CZ-CE 3.79Å; F32-M79 HydrophobicContact CZ-SD 4.29Å; F32-L440 HydrophobicContact CE1-CD1 4.24Å; F32-L440 HydrophobicContact CE1-CD2 4.47Å; F32-L440 HydrophobicContact CZ-CD1 3.77Å
33L97Very high94.2Very high96 Ų9650.6 Ų50.650%0.50326%0.256SS..Hα-helixtrans-62-40.6172.8-70172.6000111.1S29 Y30 L36 V37S29-L33 PolarHBondContact O-N 2.9Å; S29-L33 VanDerWaalsContact O-N 3.08Å; Y30-L33 HydrophobicContact CD1-CD1 3.82Å; Y30-L33 HydrophobicContact CE1-CD1 4.22Å; Y30-L33 WeakPolarHBondContact O-CB 3.42Å; Y30-L33 PolarHBondContact O-N 3.12Å; L33-L36 PolarHBondContact O-N 3.12Å; L33-V37 WeakPolarHBondContact O-CG2 3.48Å; L33-V37 PolarHBondContact O-N 3.12Å
34I97.3Very high93Very high8 Ų853 Ų534%0.04127%0.267CS..Hα-helixtrans-64.5-40.3175.2-65.6165.8000111.3I4 P7 L11 Y30 S31 F32 L36 V37 S38I4-I34 HydrophobicContact CG2-CG2 4.13Å; P7-I34 HydrophobicContact CB-CD1 4.01Å; P7-I34 HydrophobicContact CB-CG1 3.85Å; L11-I34 HydrophobicContact CD1-CD1 3.65Å; L11-I34 HydrophobicContact CD2-CD1 4.15Å; L11-I34 HydrophobicContact CG-CD1 3.81Å; Y30-I34 WeakPolarHBondContact O-CG1 3.31Å; Y30-I34 PolarHBondContact O-N 3.3Å; S31-I34 PolarHBondContact O-N 3.4Å; F32-I34 VanDerWaalsContact C-N 3.3Å; F32-I34 PolarHBondContact O-N 2.97Å; I34-L36 VanDerWaalsContact C-N 3.34Å; I34-V37 PolarHBondContact O-N 3.27Å; I34-S38 PolarHBondContact O-N 2.93Å
35S96.4Very high91.1Very high4 Ų455.8 Ų55.83%0.02829%0.287CS..Hα-helixtrans-67.7-32.4176.974.10000112.8S31 F32 S38S31-S35 PolarHBondContact O-N 2.95Å; F32-S35 WeakPolarHBondContact CA-OG 3.38Å; F32-S35 PolarHBondContact O-N 3.31Å; F32-S35 PolarHBondContact O-OG 2.74Å; S35-S38 PolarHBondContact O-N 2.9Å; S35-S38 PolarHBondContact O-OG 3.43Å
36L95.6Very high89.1Confident106 Ų10658.7 Ų58.756%0.55530%0.3SS*.Hα-helixtrans-67.7-42170.4-71.8169.6000111.8F32 L33 I34 S38 L39F32-L36 WeakPolarHBondContact O-CG 3.5Å; F32-L36 PolarHBondContact O-N 2.61Å; L33-L36 PolarHBondContact O-N 3.12Å; I34-L36 VanDerWaalsContact C-N 3.34Å; L36-S38 VanDerWaalsContact C-N 3.28Å; L36-S38 PolarHBondContact O-N 2.91Å; L36-L39 HydrophobicContact CD2-CD1 4.37Å; L36-L39 WeakPolarHBondContact O-CB 3.41Å; L36-L39 PolarHBondContact O-N 3.44Å
37V94.9Very high87Confident62 Ų6261.2 Ų61.238%0.37631%0.31SS..Hα-helixtrans-64.6-32.8176.1173.10000111.4I4 L33 I34 L39 T40I4-V37 HydrophobicContact CG1-CG1 4.28Å; L33-V37 WeakPolarHBondContact O-CG2 3.48Å; L33-V37 PolarHBondContact O-N 3.12Å; I34-V37 PolarHBondContact O-N 3.27Å; V37-L39 PolarHBondContact O-N 2.82Å; V37-T40 WeakPolarHBondContact O-CB 3.43Å; V37-T40 WeakPolarHBondContact O-CG2 3.45Å; V37-T40 PolarHBondContact O-N 3.26Å; V37-T40 VanDerWaalsContact O-N 3.12Å; V37-T40 PolarHBondContact O-OG1 3.46Å
38S94.8Very high84.8Confident1 Ų165.5 Ų65.51%0.00734%0.34CS..Hα-helixtrans-64.3-27.7179.377.30000112.9I34 S35 L36 T40 L41I34-S38 PolarHBondContact O-N 2.93Å; S35-S38 PolarHBondContact O-N 2.9Å; S35-S38 PolarHBondContact O-OG 3.43Å; L36-S38 VanDerWaalsContact C-N 3.28Å; L36-S38 PolarHBondContact O-N 2.91Å; S38-T40 PolarHBondContact O-N 2.96Å; S38-T40 VanDerWaalsContact O-N 3.12Å; S38-L41 VanDerWaalsContact O-CB 3.25Å; S38-L41 WeakPolarHBondContact O-CB 3.36Å; S38-L41 WeakPolarHBondContact O-CG 3.36Å; S38-L41 PolarHBondContact O-N 3Å
39L92.8Very high82.6Confident80 Ų8073.2 Ų73.242%0.41937%0.368SS..G310 helixtrans-60-23.3174.6-64.5173.1000113.1L36 V37 L41 L42 I68L36-L39 HydrophobicContact CD2-CD1 4.37Å; L36-L39 WeakPolarHBondContact O-CB 3.41Å; L36-L39 PolarHBondContact O-N 3.44Å; V37-L39 PolarHBondContact O-N 2.82Å; L39-L41 PolarHBondContact O-N 3.18Å; L39-L42 HydrophobicContact CD2-CD1 3.93Å; L39-L42 VanDerWaalsContact O-CB 3.31Å; L39-L42 WeakPolarHBondContact O-CB 3.42Å; L39-L42 WeakPolarHBondContact O-CG 3.46Å; L39-L42 PolarHBondContact O-N 2.83Å; L39-I68 HydrophobicContact CD2-CG2 3.9Å
40T91Very high81.1Confident64 Ų6473.5 Ų73.539%0.39336%0.362SS..G310 helixtrans-63.2-12.5173.666.30000113.5K3 V37 S38 L42K3-T40 PolarHBondContact NZ-OG1 3.05Å; V37-T40 WeakPolarHBondContact O-CB 3.43Å; V37-T40 WeakPolarHBondContact O-CG2 3.45Å; V37-T40 PolarHBondContact O-N 3.26Å; V37-T40 VanDerWaalsContact O-N 3.12Å; V37-T40 PolarHBondContact O-OG1 3.46Å; S38-T40 PolarHBondContact O-N 2.96Å; S38-T40 VanDerWaalsContact O-N 3.12Å; T40-L42 VanDerWaalsContact C-N 3.34Å
41L89.3Confident79.4Confident0 Ų070.4 Ų70.40%035%0.351CS..G310 helixtrans-74.7-21.7171.9-64.6176.8000113M1 I4 S38 L39 W43 F53 T64 I67M1-L41 HydrophobicContact CE-CD1 4.31Å; M1-L41 HydrophobicContact SD-CD1 4.24Å; M1-L41 HydrophobicContact SD-CD2 3.96Å; I4-L41 HydrophobicContact CD1-CD1 3.57Å; I4-L41 HydrophobicContact CD1-CD2 4.23Å; I4-L41 HydrophobicContact CD1-CG 3.87Å; S38-L41 VanDerWaalsContact O-CB 3.25Å; S38-L41 WeakPolarHBondContact O-CB 3.36Å; S38-L41 WeakPolarHBondContact O-CG 3.36Å; S38-L41 PolarHBondContact O-N 3Å; L39-L41 PolarHBondContact O-N 3.18Å; L41-W43 PolarHBondContact O-N 2.84Å; L41-W43 VanDerWaalsContact O-N 3.16Å; L41-F53 HydrophobicContact CD2-CE2 4.02Å; L41-F53 HydrophobicContact CD2-CZ 3.57Å; L41-T64 HydrophobicContact CB-CG2 3.95Å; L41-I67 HydrophobicContact CD1-CB 4.15Å; L41-I67 HydrophobicContact CD1-CD1 4.34Å; L41-I67 HydrophobicContact CD1-CG2 3.53Å
42L86.5Confident78.4Confident56 Ų5674.8 Ų74.829%0.29337%0.374SS..G310 helixtrans-64.9-15.8177.2-66.4175.2000113L39 T40 Q44 I68 L454L39-L42 HydrophobicContact CD2-CD1 3.93Å; L39-L42 VanDerWaalsContact O-CB 3.31Å; L39-L42 WeakPolarHBondContact O-CB 3.42Å; L39-L42 WeakPolarHBondContact O-CG 3.46Å; L39-L42 PolarHBondContact O-N 2.83Å; T40-L42 VanDerWaalsContact C-N 3.34Å; L42-Q44 PolarHBondContact O-N 3.09Å; L42-I68 HydrophobicContact CD1-CD1 4.16Å; L42-I68 HydrophobicContact CD2-CD1 3.34Å; L42-I68 HydrophobicContact CG-CD1 3.49Å; L42-I68 VanDerWaalsContact CG-CD1 3.49Å; L42-L454 HydrophobicContact CD1-CD1 4.4Å; L42-L454 HydrophobicContact CD2-CD2 4.34Å
43W78.7Confident77.6Confident187 Ų18776.1 Ų76.171%0.70838%0.38SS*.  trans-74.679.3173.4-169.146.8000110.5L41 T45 K51L41-W43 PolarHBondContact O-N 2.84Å; L41-W43 VanDerWaalsContact O-N 3.16Å; W43-T45 HydrophobicContact CZ2-CG2 4.22Å; W43-K51 PolarHBondContact O-NZ 3.21Å
44Q69.6Low77.2Confident52 Ų5274.3 Ų74.324%0.24338%0.376CS..  trans-106.5110.4170.8-71.1175.4-31.900107.1L42 D60 T61 T64L42-Q44 PolarHBondContact O-N 3.09Å; Q44-D60 PolarHBondContact NE2-O 3.24Å; Q44-T61 VanDerWaalsContact OE1-CG2 3.24Å; Q44-T64 PolarHBondContact NE2-OG1 3.38Å; Q44-T64 PolarHBondContact OE1-OG1 2.89Å
45T54.9Low76.6Confident87 Ų8780.7 Ų80.753%0.53441%0.41SS..  trans-83112.4175.6480000108.2W43W43-T45 HydrophobicContact CZ2-CG2 4.22Å
46D53.7Low76.3Confident139 Ų13986.1 Ų86.174%0.74344%0.436SS*.SBendtrans48.2143175.7-63.3-23.5000117.6S48 Y49D46-S48 PolarHBondContact O-N 3.24Å; D46-Y49 PolarHBondContact O-N 3.2Å
47E52.9Low76.2Confident103 Ų10382.1 Ų82.148%0.48142%0.415SS..THydrogen-bonded Turntrans-50.6-19-173.6-64.4-89.3150.400114.7T459E47-T459 PolarHBondContact OE1-OG1 3.33Å; E47-T459 PolarHBondContact OE2-OG1 2.97Å
48S49.8Very low76Confident91 Ų9179.5 Ų79.564%0.63640%0.399SS*.THydrogen-bonded Turntrans-84.9-20-172.155.90000115.3D46D46-S48 PolarHBondContact O-N 3.24Å
49Y51.9Low75.8Confident184 Ų18479.4 Ų79.472%0.72240%0.398SS*.  trans-121.594.9-177.9-69.3-77.6000112.1D46 K51D46-Y49 PolarHBondContact O-N 3.2Å; Y49-K51 PolarHBondContact O-N 3.17Å
50K63Low75.7Confident63 Ų6375.9 Ų75.927%0.27438%0.38SS..  trans-47.5129.2160.9-70.4176.4178.3167.40108.6N52 D60 M178K50-N52 VanDerWaalsContact C-N 3.31Å; K50-N52 PolarHBondContact O-N 2.98Å; K50-D60 HydrophobicContact CD-CB 4.42Å; K50-D60 HydrophobicContact CG-CB 3.93Å; K50-M178 HydrophobicContact CB-CE 3.83Å; K50-M178 HydrophobicContact CB-SD 4.34Å; K50-M178 HydrophobicContact CD-CE 3.61Å; K50-M178 HydrophobicContact CD-SD 3.31Å; K50-M178 WeakPolarHBondContact CD-SD 3.44Å; K50-M178 HydrophobicContact CG-CE 4.29Å; K50-M178 HydrophobicContact CG-SD 4.46Å
51K62.8Low75.6Confident51 Ų5174.4 Ų74.422%0.22237%0.371CS..EExtended strand (participates in β ladder)trans-73.690.9-179.2-160.5171.4-166.5160.10108.7W43 Y49 F53 S59W43-K51 PolarHBondContact O-NZ 3.21Å; Y49-K51 PolarHBondContact O-N 3.17Å; K51-F53 HydrophobicContact CD-CE1 3.95Å; K51-F53 HydrophobicContact CD-CZ 3.82Å; K51-F53 HydrophobicContact CG-CE1 4.01Å; K51-F53 HydrophobicContact CG-CZ 3.99Å; K51-S59 WeakPolarHBondContact CB-O 3.15Å; K51-S59 PolarHBondContact N-O 3.5Å; K51-S59 VanDerWaalsContact N-O 3.11Å; K51-S59 PolarHBondContact O-N 3.45Å
52N75.6Confident75.7Confident91 Ų9174.7 Ų74.749%0.48737%0.372SS..EExtended strand (participates in β ladder)trans-79.3119.7174.2-68.8-15.3000108.5K50 M178K50-N52 VanDerWaalsContact C-N 3.31Å; K50-N52 PolarHBondContact O-N 2.98Å; N52-M178 VanDerWaalsContact ND2-CE 3.25Å; N52-M178 WeakPolarHBondContact ND2-CE 2.87Å; N52-M178 WeakPolarHBondContact OD1-CE 3.27Å
53F81Confident76.1Confident73 Ų7372 Ų7232%0.3236%0.358SS..  trans-92.9-45.4174.8-61.4-72.5000111.3M1 L41 K51 F57 S59M1-F53 HydrophobicContact CG-CD2 3.75Å; M1-F53 HydrophobicContact CG-CE2 3.94Å; M1-F53 HydrophobicContact SD-CD2 4.12Å; M1-F53 HydrophobicContact SD-CE2 3.65Å; M1-F53 HydrophobicContact SD-CZ 4.43Å; L41-F53 HydrophobicContact CD2-CE2 4.02Å; L41-F53 HydrophobicContact CD2-CZ 3.57Å; K51-F53 HydrophobicContact CD-CE1 3.95Å; K51-F53 HydrophobicContact CD-CZ 3.82Å; K51-F53 HydrophobicContact CG-CE1 4.01Å; K51-F53 HydrophobicContact CG-CZ 3.99Å; F53-F57 WeakPolarHBondContact CB-O 3.39Å; F53-F57 PolarHBondContact N-O 3.11Å; F53-F57 VanDerWaalsContact N-O 3.15Å; F53-S59 WeakPolarHBondContact CE2-OG 3.21Å
54S87.7Confident76.8Confident58 Ų5863.1 Ų63.141%0.40633%0.325SS..SBendtrans-156.6175.2179.366.90000110M56 F57S54-M56 PolarHBondContact O-N 3.12Å; S54-M56 VanDerWaalsContact O-N 3.14Å; S54-M56 PolarHBondContact OG-N 3.2Å; S54-F57 PolarHBondContact N-O 2.92Å; S54-F57 VanDerWaalsContact N-O 3.11Å; S54-F57 PolarHBondContact O-N 3.31Å; S54-F57 VanDerWaalsContact O-O 3.13Å; S54-F57 PolarHBondContact OG-N 3.04Å
55N86.3Confident78Confident142 Ų14261.1 Ų61.176%0.75932%0.316SS*.SBendtrans-58.7-26.4177-67.26.4000113.4T114N55-T114 WeakPolarHBondContact O-CB 3.33Å; N55-T114 PolarHBondContact O-OG1 2.74Å
56M90.1Very high80Confident119 Ų11957.2 Ų57.259%0.58629%0.292SS*.SBendtrans-93.8-27.7-179.4-67.5179.1176.800113.8S54 T114 M118S54-M56 PolarHBondContact O-N 3.12Å; S54-M56 VanDerWaalsContact O-N 3.14Å; S54-M56 PolarHBondContact OG-N 3.2Å; M56-T114 VanDerWaalsContact CA-OG1 3.26Å; M56-T114 WeakPolarHBondContact CA-OG1 3.4Å; M56-T114 PolarHBondContact O-N 2.97Å; M56-T114 VanDerWaalsContact O-N 3.16Å; M56-T114 PolarHBondContact O-OG1 3.37Å; M56-M118 HydrophobicContact CB-CE 4.44Å; M56-M118 HydrophobicContact CB-SD 4.49Å; M56-M118 VanDerWaalsContact O-CE 3.3Å; M56-M118 WeakPolarHBondContact O-CE 3.36Å
57F92.9Very high82.1Confident22 Ų2250.6 Ų50.610%0.09626%0.257CS..BIsolated β-bridgetrans-132.1126.7-171.2-61.8-67.8000113.1M1 I5 F53 S54 M109 S112 M118M1-F57 HydrophobicContact CB-CB 3.82Å; M1-F57 HydrophobicContact CB-CD1 4.35Å; M1-F57 HydrophobicContact CB-CD2 4.42Å; M1-F57 HydrophobicContact CB-CG 3.96Å; M1-F57 HydrophobicContact CG-CB 3.73Å; M1-F57 HydrophobicContact CG-CG 4.27Å; I5-F57 HydrophobicContact CD1-CE1 4.1Å; I5-F57 HydrophobicContact CD1-CE2 4.08Å; I5-F57 HydrophobicContact CD1-CZ 3.85Å; F53-F57 WeakPolarHBondContact CB-O 3.39Å; F53-F57 PolarHBondContact N-O 3.11Å; F53-F57 VanDerWaalsContact N-O 3.15Å; S54-F57 PolarHBondContact N-O 2.92Å; S54-F57 VanDerWaalsContact N-O 3.11Å; S54-F57 PolarHBondContact O-N 3.31Å; S54-F57 VanDerWaalsContact O-O 3.13Å; S54-F57 PolarHBondContact OG-N 3.04Å; F57-M109 HydrophobicContact CE1-CB 4.18Å; F57-M109 HydrophobicContact CE1-CG 4.15Å; F57-M109 HydrophobicContact CZ-CG 4.33Å; F57-M109 HydrophobicContact CZ-SD 4.47Å; F57-S112 CarbonylContact C-O 3.36Å; F57-S112 VanDerWaalsContact CA-O 3.24Å; F57-S112 WeakPolarHBondContact CA-O 3.46Å; F57-S112 VanDerWaalsContact CD1-OG 3.32Å; F57-S112 WeakPolarHBondContact CD1-OG 3.44Å; F57-M118 HydrophobicContact CD1-CE 3.98Å; F57-M118 HydrophobicContact CE1-CE 3.51Å; F57-M118 HydrophobicContact CZ-CE 4.02Å
58S91.3Very high84.2Confident6 Ų647 Ų474%0.04224%0.24CC..EExtended strand (participates in β ladder)trans-133.6160.5174.267.40000110.5S112 T114S58-S112 PolarHBondContact N-O 3Å; S58-S112 VanDerWaalsContact O-CA 3.29Å; S58-S112 WeakPolarHBondContact O-CA 3.28Å; S58-S112 WeakPolarHBondContact O-CB 3.46Å; S58-T114 WeakPolarHBondContact OG-CG2 3.29Å
59S90.9Very high86.4Confident0 Ų043.1 Ų43.10%021%0.212CC..EExtended strand (participates in β ladder)trans-141.5127.7169.167.80000111K51 F53 S63K51-S59 WeakPolarHBondContact CB-O 3.15Å; K51-S59 PolarHBondContact N-O 3.5Å; K51-S59 VanDerWaalsContact N-O 3.11Å; K51-S59 PolarHBondContact O-N 3.45Å; F53-S59 WeakPolarHBondContact CE2-OG 3.21Å; S59-S63 WeakPolarHBondContact CA-OG 3.02Å
60D89.6Confident88.6Confident6 Ų634.4 Ų34.43%0.03218%0.178CC..  trans-118178.5176.266.2-16.3000111.1Q44 K50 L62 S63 T64 R246Q44-D60 PolarHBondContact NE2-O 3.24Å; K50-D60 HydrophobicContact CD-CB 4.42Å; K50-D60 HydrophobicContact CG-CB 3.93Å; D60-L62 PolarHBondContact O-N 3.1Å; D60-L62 VanDerWaalsContact O-N 3.15Å; D60-S63 PolarHBondContact N-OG 3.35Å; D60-S63 PolarHBondContact O-N 3.48Å; D60-S63 PolarHBondContact O-OG 2.8Å; D60-S63 WeakPolarHBondContact OD1-CB 3.49Å; D60-S63 PolarHBondContact OD1-N 3.42Å; D60-S63 PolarHBondContact OD1-OG 3.13Å; D60-T64 WeakPolarHBondContact O-CG2 3.32Å; D60-T64 PolarHBondContact O-N 3.14Å; D60-T64 PolarHBondContact O-OG1 2.88Å; D60-T64 VanDerWaalsContact O-OG1 3.06Å; D60-R246 IonicContact OD1-CZ 2.89Å; D60-R246 IonicContact OD1-NH2 2.8Å; D60-R246 PolarHBondContact OD1-NH2 3Å; D60-R246 IonicContact OD2-CZ 2.83Å; D60-R246 IonicContact OD2-NH1 3.35Å; D60-R246 PolarHBondContact OD2-NH1 2.74Å; D60-R246 IonicContact OD2-NH2 3.38Å; D60-R246 PolarHBondContact OD2-NH2 2.82Å
61T89.4Confident90.2Very high33 Ų3331.4 Ų31.420%0.20217%0.165CC..THydrogen-bonded Turntrans-61.9-20.7-176.354.50000113.2Q44 P65 G457 L458Q44-T61 VanDerWaalsContact OE1-CG2 3.24Å; T61-P65 WeakPolarHBondContact O-CD 3.42Å; T61-P65 WeakPolarHBondContact O-CG 3.24Å; T61-G457 WeakPolarHBondContact CB-O 3.21Å; T61-G457 PolarHBondContact OG1-O 3.24Å; T61-L458 PolarHBondContact OG1-N 2.91Å
62L91.9Very high91.9Very high5 Ų531.7 Ų31.73%0.02617%0.165CC..THydrogen-bonded Turntrans-76.3-49.4172.8-179.377.6000112.2D60 P65 Y242 I245 T314 M317D60-L62 PolarHBondContact O-N 3.1Å; D60-L62 VanDerWaalsContact O-N 3.15Å; L62-P65 WeakPolarHBondContact O-CD 3.45Å; L62-Y242 HydrophobicContact CD2-CD2 3.45Å; L62-Y242 VanDerWaalsContact CD2-CD2 3.45Å; L62-Y242 HydrophobicContact CD2-CE2 3.57Å; L62-Y242 HydrophobicContact CD2-CG 4.5Å; L62-Y242 HydrophobicContact CG-CD2 3.86Å; L62-Y242 HydrophobicContact CG-CE2 4.08Å; L62-I245 HydrophobicContact CD1-CD1 3.67Å; L62-I245 HydrophobicContact CD1-CG2 4.33Å; L62-I245 HydrophobicContact CD2-CB 4.15Å; L62-I245 HydrophobicContact CD2-CG2 3.8Å; L62-T314 HydrophobicContact CD1-CG2 3.36Å; L62-M317 HydrophobicContact CD1-CE 4.44Å
63S93.8Very high92.9Very high0 Ų027.3 Ų27.30%014%0.142CC..Hα-helixtrans-78.3-31.7-174.650.80000113S59 D60 L66 I67 F111S59-S63 WeakPolarHBondContact CA-OG 3.02Å; D60-S63 PolarHBondContact N-OG 3.35Å; D60-S63 PolarHBondContact O-N 3.48Å; D60-S63 PolarHBondContact O-OG 2.8Å; D60-S63 WeakPolarHBondContact OD1-CB 3.49Å; D60-S63 PolarHBondContact OD1-N 3.42Å; D60-S63 PolarHBondContact OD1-OG 3.13Å; S63-L66 PolarHBondContact O-N 2.66Å; S63-I67 WeakPolarHBondContact O-CD1 3.41Å; S63-I67 VanDerWaalsContact O-CG1 3.26Å; S63-I67 WeakPolarHBondContact O-CG1 3.42Å; S63-I67 PolarHBondContact O-N 3.23Å; S63-F111 WeakPolarHBondContact CB-O 3.35Å
64T94Very high93.7Very high1 Ų123.9 Ų23.91%0.00613%0.127CC..Hα-helixtrans-60.9-45.9-17546.80000114L41 Q44 D60 L66 I67 I68L41-T64 HydrophobicContact CB-CG2 3.95Å; Q44-T64 PolarHBondContact NE2-OG1 3.38Å; Q44-T64 PolarHBondContact OE1-OG1 2.89Å; D60-T64 WeakPolarHBondContact O-CG2 3.32Å; D60-T64 PolarHBondContact O-N 3.14Å; D60-T64 PolarHBondContact O-OG1 2.88Å; D60-T64 VanDerWaalsContact O-OG1 3.06Å; T64-L66 VanDerWaalsContact C-N 3.3Å; T64-L66 PolarHBondContact O-N 3.2Å; T64-I67 PolarHBondContact O-N 3.22Å; T64-I68 WeakPolarHBondContact O-CD1 3.48Å; T64-I68 VanDerWaalsContact O-CG1 3.27Å; T64-I68 WeakPolarHBondContact O-CG1 3.33Å; T64-I68 PolarHBondContact O-N 2.98Å
65P95.1Very high94.2Very high10 Ų1021.1 Ų21.17%0.06511%0.107CC..Hα-helixtrans-66.9-34.8178.5-20.335.4000112.2T61 L62 I68 L69 I318 L454 I455T61-P65 WeakPolarHBondContact O-CD 3.42Å; T61-P65 WeakPolarHBondContact O-CG 3.24Å; L62-P65 WeakPolarHBondContact O-CD 3.45Å; P65-I68 PolarHBondContact O-N 3.5Å; P65-L69 VanDerWaalsContact O-CB 3.3Å; P65-L69 WeakPolarHBondContact O-CB 3.43Å; P65-L69 PolarHBondContact O-N 3.14Å; P65-I318 HydrophobicContact CB-CD1 3.3Å; P65-I318 HydrophobicContact CB-CG1 4.02Å; P65-I318 HydrophobicContact CG-CD1 3.98Å; P65-L454 WeakPolarHBondContact CG-O 3.44Å; P65-I455 HydrophobicContact CB-CG2 4.11Å; P65-I455 HydrophobicContact CG-CG2 4.35Å
66L96.6Very high94.8Very high5 Ų514.3 Ų14.33%0.0267%0.071CC..Hα-helixtrans-66.5-42.6177.1-66172.2000111S63 T64 I68 L69 T70 F111 K238 Y242S63-L66 PolarHBondContact O-N 2.66Å; T64-L66 VanDerWaalsContact C-N 3.3Å; T64-L66 PolarHBondContact O-N 3.2Å; L66-I68 VanDerWaalsContact C-N 3.35Å; L66-I68 PolarHBondContact O-N 3.22Å; L66-L69 PolarHBondContact O-N 2.64Å; L66-T70 WeakPolarHBondContact O-CG2 3.37Å; L66-T70 PolarHBondContact O-N 2.73Å; L66-F111 HydrophobicContact CB-CD1 3.98Å; L66-F111 HydrophobicContact CB-CD2 4.14Å; L66-F111 HydrophobicContact CB-CE1 4.03Å; L66-F111 HydrophobicContact CB-CE2 4.2Å; L66-F111 HydrophobicContact CB-CG 4.04Å; L66-F111 HydrophobicContact CB-CZ 4.14Å; L66-F111 HydrophobicContact CD1-CD1 3.81Å; L66-F111 HydrophobicContact CD1-CE1 3.59Å; L66-F111 HydrophobicContact CD1-CZ 4.3Å; L66-F111 HydrophobicContact CG-CE1 4.31Å; L66-K238 HydrophobicContact CD2-CB 3.92Å; L66-K238 HydrophobicContact CD2-CG 4.12Å; L66-Y242 HydrophobicContact CD1-CD2 3.89Å; L66-Y242 HydrophobicContact CD1-CG 4.36Å
67I96.9Very high95.1Very high0 Ų08.9 Ų8.90%04%0.044CC..Hα-helixtrans-64.3-39.4174.9-65.7161.6000111.3M1 L41 S63 T64 T70 A71 I108 F111M1-I67 HydrophobicContact CE-CD1 3.86Å; M1-I67 HydrophobicContact CE-CG2 4.08Å; L41-I67 HydrophobicContact CD1-CB 4.15Å; L41-I67 HydrophobicContact CD1-CD1 4.34Å; L41-I67 HydrophobicContact CD1-CG2 3.53Å; S63-I67 WeakPolarHBondContact O-CD1 3.41Å; S63-I67 VanDerWaalsContact O-CG1 3.26Å; S63-I67 WeakPolarHBondContact O-CG1 3.42Å; S63-I67 PolarHBondContact O-N 3.23Å; T64-I67 PolarHBondContact O-N 3.22Å; I67-T70 PolarHBondContact O-N 3.25Å; I67-T70 PolarHBondContact O-OG1 3.12Å; I67-A71 WeakPolarHBondContact O-CB 3.41Å; I67-A71 PolarHBondContact O-N 3.25Å; I67-I108 HydrophobicContact CG2-CG2 4.34Å; I67-F111 HydrophobicContact CD1-CB 4.14Å; I67-F111 HydrophobicContact CG1-CB 3.61Å
68I96.9Very high95.3Very high27 Ų277.9 Ų7.914%0.1384%0.04CC..Hα-helixtrans-67.2-44.5177.6-67.6162.6000110L39 L42 T64 P65 L66 T70 A71 W72L39-I68 HydrophobicContact CD2-CG2 3.9Å; L42-I68 HydrophobicContact CD1-CD1 4.16Å; L42-I68 HydrophobicContact CD2-CD1 3.34Å; L42-I68 HydrophobicContact CG-CD1 3.49Å; L42-I68 VanDerWaalsContact CG-CD1 3.49Å; T64-I68 WeakPolarHBondContact O-CD1 3.48Å; T64-I68 VanDerWaalsContact O-CG1 3.27Å; T64-I68 WeakPolarHBondContact O-CG1 3.33Å; T64-I68 PolarHBondContact O-N 2.98Å; P65-I68 PolarHBondContact O-N 3.5Å; L66-I68 VanDerWaalsContact C-N 3.35Å; L66-I68 PolarHBondContact O-N 3.22Å; I68-T70 VanDerWaalsContact C-N 3.32Å; I68-T70 PolarHBondContact O-N 3.14Å; I68-A71 PolarHBondContact O-N 3.47Å; I68-W72 VanDerWaalsContact O-CB 3.29Å; I68-W72 WeakPolarHBondContact O-CB 3.46Å; I68-W72 PolarHBondContact O-N 3.18Å
69L97.1Very high95.6Very high9 Ų99.3 Ų9.35%0.0475%0.046CC..Hα-helixtrans-60.6-40.6175.3-176.365.1000111.5P65 L66 W72 L73 L322P65-L69 VanDerWaalsContact O-CB 3.3Å; P65-L69 WeakPolarHBondContact O-CB 3.43Å; P65-L69 PolarHBondContact O-N 3.14Å; L66-L69 PolarHBondContact O-N 2.64Å; L69-W72 PolarHBondContact O-N 2.88Å; L69-L73 WeakPolarHBondContact O-CB 3.5Å; L69-L73 PolarHBondContact O-N 3.5Å; L69-L322 HydrophobicContact CD1-CD2 3.59Å; L69-L322 HydrophobicContact CD1-CG 3.89Å
70T97.7Very high95.8Very high2 Ų29.4 Ų9.41%0.0125%0.047CC..Hα-helixtrans-65.9-42.7177.766.90000112.6L66 I67 I68 W72 L73 L107 F111 I235L66-T70 WeakPolarHBondContact O-CG2 3.37Å; L66-T70 PolarHBondContact O-N 2.73Å; I67-T70 PolarHBondContact O-N 3.25Å; I67-T70 PolarHBondContact O-OG1 3.12Å; I68-T70 VanDerWaalsContact C-N 3.32Å; I68-T70 PolarHBondContact O-N 3.14Å; T70-W72 VanDerWaalsContact C-N 3.33Å; T70-L73 PolarHBondContact O-N 3.41Å; T70-L107 HydrophobicContact CG2-CB 4.19Å; T70-F111 HydrophobicContact CG2-CD2 3.87Å; T70-F111 HydrophobicContact CG2-CE2 3.55Å; T70-I235 HydrophobicContact CG2-CB 4.4Å; T70-I235 HydrophobicContact CG2-CD1 3.65Å; T70-I235 HydrophobicContact CG2-CG1 3.93Å; T70-I235 HydrophobicContact CG2-CG2 3.54Å
71A97.3Very high96.1Very high0 Ų09.1 Ų9.10%05%0.045CC..Hα-helixtrans-66.2-37.8175.600000112I67 I68 P75I67-A71 WeakPolarHBondContact O-CB 3.41Å; I67-A71 PolarHBondContact O-N 3.25Å; I68-A71 PolarHBondContact O-N 3.47Å; A71-P75 WeakPolarHBondContact O-CD 3.47Å
72W98Very high96.2Very high56 Ų5610.4 Ų10.421%0.2125%0.049CC..Hα-helixtrans-66.6-37.1176.3-175.1-108.9000112.6F32 I68 L69 T70 L74 P75 L76 L440 P444F32-W72 HydrophobicContact CD1-CZ3 4.21Å; F32-W72 HydrophobicContact CE1-CH2 4.22Å; F32-W72 HydrophobicContact CE1-CZ3 4.23Å; I68-W72 VanDerWaalsContact O-CB 3.29Å; I68-W72 WeakPolarHBondContact O-CB 3.46Å; I68-W72 PolarHBondContact O-N 3.18Å; L69-W72 PolarHBondContact O-N 2.88Å; T70-W72 VanDerWaalsContact C-N 3.33Å; W72-L74 PolarHBondContact O-N 3.23Å; W72-P75 WeakPolarHBondContact O-CD 3.33Å; W72-P75 VanDerWaalsContact O-CG 3.27Å; W72-P75 WeakPolarHBondContact O-CG 3.32Å; W72-L76 HydrophobicContact CD2-CD1 4.39Å; W72-L76 HydrophobicContact CZ2-CD1 4.19Å; W72-L76 WeakPolarHBondContact O-CD1 3.46Å; W72-L440 HydrophobicContact CH2-CD2 3.77Å; W72-L440 HydrophobicContact CZ2-CB 4.12Å; W72-L440 HydrophobicContact CZ2-CD2 3.74Å; W72-L440 WeakPolarHBondContact CZ2-O 3.29Å; W72-L440 PolarHBondContact NE1-O 3.26Å; W72-L440 VanDerWaalsContact NE1-O 3.16Å; W72-P444 HydrophobicContact CZ2-CG 3.82Å
73L97.6Very high96.2Very high0 Ų012.4 Ų12.40%06%0.06CC..Hα-helixtrans-68.9-31.4-174.2-155.681.3000113.3L69 T70 L76 M77 M230 I231 A234 I235L69-L73 WeakPolarHBondContact O-CB 3.5Å; L69-L73 PolarHBondContact O-N 3.5Å; T70-L73 PolarHBondContact O-N 3.41Å; L73-L76 WeakPolarHBondContact O-CB 3.07Å; L73-L76 PolarHBondContact O-N 2.98Å; L73-M77 HydrophobicContact CB-CE 4.28Å; L73-M77 HydrophobicContact CD2-CE 4.12Å; L73-M77 HydrophobicContact CD2-CG 4.29Å; L73-M77 HydrophobicContact CD2-SD 4.21Å; L73-M77 HydrophobicContact CG-CE 4.27Å; L73-M77 HydrophobicContact CG-CG 4.12Å; L73-M77 VanDerWaalsContact O-CG 3.27Å; L73-M77 WeakPolarHBondContact O-CG 3.44Å; L73-M77 PolarHBondContact O-N 3.41Å; L73-M230 HydrophobicContact CD1-CE 4.46Å; L73-M230 HydrophobicContact CD2-CB 4.4Å; L73-I231 HydrophobicContact CD2-CB 4.35Å; L73-I231 HydrophobicContact CD2-CG1 3.91Å; L73-A234 HydrophobicContact CD1-CB 3.87Å; L73-A234 HydrophobicContact CD2-CB 3.86Å; L73-I235 HydrophobicContact CB-CD1 4.12Å; L73-I235 HydrophobicContact CD2-CD1 3.62Å; L73-I235 HydrophobicContact CD2-CG1 4.24Å; L73-I235 HydrophobicContact CG-CD1 4.5Å
74L97.7Very high95.9Very high0 Ų015 Ų150%07%0.072CC..Hα-helixtrans-53.8-56.4-178.1-174.678000113.7L11 S31 W72 L76 M77 L78 L100 I101 Q104L11-L74 HydrophobicContact CD1-CD2 3.64Å; S31-L74 VanDerWaalsContact CB-CD2 3.4Å; W72-L74 PolarHBondContact O-N 3.23Å; L74-L76 VanDerWaalsContact C-N 3.26Å; L74-L76 PolarHBondContact O-N 2.95Å; L74-M77 VanDerWaalsContact CA-CE 3.49Å; L74-M77 HydrophobicContact CB-CE 4.25Å; L74-M77 HydrophobicContact CD1-CE 4.08Å; L74-M77 WeakPolarHBondContact O-CB 3.39Å; L74-M77 PolarHBondContact O-N 3.44Å; L74-L78 HydrophobicContact CD2-CD1 4.37Å; L74-L78 HydrophobicContact CG-CD1 4.11Å; L74-L78 HydrophobicContact CG-CG 4.49Å; L74-L78 WeakPolarHBondContact O-CG 3.42Å; L74-L78 PolarHBondContact O-N 3.38Å; L74-L100 HydrophobicContact CD1-CB 3.89Å; L74-I101 HydrophobicContact CD1-CG1 4.47Å; L74-I101 HydrophobicContact CD2-CG1 4.24Å; L74-Q104 HydrophobicContact CB-CG 4.49Å; L74-Q104 HydrophobicContact CD1-CB 4.47Å
75P97.4Very high95.8Very high0 Ų015 Ų150%07%0.072CC..Hα-helixtrans-60.7-36.6179.520.9-31.9000112.6S31 F32 A71 W72 M77 L78 M79S31-P75 WeakPolarHBondContact OG-CB 3.38Å; F32-P75 HydrophobicContact CD1-CB 3.79Å; F32-P75 HydrophobicContact CD1-CG 3.63Å; F32-P75 HydrophobicContact CD2-CB 3.75Å; F32-P75 HydrophobicContact CD2-CG 4.45Å; F32-P75 HydrophobicContact CE1-CB 3.6Å; F32-P75 HydrophobicContact CE1-CG 3.61Å; F32-P75 HydrophobicContact CE2-CB 3.56Å; F32-P75 HydrophobicContact CE2-CG 4.44Å; F32-P75 HydrophobicContact CG-CB 3.86Å; F32-P75 HydrophobicContact CG-CG 4.07Å; F32-P75 HydrophobicContact CZ-CB 3.49Å; F32-P75 VanDerWaalsContact CZ-CB 3.49Å; F32-P75 HydrophobicContact CZ-CG 4.05Å; A71-P75 WeakPolarHBondContact O-CD 3.47Å; W72-P75 WeakPolarHBondContact O-CD 3.33Å; W72-P75 VanDerWaalsContact O-CG 3.27Å; W72-P75 WeakPolarHBondContact O-CG 3.32Å; P75-M77 PolarHBondContact O-N 3.01Å; P75-L78 PolarHBondContact O-N 2.85Å; P75-M79 WeakPolarHBondContact O-CG 3.5Å; P75-M79 PolarHBondContact O-N 2.67Å
76L97.8Very high95.5Very high0 Ų021.3 Ų21.30%010%0.098CC..Hα-helixtrans-63.2-42.5177.2-85.758.3000111.3F32 W72 L73 L74 M79 A80 M230 L440 H441F32-L76 HydrophobicContact CE1-CD1 4.27Å; W72-L76 HydrophobicContact CD2-CD1 4.39Å; W72-L76 HydrophobicContact CZ2-CD1 4.19Å; W72-L76 WeakPolarHBondContact O-CD1 3.46Å; L73-L76 WeakPolarHBondContact O-CB 3.07Å; L73-L76 PolarHBondContact O-N 2.98Å; L74-L76 VanDerWaalsContact C-N 3.26Å; L74-L76 PolarHBondContact O-N 2.95Å; L76-M79 PolarHBondContact O-N 3.45Å; L76-A80 WeakPolarHBondContact O-CB 3.46Å; L76-A80 PolarHBondContact O-N 3.49Å; L76-M230 HydrophobicContact CB-CE 3.94Å; L76-L440 HydrophobicContact CD1-CB 4.04Å; L76-L440 HydrophobicContact CD1-CD1 4.2Å; L76-L440 HydrophobicContact CD2-CB 4.49Å; L76-L440 HydrophobicContact CG-CB 4.24Å; L76-H441 VanDerWaalsContact CD2-CE1 3.41Å; L76-H441 WeakPolarHBondContact CD2-CE1 3.45Å
77M97.6Very high95.1Very high5 Ų530.7 Ų30.73%0.02514%0.139CC..Hα-helixtrans-63-44.6175.7-73.8-172.2-85.700113L73 L74 P75 M79 A80 S81 L100 A227 M230 I231L73-M77 HydrophobicContact CB-CE 4.28Å; L73-M77 HydrophobicContact CD2-CE 4.12Å; L73-M77 HydrophobicContact CD2-CG 4.29Å; L73-M77 HydrophobicContact CD2-SD 4.21Å; L73-M77 HydrophobicContact CG-CE 4.27Å; L73-M77 HydrophobicContact CG-CG 4.12Å; L73-M77 VanDerWaalsContact O-CG 3.27Å; L73-M77 WeakPolarHBondContact O-CG 3.44Å; L73-M77 PolarHBondContact O-N 3.41Å; L74-M77 VanDerWaalsContact CA-CE 3.49Å; L74-M77 HydrophobicContact CB-CE 4.25Å; L74-M77 HydrophobicContact CD1-CE 4.08Å; L74-M77 WeakPolarHBondContact O-CB 3.39Å; L74-M77 PolarHBondContact O-N 3.44Å; P75-M77 PolarHBondContact O-N 3.01Å; M77-M79 VanDerWaalsContact C-N 3.29Å; M77-M79 PolarHBondContact O-N 2.95Å; M77-A80 WeakPolarHBondContact O-CB 3.46Å; M77-A80 PolarHBondContact O-N 3.35Å; M77-A80 VanDerWaalsContact O-N 3.1Å; M77-S81 WeakPolarHBondContact O-CB 3.32Å; M77-S81 PolarHBondContact O-N 3.09Å; M77-S81 PolarHBondContact O-OG 2.87Å; M77-L100 HydrophobicContact CB-CD1 4.38Å; M77-L100 HydrophobicContact SD-CD2 3.9Å; M77-A227 HydrophobicContact CB-CB 3.84Å; M77-A227 HydrophobicContact CG-CB 4.02Å; M77-A227 HydrophobicContact SD-CB 4.07Å; M77-M230 HydrophobicContact CG-CB 4.29Å; M77-M230 HydrophobicContact CG-CE 4.07Å; M77-M230 HydrophobicContact CG-SD 4.13Å; M77-I231 HydrophobicContact CE-CD1 3.72Å; M77-I231 HydrophobicContact CE-CG1 3.57Å; M77-I231 HydrophobicContact CG-CG1 4.33Å; M77-I231 HydrophobicContact SD-CB 4.42Å; M77-I231 HydrophobicContact SD-CD1 3.06Å; M77-I231 WeakPolarHBondContact SD-CD1 3.47Å; M77-I231 HydrophobicContact SD-CG1 2.95Å; M77-I231 WeakPolarHBondContact SD-CG1 3.32Å
78L96.9Very high94.7Very high1 Ų133.2 Ų33.21%0.00515%0.152CC..Hα-helixtrans-62-41.7178-66.2171000110.7W24 V27 T28 L74 P75 A80 S81 Q82 I97 L100W24-L78 HydrophobicContact CE3-CB 4.36Å; W24-L78 HydrophobicContact CE3-CD2 4.35Å; W24-L78 HydrophobicContact CZ3-CB 4.26Å; W24-L78 HydrophobicContact CZ3-CD2 3.87Å; W24-L78 WeakPolarHBondContact CZ3-O 3.21Å; V27-L78 HydrophobicContact CB-CD1 4.2Å; V27-L78 HydrophobicContact CG1-CD1 3.54Å; T28-L78 HydrophobicContact CG2-CB 3.55Å; T28-L78 HydrophobicContact CG2-CD1 4Å; T28-L78 HydrophobicContact CG2-CG 4.44Å; L74-L78 HydrophobicContact CD2-CD1 4.37Å; L74-L78 HydrophobicContact CG-CD1 4.11Å; L74-L78 HydrophobicContact CG-CG 4.49Å; L74-L78 WeakPolarHBondContact O-CG 3.42Å; L74-L78 PolarHBondContact O-N 3.38Å; P75-L78 PolarHBondContact O-N 2.85Å; L78-A80 VanDerWaalsContact C-N 3.33Å; L78-A80 PolarHBondContact O-N 2.88Å; L78-S81 PolarHBondContact O-N 3.32Å; L78-S81 PolarHBondContact O-OG 3.23Å; L78-Q82 PolarHBondContact O-N 3.29Å; L78-I97 HydrophobicContact CD2-CB 4.42Å; L78-I97 HydrophobicContact CD2-CG1 4.02Å; L78-I97 HydrophobicContact CD2-CG2 3.87Å; L78-L100 HydrophobicContact CD2-CD1 3.97Å
79M96.5Very high94.5Very high36 Ų3637.6 Ų37.618%0.17718%0.176CC..Hα-helixtrans-62.4-39172.8-75.1-176.717200112.3F32 P75 L76 M77 Q82 R433 L437 L440F32-M79 HydrophobicContact CE2-CE 3.54Å; F32-M79 HydrophobicContact CZ-CE 3.79Å; F32-M79 HydrophobicContact CZ-SD 4.29Å; P75-M79 WeakPolarHBondContact O-CG 3.5Å; P75-M79 PolarHBondContact O-N 2.67Å; L76-M79 PolarHBondContact O-N 3.45Å; M77-M79 VanDerWaalsContact C-N 3.29Å; M77-M79 PolarHBondContact O-N 2.95Å; M79-Q82 WeakPolarHBondContact O-CG 3.36Å; M79-Q82 PolarHBondContact O-NE2 2.85Å; M79-R433 WeakPolarHBondContact O-CD 3.45Å; M79-R433 PolarHBondContact O-NH1 2.92Å; M79-L437 HydrophobicContact CB-CD1 4.39Å; M79-L440 HydrophobicContact CE-CD1 4.34Å; M79-L440 HydrophobicContact SD-CD1 3.81Å
80A96.1Very high94.3Very high1 Ų139.9 Ų39.91%0.00819%0.188CC..Hα-helixtrans-68.4-43.7178.900000112.2L76 M77 L78 I226 M230 R433 L437L76-A80 WeakPolarHBondContact O-CB 3.46Å; L76-A80 PolarHBondContact O-N 3.49Å; M77-A80 WeakPolarHBondContact O-CB 3.46Å; M77-A80 PolarHBondContact O-N 3.35Å; M77-A80 VanDerWaalsContact O-N 3.1Å; L78-A80 VanDerWaalsContact C-N 3.33Å; L78-A80 PolarHBondContact O-N 2.88Å; A80-I226 HydrophobicContact CB-CG1 3.88Å; A80-I226 HydrophobicContact CB-CG2 3.87Å; A80-M230 HydrophobicContact CB-CE 4.47Å; A80-M230 HydrophobicContact CB-SD 3.63Å; A80-R433 PolarHBondContact O-NH1 3.39Å; A80-L437 HydrophobicContact CB-CD1 3.56Å
81S95Very high94.2Very high0 Ų043.9 Ų43.90%021%0.213CC..Hα-helixtrans-81.7-19.2-170.860.60000114.6W24 M77 L78 N83 H84 L85 Y96W24-S81 WeakPolarHBondContact CZ3-OG 3.49Å; M77-S81 WeakPolarHBondContact O-CB 3.32Å; M77-S81 PolarHBondContact O-N 3.09Å; M77-S81 PolarHBondContact O-OG 2.87Å; L78-S81 PolarHBondContact O-N 3.32Å; L78-S81 PolarHBondContact O-OG 3.23Å; S81-N83 PolarHBondContact O-N 2.62Å; S81-N83 VanDerWaalsContact O-N 3.14Å; S81-H84 PolarHBondContact O-CE1 2.88Å; S81-H84 PolarHBondContact O-ND1 3.29Å; S81-L85 PolarHBondContact O-N 2.83Å; S81-Y96 VanDerWaalsContact CB-CE1 3.44Å; S81-Y96 WeakPolarHBondContact CB-OH 3.31Å
82Q92.7Very high94Very high61 Ų6146 Ų4629%0.28522%0.223SC..THydrogen-bonded Turntrans-61.1-30.1-172.965.7-174.5-45.100114W24 L78 M79 K86W24-Q82 HydrophobicContact CD2-CB 4.02Å; W24-Q82 HydrophobicContact CE3-CB 3.93Å; W24-Q82 HydrophobicContact CZ3-CB 4.19Å; L78-Q82 PolarHBondContact O-N 3.29Å; M79-Q82 WeakPolarHBondContact O-CG 3.36Å; M79-Q82 PolarHBondContact O-NE2 2.85Å; Q82-K86 VanDerWaalsContact O-CG 3.32Å; Q82-K86 WeakPolarHBondContact O-CG 3.44Å; Q82-K86 PolarHBondContact O-N 3.36Å
83N90.8Very high93.8Very high46 Ų4644.3 Ų44.325%0.24622%0.218CC..THydrogen-bonded Turntrans-73.5-49.5-174.1-16235000112.9S81 L85 K86 E336S81-N83 PolarHBondContact O-N 2.62Å; S81-N83 VanDerWaalsContact O-N 3.14Å; N83-L85 PolarHBondContact O-N 3.03Å; N83-K86 WeakPolarHBondContact O-CB 3.35Å; N83-K86 WeakPolarHBondContact O-CG 3.21Å; N83-K86 PolarHBondContact O-N 3.16Å; N83-K86 VanDerWaalsContact OD1-CE 3.3Å; N83-K86 WeakPolarHBondContact OD1-CE 3.35Å; N83-K86 PolarHBondContact OD1-NZ 2.97Å; N83-E336 PolarHBondContact ND2-OE2 3.35Å
84H88.9Confident93.8Very high54 Ų5445.2 Ų45.225%0.2522%0.222CC..G310 helixtrans-67.4-25-179.874.3-31.2000113.2S81 P225S81-H84 PolarHBondContact O-CE1 2.88Å; S81-H84 PolarHBondContact O-ND1 3.29Å; H84-P225 WeakPolarHBondContact NE2-CB 3.13Å
85L91.6Very high93.7Very high3 Ų348 Ų482%0.01624%0.236CC..G310 helixtrans-87.8-2.5-180-67.7167000113.6W24 S81 N83 K87 D88 Q93 Y96 W137W24-L85 HydrophobicContact CH2-CD1 3.69Å; W24-L85 HydrophobicContact CZ2-CB 4.28Å; W24-L85 HydrophobicContact CZ2-CD1 3.94Å; S81-L85 PolarHBondContact O-N 2.83Å; N83-L85 PolarHBondContact O-N 3.03Å; L85-K87 PolarHBondContact O-N 3.23Å; L85-K87 VanDerWaalsContact O-N 3.09Å; L85-D88 WeakPolarHBondContact CD2-OD2 3.35Å; L85-D88 WeakPolarHBondContact O-CB 3.28Å; L85-D88 PolarHBondContact O-N 3.46Å; L85-Q93 HydrophobicContact CB-CG 4.42Å; L85-Q93 PolarHBondContact O-NE2 2.79Å; L85-Y96 HydrophobicContact CD1-CD1 3.29Å; L85-Y96 HydrophobicContact CD1-CD2 4.29Å; L85-Y96 HydrophobicContact CD1-CE1 3.49Å; L85-Y96 VanDerWaalsContact CD1-CE1 3.49Å; L85-Y96 HydrophobicContact CD1-CE2 4.42Å; L85-Y96 HydrophobicContact CD1-CG 3.69Å; L85-W137 HydrophobicContact CD2-CG 4.49Å
86K88.3Confident93.7Very high141 Ų14148 Ų4861%0.61324%0.236SC*.G310 helixtrans-55.4-31.7-177.3-76.8179.1179.7164.90113.4Q82 N83Q82-K86 VanDerWaalsContact O-CG 3.32Å; Q82-K86 WeakPolarHBondContact O-CG 3.44Å; Q82-K86 PolarHBondContact O-N 3.36Å; N83-K86 WeakPolarHBondContact O-CB 3.35Å; N83-K86 WeakPolarHBondContact O-CG 3.21Å; N83-K86 PolarHBondContact O-N 3.16Å; N83-K86 VanDerWaalsContact OD1-CE 3.3Å; N83-K86 WeakPolarHBondContact OD1-CE 3.35Å; N83-K86 PolarHBondContact OD1-NZ 2.97Å
87K87.8Confident93.7Very high202 Ų20248 Ų4888%0.87824%0.236SC*.G310 helixtrans-83.7-13.6-178.3-63.9-177.6-179.4179.10113.2L85L85-K87 PolarHBondContact O-N 3.23Å; L85-K87 VanDerWaalsContact O-N 3.09Å
88D89.6Confident93.7Very high54 Ų5448.4 Ų48.429%0.28924%0.24SC..SBendtrans-79.5153.5-174.9-73-1000112.4L85 L92 Q93L85-D88 WeakPolarHBondContact CD2-OD2 3.35Å; L85-D88 WeakPolarHBondContact O-CB 3.28Å; L85-D88 PolarHBondContact O-N 3.46Å; D88-L92 HydrophobicContact CB-CB 4.43Å; D88-Q93 HydrophobicContact CB-CG 4.18Å; D88-Q93 PolarHBondContact O-NE2 3.05Å; D88-Q93 VanDerWaalsContact O-NE2 3.11Å
89N92.3Very high93.7Very high119 Ų11950.2 Ų50.264%0.63625%0.249SC*.  trans-57142.7173.5-70.3-8000111.3V91 L92 Q93N89-V91 PolarHBondContact O-N 3.06Å; N89-V91 VanDerWaalsContact O-N 3.12Å; N89-L92 HydrophobicContact CB-CD1 4.22Å; N89-L92 HydrophobicContact CB-CG 4.38Å; N89-L92 WeakPolarHBondContact O-CA 3.25Å; N89-L92 WeakPolarHBondContact O-CB 3.27Å; N89-L92 PolarHBondContact O-N 2.96Å; N89-Q93 PolarHBondContact O-N 3.3Å
90N92.5Very high93.8Very high56 Ų5648.5 Ų48.530%0.29924%0.241SC..Hα-helixtrans-53.4-37.5179.7-178.444.1000113.1Q93 K94N90-Q93 PolarHBondContact O-N 3.22Å; N90-K94 WeakPolarHBondContact O-CG 3.44Å; N90-K94 PolarHBondContact O-N 3.26Å
91V94.9Very high93.9Very high87 Ų8748.5 Ų48.553%0.52724%0.24SC..Hα-helixtrans-64.5-41.6176.3-179.10000111.3N89 K94 L95N89-V91 PolarHBondContact O-N 3.06Å; N89-V91 VanDerWaalsContact O-N 3.12Å; V91-K94 PolarHBondContact O-N 3.27Å; V91-L95 HydrophobicContact CG1-CD1 4.13Å; V91-L95 WeakPolarHBondContact O-CB 3.46Å; V91-L95 WeakPolarHBondContact O-CG 3.29Å; V91-L95 PolarHBondContact O-N 2.93Å
92L94.1Very high94Very high43 Ų4350 Ų5023%0.22525%0.25CS..Hα-helixtrans-67.6-38.7177-69.7171.4000111.6D88 N89 L95 Y96D88-L92 HydrophobicContact CB-CB 4.43Å; N89-L92 HydrophobicContact CB-CD1 4.22Å; N89-L92 HydrophobicContact CB-CG 4.38Å; N89-L92 WeakPolarHBondContact O-CA 3.25Å; N89-L92 WeakPolarHBondContact O-CB 3.27Å; N89-L92 PolarHBondContact O-N 2.96Å; L92-L95 HydrophobicContact CD2-CD1 4.38Å; L92-L95 PolarHBondContact O-N 3.47Å; L92-Y96 WeakPolarHBondContact O-CB 3.33Å; L92-Y96 PolarHBondContact O-N 3.26Å
93Q94.6Very high94.3Very high21 Ų2147.1 Ų47.110%0.09824%0.237CC..Hα-helixtrans-60.6-46.2172.9-64.6-176.87.600111.2W24 L85 D88 N89 N90 L95 Y96 I97W24-Q93 HydrophobicContact CZ2-CB 4.42Å; L85-Q93 HydrophobicContact CB-CG 4.42Å; L85-Q93 PolarHBondContact O-NE2 2.79Å; D88-Q93 HydrophobicContact CB-CG 4.18Å; D88-Q93 PolarHBondContact O-NE2 3.05Å; D88-Q93 VanDerWaalsContact O-NE2 3.11Å; N89-Q93 PolarHBondContact O-N 3.3Å; N90-Q93 PolarHBondContact O-N 3.22Å; Q93-L95 PolarHBondContact O-N 3.47Å; Q93-Y96 WeakPolarHBondContact O-CB 3.45Å; Q93-Y96 PolarHBondContact O-N 3.46Å; Q93-I97 VanDerWaalsContact O-CG1 3.29Å; Q93-I97 WeakPolarHBondContact O-CG1 2.99Å; Q93-I97 PolarHBondContact O-N 2.89Å
94K95.8Very high94.6Very high20 Ų2045.1 Ų45.19%0.08723%0.227CC..Hα-helixtrans-62.7-41.6176.4-74-177.6173.5-166.40112.3T15 W16 S18 T23 N90 V91 I97 S98T15-K94 WeakPolarHBondContact O-CD 3.21Å; T15-K94 WeakPolarHBondContact O-CE 3.27Å; T15-K94 PolarHBondContact O-NZ 3.24Å; W16-K94 HydrophobicContact CE3-CB 4.44Å; W16-K94 HydrophobicContact CE3-CD 4.19Å; W16-K94 HydrophobicContact CH2-CB 4.47Å; W16-K94 HydrophobicContact CZ3-CB 4.38Å; W16-K94 PolarHBondContact O-NZ 3.16Å; S18-K94 WeakPolarHBondContact O-CE 3.41Å; S18-K94 PolarHBondContact O-NZ 3.31Å; T23-K94 HydrophobicContact CG2-CG 4.38Å; N90-K94 WeakPolarHBondContact O-CG 3.44Å; N90-K94 PolarHBondContact O-N 3.26Å; V91-K94 PolarHBondContact O-N 3.27Å; K94-I97 PolarHBondContact O-N 2.86Å; K94-S98 WeakPolarHBondContact O-CB 3.43Å; K94-S98 PolarHBondContact O-N 3.43Å; K94-S98 PolarHBondContact O-OG 2.78Å
95L97Very high95Very high57 Ų5743 Ų4330%0.29822%0.217SC..Hα-helixtrans-60.5-46.3174.3-75.9167.9000111.4W16 V91 L92 Q93 I97 S98 M99 W137W16-L95 HydrophobicContact CH2-CD2 3.84Å; W16-L95 HydrophobicContact CH2-CG 3.98Å; W16-L95 HydrophobicContact CZ2-CD2 3.77Å; W16-L95 HydrophobicContact CZ2-CG 4.22Å; V91-L95 HydrophobicContact CG1-CD1 4.13Å; V91-L95 WeakPolarHBondContact O-CB 3.46Å; V91-L95 WeakPolarHBondContact O-CG 3.29Å; V91-L95 PolarHBondContact O-N 2.93Å; L92-L95 HydrophobicContact CD2-CD1 4.38Å; L92-L95 PolarHBondContact O-N 3.47Å; Q93-L95 PolarHBondContact O-N 3.47Å; L95-I97 PolarHBondContact O-N 3.41Å; L95-S98 WeakPolarHBondContact CA-OG 3.33Å; L95-S98 PolarHBondContact O-N 3.33Å; L95-S98 PolarHBondContact O-OG 2.94Å; L95-M99 WeakPolarHBondContact O-CG 3.34Å; L95-M99 PolarHBondContact O-N 3.45Å; L95-W137 HydrophobicContact CB-CH2 4.31Å; L95-W137 HydrophobicContact CB-CZ2 4.3Å
96Y97Very high95.3Very high0 Ų044.3 Ų44.30%022%0.224CC..Hα-helixtrans-57.2-49.1176.5-177.2-99.3000112.2W24 S81 L85 L92 Q93 S98 M99 L100 I133 W137 P225 A227W24-Y96 HydrophobicContact CH2-CD1 4.31Å; S81-Y96 VanDerWaalsContact CB-CE1 3.44Å; S81-Y96 WeakPolarHBondContact CB-OH 3.31Å; L85-Y96 HydrophobicContact CD1-CD1 3.29Å; L85-Y96 HydrophobicContact CD1-CD2 4.29Å; L85-Y96 HydrophobicContact CD1-CE1 3.49Å; L85-Y96 VanDerWaalsContact CD1-CE1 3.49Å; L85-Y96 HydrophobicContact CD1-CE2 4.42Å; L85-Y96 HydrophobicContact CD1-CG 3.69Å; L92-Y96 WeakPolarHBondContact O-CB 3.33Å; L92-Y96 PolarHBondContact O-N 3.26Å; Q93-Y96 WeakPolarHBondContact O-CB 3.45Å; Q93-Y96 PolarHBondContact O-N 3.46Å; Y96-S98 VanDerWaalsContact C-N 3.3Å; Y96-S98 PolarHBondContact O-N 3.4Å; Y96-M99 PolarHBondContact O-N 3.14Å; Y96-L100 HydrophobicContact CD1-CD1 3.92Å; Y96-L100 HydrophobicContact CD1-CG 4.42Å; Y96-L100 HydrophobicContact CE1-CD1 3.44Å; Y96-L100 VanDerWaalsContact CE1-CD1 3.44Å; Y96-L100 HydrophobicContact CE1-CG 4.13Å; Y96-L100 PolarHBondContact O-N 2.98Å; Y96-L100 VanDerWaalsContact O-N 3.09Å; Y96-I133 HydrophobicContact CE2-CG2 4.25Å; Y96-W137 HydrophobicContact CD2-CB 4.32Å; Y96-W137 AromaticContact CD2-CD2 3.44Å; Y96-W137 HydrophobicContact CD2-CD2 3.44Å; Y96-W137 VanDerWaalsContact CD2-CD2 3.44Å; Y96-W137 AromaticContact CD2-CE2 3.67Å; Y96-W137 AromaticContact CD2-CE3 3.67Å; Y96-W137 HydrophobicContact CD2-CE3 3.67Å; Y96-W137 AromaticContact CD2-CG 3.75Å; Y96-W137 HydrophobicContact CD2-CG 3.75Å; Y96-W137 HydrophobicContact CD2-CH2 4.27Å; Y96-W137 HydrophobicContact CD2-CZ2 4.11Å; Y96-W137 HydrophobicContact CD2-CZ3 4.04Å; Y96-W137 HydrophobicContact CE2-CB 4.15Å; Y96-W137 HydrophobicContact CE2-CD2 4.12Å; Y96-W137 HydrophobicContact CE2-CE3 4.29Å; Y96-W137 HydrophobicContact CE2-CG 4.08Å; Y96-W137 HydrophobicContact CG-CD2 4.4Å; Y96-W137 HydrophobicContact CG-CZ2 4.38Å; Y96-P225 HydrophobicContact CE2-CG 4.37Å; Y96-A227 WeakPolarHBondContact OH-CB 3.36Å
97I97.2Very high95.7Very high0 Ų037.7 Ų37.70%020%0.195CC..Hα-helixtrans-62.9-40.2178.6-61.5166.3000110.3T15 W24 V27 L78 Q93 K94 L95 M99 L100 I101T15-I97 HydrophobicContact CG2-CB 4.19Å; T15-I97 HydrophobicContact CG2-CG2 3.42Å; T15-I97 VanDerWaalsContact CG2-CG2 3.42Å; W24-I97 HydrophobicContact CD2-CD1 4.02Å; W24-I97 HydrophobicContact CE3-CD1 4.08Å; W24-I97 HydrophobicContact CE3-CG1 4.44Å; W24-I97 HydrophobicContact CH2-CD1 4.02Å; W24-I97 HydrophobicContact CH2-CG1 3.83Å; W24-I97 HydrophobicContact CZ2-CD1 3.97Å; W24-I97 HydrophobicContact CZ2-CG1 4.21Å; W24-I97 HydrophobicContact CZ3-CD1 4.08Å; W24-I97 HydrophobicContact CZ3-CG1 3.97Å; V27-I97 HydrophobicContact CB-CG2 4.41Å; V27-I97 HydrophobicContact CG1-CG2 3.81Å; V27-I97 HydrophobicContact CG2-CG2 4.23Å; L78-I97 HydrophobicContact CD2-CB 4.42Å; L78-I97 HydrophobicContact CD2-CG1 4.02Å; L78-I97 HydrophobicContact CD2-CG2 3.87Å; Q93-I97 VanDerWaalsContact O-CG1 3.29Å; Q93-I97 WeakPolarHBondContact O-CG1 2.99Å; Q93-I97 PolarHBondContact O-N 2.89Å; K94-I97 PolarHBondContact O-N 2.86Å; L95-I97 PolarHBondContact O-N 3.41Å; I97-M99 VanDerWaalsContact C-N 3.32Å; I97-M99 PolarHBondContact O-N 3.14Å; I97-L100 PolarHBondContact O-N 2.85Å; I97-I101 HydrophobicContact CG2-CD1 3.73Å; I97-I101 HydrophobicContact CG2-CG1 4.38Å; I97-I101 WeakPolarHBondContact O-CG1 3.27Å; I97-I101 PolarHBondContact O-N 3.36Å
98S97.7Very high96.2Very high14 Ų1428.1 Ų28.110%0.09815%0.153CC..Hα-helixtrans-63-35176.373.90000113.2K94 L95 Y96 I101 S102K94-S98 WeakPolarHBondContact O-CB 3.43Å; K94-S98 PolarHBondContact O-N 3.43Å; K94-S98 PolarHBondContact O-OG 2.78Å; L95-S98 WeakPolarHBondContact CA-OG 3.33Å; L95-S98 PolarHBondContact O-N 3.33Å; L95-S98 PolarHBondContact O-OG 2.94Å; Y96-S98 VanDerWaalsContact C-N 3.3Å; Y96-S98 PolarHBondContact O-N 3.4Å; S98-I101 PolarHBondContact O-N 2.74Å; S98-S102 WeakPolarHBondContact O-CB 3.47Å; S98-S102 PolarHBondContact O-N 3.48Å; S98-S102 PolarHBondContact O-OG 2.87Å
99M97.9Very high96.5Very high40 Ų4027.3 Ų27.320%0.19715%0.148CC..Hα-helixtrans-69-37174.4-66.8-63.8169.400112.3L95 Y96 I97 S102 L103 P129 I132 I133 W137L95-M99 WeakPolarHBondContact O-CG 3.34Å; L95-M99 PolarHBondContact O-N 3.45Å; Y96-M99 PolarHBondContact O-N 3.14Å; I97-M99 VanDerWaalsContact C-N 3.32Å; I97-M99 PolarHBondContact O-N 3.14Å; M99-S102 WeakPolarHBondContact CA-OG 3.41Å; M99-S102 PolarHBondContact O-OG 3.42Å; M99-L103 VanDerWaalsContact O-CB 3.25Å; M99-L103 WeakPolarHBondContact O-CB 3.47Å; M99-L103 PolarHBondContact O-N 3.02Å; M99-L103 VanDerWaalsContact O-N 3.08Å; M99-P129 HydrophobicContact SD-CB 4.42Å; M99-I132 HydrophobicContact CE-CD1 3.75Å; M99-I132 HydrophobicContact CE-CG2 4.12Å; M99-I132 HydrophobicContact CG-CG2 4.37Å; M99-I132 HydrophobicContact SD-CB 4.42Å; M99-I132 HydrophobicContact SD-CD1 3.93Å; M99-I132 HydrophobicContact SD-CG2 4.31Å; M99-I133 HydrophobicContact CB-CD1 4.09Å; M99-I133 HydrophobicContact CB-CG1 3.94Å; M99-W137 HydrophobicContact CG-CH2 4.35Å; M99-W137 HydrophobicContact CG-CZ3 4.32Å
100L97.9Very high96.8Very high0 Ų021.7 Ų21.70%012%0.118CC..Hα-helixtrans-66.8-41.7173.5-67.5179.2000111.9L74 M77 L78 Y96 I97 Q104 I133 A227 I231L74-L100 HydrophobicContact CD1-CB 3.89Å; M77-L100 HydrophobicContact CB-CD1 4.38Å; M77-L100 HydrophobicContact SD-CD2 3.9Å; L78-L100 HydrophobicContact CD2-CD1 3.97Å; Y96-L100 HydrophobicContact CD1-CD1 3.92Å; Y96-L100 HydrophobicContact CD1-CG 4.42Å; Y96-L100 HydrophobicContact CE1-CD1 3.44Å; Y96-L100 VanDerWaalsContact CE1-CD1 3.44Å; Y96-L100 HydrophobicContact CE1-CG 4.13Å; Y96-L100 PolarHBondContact O-N 2.98Å; Y96-L100 VanDerWaalsContact O-N 3.09Å; I97-L100 PolarHBondContact O-N 2.85Å; L100-Q104 PolarHBondContact O-N 2.88Å; L100-I133 HydrophobicContact CD2-CD1 3.76Å; L100-A227 HydrophobicContact CD1-CB 4.1Å; L100-A227 HydrophobicContact CD2-CB 3.87Å; L100-I231 HydrophobicContact CD2-CD1 3.6Å
101I98.1Very high97Very high0 Ų019 Ų190%010%0.104CC..Hα-helixtrans-66.2-47.4177.2-68.1160.6000110.7S8 L11 L12 T15 V27 L74 I97 S98 L103 Q104 I105S8-I101 WeakPolarHBondContact O-CG2 3.46Å; L11-I101 HydrophobicContact CB-CD1 3.66Å; L11-I101 HydrophobicContact CB-CG1 4.06Å; L11-I101 HydrophobicContact CB-CG2 3.9Å; L11-I101 HydrophobicContact CD1-CG1 4.17Å; L11-I101 HydrophobicContact CD1-CG2 4.45Å; L12-I101 HydrophobicContact CD2-CB 4.11Å; L12-I101 HydrophobicContact CD2-CG2 3.86Å; L12-I101 HydrophobicContact CG-CG2 3.9Å; T15-I101 HydrophobicContact CG2-CD1 3.38Å; V27-I101 HydrophobicContact CG1-CD1 4.09Å; L74-I101 HydrophobicContact CD1-CG1 4.47Å; L74-I101 HydrophobicContact CD2-CG1 4.24Å; I97-I101 HydrophobicContact CG2-CD1 3.73Å; I97-I101 HydrophobicContact CG2-CG1 4.38Å; I97-I101 WeakPolarHBondContact O-CG1 3.27Å; I97-I101 PolarHBondContact O-N 3.36Å; S98-I101 PolarHBondContact O-N 2.74Å; I101-L103 VanDerWaalsContact C-N 3.26Å; I101-L103 PolarHBondContact O-N 3.42Å; I101-Q104 WeakPolarHBondContact O-CB 3.38Å; I101-Q104 PolarHBondContact O-N 2.78Å; I101-Q104 VanDerWaalsContact O-N 3.11Å; I101-I105 HydrophobicContact CG2-CD1 3.76Å; I101-I105 HydrophobicContact CG2-CG1 4.31Å; I101-I105 VanDerWaalsContact O-CG1 3.27Å; I101-I105 WeakPolarHBondContact O-CG1 3.47Å; I101-I105 PolarHBondContact O-N 3.31Å
102S98.1Very high97Very high31 Ų3114.9 Ų14.922%0.2178%0.079CC..Hα-helixtrans-59.9-40.5179.167.30000111.4S98 M99 I105 L106S98-S102 WeakPolarHBondContact O-CB 3.47Å; S98-S102 PolarHBondContact O-N 3.48Å; S98-S102 PolarHBondContact O-OG 2.87Å; M99-S102 WeakPolarHBondContact CA-OG 3.41Å; M99-S102 PolarHBondContact O-OG 3.42Å; S102-I105 PolarHBondContact O-N 3.4Å; S102-L106 VanDerWaalsContact O-CG 3.29Å; S102-L106 WeakPolarHBondContact O-CG 3.44Å; S102-L106 PolarHBondContact O-N 3.15Å
103L97.6Very high97.1Very high1 Ų112.8 Ų12.81%0.0057%0.068CC..Hα-helixtrans-62.2-43.8174.1-174.354.1000112.5M99 I101 L106 L107 T126 P129 T130 I133 I231M99-L103 VanDerWaalsContact O-CB 3.25Å; M99-L103 WeakPolarHBondContact O-CB 3.47Å; M99-L103 PolarHBondContact O-N 3.02Å; M99-L103 VanDerWaalsContact O-N 3.08Å; I101-L103 VanDerWaalsContact C-N 3.26Å; I101-L103 PolarHBondContact O-N 3.42Å; L103-L106 PolarHBondContact O-N 3.21Å; L103-L107 HydrophobicContact CD1-CD1 4.09Å; L103-L107 HydrophobicContact CD1-CG 4.26Å; L103-L107 HydrophobicContact CG-CD1 3.91Å; L103-L107 WeakPolarHBondContact O-CB 3.38Å; L103-L107 WeakPolarHBondContact O-CD1 3.27Å; L103-L107 WeakPolarHBondContact O-CG 3.49Å; L103-L107 PolarHBondContact O-N 2.88Å; L103-T126 HydrophobicContact CD1-CG2 4.26Å; L103-P129 HydrophobicContact CB-CB 3.95Å; L103-P129 HydrophobicContact CB-CG 4.39Å; L103-P129 HydrophobicContact CD1-CB 4.44Å; L103-T130 HydrophobicContact CD1-CG2 3.6Å; L103-T130 HydrophobicContact CD2-CG2 3.42Å; L103-T130 VanDerWaalsContact CD2-CG2 3.42Å; L103-T130 HydrophobicContact CG-CG2 4.17Å; L103-I133 HydrophobicContact CD2-CD1 4.2Å; L103-I231 HydrophobicContact CD2-CB 4.42Å; L103-I231 HydrophobicContact CD2-CD1 3.44Å; L103-I231 VanDerWaalsContact CD2-CD1 3.44Å; L103-I231 HydrophobicContact CD2-CG1 4.39Å; L103-I231 HydrophobicContact CD2-CG2 3.8Å; L103-I231 HydrophobicContact CG-CD1 4.48Å; L103-I231 HydrophobicContact CG-CG2 4.34Å
104Q97.1Very high97Very high5 Ų512 Ų122%0.0237%0.065CC..Hα-helixtrans-61.3-45.1176.1-173.3-162.5-0.700111.7L74 L100 I101 L106 L107 I108L74-Q104 HydrophobicContact CB-CG 4.49Å; L74-Q104 HydrophobicContact CD1-CB 4.47Å; L100-Q104 PolarHBondContact O-N 2.88Å; I101-Q104 WeakPolarHBondContact O-CB 3.38Å; I101-Q104 PolarHBondContact O-N 2.78Å; I101-Q104 VanDerWaalsContact O-N 3.11Å; Q104-L106 VanDerWaalsContact C-N 3.34Å; Q104-L106 PolarHBondContact O-N 3.13Å; Q104-L107 PolarHBondContact O-N 3.49Å; Q104-I108 HydrophobicContact CG-CD1 3.78Å; Q104-I108 HydrophobicContact CG-CG1 4.38Å; Q104-I108 WeakPolarHBondContact O-CG1 3.47Å; Q104-I108 PolarHBondContact O-N 3.36Å
105I97.3Very high96.9Very high10 Ų1014.4 Ų14.45%0.0518%0.076CC..Hα-helixtrans-59-49.2178.7-62.7162.4000109.5S8 L9 L12 I101 S102 L107 I108 M109S8-I105 WeakPolarHBondContact OG-CG1 3.4Å; L9-I105 HydrophobicContact CD2-CD1 3.8Å; L9-I105 HydrophobicContact CD2-CG2 4.3Å; L9-I105 HydrophobicContact CG-CD1 4.15Å; L9-I105 HydrophobicContact CG-CG2 4.42Å; L12-I105 HydrophobicContact CD1-CD1 4.31Å; I101-I105 HydrophobicContact CG2-CD1 3.76Å; I101-I105 HydrophobicContact CG2-CG1 4.31Å; I101-I105 VanDerWaalsContact O-CG1 3.27Å; I101-I105 WeakPolarHBondContact O-CG1 3.47Å; I101-I105 PolarHBondContact O-N 3.31Å; S102-I105 PolarHBondContact O-N 3.4Å; I105-L107 VanDerWaalsContact C-N 3.31Å; I105-L107 PolarHBondContact O-N 3.04Å; I105-I108 PolarHBondContact O-N 3.36Å; I105-M109 HydrophobicContact CG2-CE 3.62Å; I105-M109 HydrophobicContact CG2-SD 4.35Å; I105-M109 WeakPolarHBondContact O-CG 3.29Å; I105-M109 PolarHBondContact O-N 2.95Å
106L98.1Very high96.9Very high29 Ų2911.7 Ų11.715%0.1526%0.062CC..Hα-helixtrans-57-46.6177.3-70.6169.8000111S102 L103 Q104 I108 M109 T110 L122 A125 T126 P129S102-L106 VanDerWaalsContact O-CG 3.29Å; S102-L106 WeakPolarHBondContact O-CG 3.44Å; S102-L106 PolarHBondContact O-N 3.15Å; L103-L106 PolarHBondContact O-N 3.21Å; Q104-L106 VanDerWaalsContact C-N 3.34Å; Q104-L106 PolarHBondContact O-N 3.13Å; L106-I108 PolarHBondContact O-N 3.01Å; L106-M109 HydrophobicContact CD2-CE 4.15Å; L106-M109 CarbonylContact O-C 3.6Å; L106-M109 PolarHBondContact O-N 3.11Å; L106-T110 WeakPolarHBondContact O-CG2 3.06Å; L106-T110 PolarHBondContact O-N 3.39Å; L106-L122 HydrophobicContact CD2-CD2 3.96Å; L106-A125 HydrophobicContact CD1-CB 4.16Å; L106-A125 WeakPolarHBondContact CD1-O 2.95Å; L106-A125 HydrophobicContact CD2-CB 3.8Å; L106-T126 HydrophobicContact CB-CG2 3.96Å; L106-P129 HydrophobicContact CD1-CG 3.87Å
107L97.9Very high96.8Very high3 Ų313.9 Ų13.92%0.0167%0.073CC..Hα-helixtrans-65.1-39.2179.9-71.1167.4000113.7T70 L103 Q104 I105 M109 T110 F111 T126 I231 I235 L236 L239T70-L107 HydrophobicContact CG2-CB 4.19Å; L103-L107 HydrophobicContact CD1-CD1 4.09Å; L103-L107 HydrophobicContact CD1-CG 4.26Å; L103-L107 HydrophobicContact CG-CD1 3.91Å; L103-L107 WeakPolarHBondContact O-CB 3.38Å; L103-L107 WeakPolarHBondContact O-CD1 3.27Å; L103-L107 WeakPolarHBondContact O-CG 3.49Å; L103-L107 PolarHBondContact O-N 2.88Å; Q104-L107 PolarHBondContact O-N 3.49Å; I105-L107 VanDerWaalsContact C-N 3.31Å; I105-L107 PolarHBondContact O-N 3.04Å; L107-M109 VanDerWaalsContact C-N 3.29Å; L107-M109 PolarHBondContact O-N 2.86Å; L107-T110 VanDerWaalsContact CA-OG1 3.27Å; L107-T110 WeakPolarHBondContact CA-OG1 3.17Å; L107-T110 PolarHBondContact O-N 3.35Å; L107-T110 PolarHBondContact O-OG1 3.23Å; L107-F111 HydrophobicContact CD2-CE2 4.47Å; L107-F111 WeakPolarHBondContact O-CD2 3.25Å; L107-F111 PolarHBondContact O-N 3.48Å; L107-T126 HydrophobicContact CD2-CG2 3.76Å; L107-T126 HydrophobicContact CG-CG2 4.11Å; L107-I231 HydrophobicContact CD1-CG2 4.01Å; L107-I235 HydrophobicContact CD1-CB 4.42Å; L107-I235 HydrophobicContact CD1-CD1 4.17Å; L107-I235 HydrophobicContact CD1-CG2 3.91Å; L107-I235 HydrophobicContact CD2-CG2 3.73Å; L107-I235 HydrophobicContact CG-CG2 4.3Å; L107-L236 HydrophobicContact CD2-CD2 4.17Å; L107-L239 HydrophobicContact CD2-CD1 3.67Å; L107-L239 HydrophobicContact CD2-CD2 4.04Å; L107-L239 HydrophobicContact CD2-CG 4.06Å
108I97.3Very high96.8Very high0 Ų016 Ų160%08%0.084CC..Hα-helixtrans-65.1-39.4175.9-68.5166.9000110M1 I4 I5 I67 Q104 I105 L106 S112M1-I108 HydrophobicContact CE-CG2 3.67Å; I4-I108 HydrophobicContact CG2-CD1 3.91Å; I4-I108 HydrophobicContact CG2-CG2 4.11Å; I5-I108 HydrophobicContact CG1-CG2 4.27Å; I67-I108 HydrophobicContact CG2-CG2 4.34Å; Q104-I108 HydrophobicContact CG-CD1 3.78Å; Q104-I108 HydrophobicContact CG-CG1 4.38Å; Q104-I108 WeakPolarHBondContact O-CG1 3.47Å; Q104-I108 PolarHBondContact O-N 3.36Å; I105-I108 PolarHBondContact O-N 3.36Å; L106-I108 PolarHBondContact O-N 3.01Å; I108-S112 PolarHBondContact O-N 3.08Å; I108-S112 PolarHBondContact O-OG 3.45Å
109M96.9Very high96.8Very high38 Ų3815.5 Ų15.519%0.1878%0.08CC..Hα-helixtrans-69.8-38.4175.4-64.9-172.3-64.100111.9I5 F57 I105 L106 L107 F111 S112 A113 L122I5-M109 HydrophobicContact CD1-CG 3.89Å; I5-M109 HydrophobicContact CG1-CG 4.23Å; I5-M109 HydrophobicContact CG2-SD 4.41Å; F57-M109 HydrophobicContact CE1-CB 4.18Å; F57-M109 HydrophobicContact CE1-CG 4.15Å; F57-M109 HydrophobicContact CZ-CG 4.33Å; F57-M109 HydrophobicContact CZ-SD 4.47Å; I105-M109 HydrophobicContact CG2-CE 3.62Å; I105-M109 HydrophobicContact CG2-SD 4.35Å; I105-M109 WeakPolarHBondContact O-CG 3.29Å; I105-M109 PolarHBondContact O-N 2.95Å; L106-M109 HydrophobicContact CD2-CE 4.15Å; L106-M109 CarbonylContact O-C 3.6Å; L106-M109 PolarHBondContact O-N 3.11Å; L107-M109 VanDerWaalsContact C-N 3.29Å; L107-M109 PolarHBondContact O-N 2.86Å; M109-F111 PolarHBondContact O-N 2.83Å; M109-S112 PolarHBondContact O-N 3.25Å; M109-S112 PolarHBondContact O-OG 3.09Å; M109-A113 PolarHBondContact O-N 3.24Å; M109-L122 HydrophobicContact CB-CD1 3.61Å; M109-L122 HydrophobicContact CB-CD2 4.08Å; M109-L122 HydrophobicContact CB-CG 4.46Å; M109-L122 HydrophobicContact CE-CD2 3.85Å
110T97.5Very high96.8Very high0 Ų014.6 Ų14.60%07%0.074CC..Hα-helixtrans-59.9-48.2178.451.80000111.7L106 L107 S112 A113 F119 L122 T126 L239L106-T110 WeakPolarHBondContact O-CG2 3.06Å; L106-T110 PolarHBondContact O-N 3.39Å; L107-T110 VanDerWaalsContact CA-OG1 3.27Å; L107-T110 WeakPolarHBondContact CA-OG1 3.17Å; L107-T110 PolarHBondContact O-N 3.35Å; L107-T110 PolarHBondContact O-OG1 3.23Å; T110-S112 PolarHBondContact O-N 3.03Å; T110-A113 PolarHBondContact O-N 3.18Å; T110-F119 WeakPolarHBondContact O-CD2 3.38Å; T110-L122 HydrophobicContact CG2-CB 3.41Å; T110-L122 VanDerWaalsContact CG2-CB 3.41Å; T110-T126 HydrophobicContact CG2-CG2 4.16Å; T110-L239 HydrophobicContact CG2-CD2 4.35Å; T110-L239 WeakPolarHBondContact OG1-CD2 3.36Å
111F96.4Very high96.8Very high0 Ų019.6 Ų19.60%010%0.1CC..Hα-helixtrans-72.7-16.3-177.1-68.8-59.7000113.2S63 L66 I67 T70 L107 M109 I235 L239 Y242S63-F111 WeakPolarHBondContact CB-O 3.35Å; L66-F111 HydrophobicContact CB-CD1 3.98Å; L66-F111 HydrophobicContact CB-CD2 4.14Å; L66-F111 HydrophobicContact CB-CE1 4.03Å; L66-F111 HydrophobicContact CB-CE2 4.2Å; L66-F111 HydrophobicContact CB-CG 4.04Å; L66-F111 HydrophobicContact CB-CZ 4.14Å; L66-F111 HydrophobicContact CD1-CD1 3.81Å; L66-F111 HydrophobicContact CD1-CE1 3.59Å; L66-F111 HydrophobicContact CD1-CZ 4.3Å; L66-F111 HydrophobicContact CG-CE1 4.31Å; I67-F111 HydrophobicContact CD1-CB 4.14Å; I67-F111 HydrophobicContact CG1-CB 3.61Å; T70-F111 HydrophobicContact CG2-CD2 3.87Å; T70-F111 HydrophobicContact CG2-CE2 3.55Å; L107-F111 HydrophobicContact CD2-CE2 4.47Å; L107-F111 WeakPolarHBondContact O-CD2 3.25Å; L107-F111 PolarHBondContact O-N 3.48Å; M109-F111 PolarHBondContact O-N 2.83Å; F111-I235 HydrophobicContact CE2-CG2 3.6Å; F111-I235 HydrophobicContact CZ-CG2 3.86Å; F111-L239 HydrophobicContact CD1-CD2 4.33Å; F111-L239 HydrophobicContact CE1-CD2 3.63Å; F111-L239 HydrophobicContact CE1-CG 4.43Å; F111-L239 HydrophobicContact CE2-CD2 3.97Å; F111-L239 HydrophobicContact CZ-CD2 3.42Å; F111-L239 VanDerWaalsContact CZ-CD2 3.42Å; F111-L239 HydrophobicContact CZ-CG 3.99Å; F111-Y242 AromaticContact CD1-CD1 3.89Å; F111-Y242 HydrophobicContact CD1-CD1 3.89Å; F111-Y242 AromaticContact CD1-CD2 3.87Å; F111-Y242 HydrophobicContact CD1-CD2 3.87Å; F111-Y242 HydrophobicContact CD1-CE1 4.22Å; F111-Y242 HydrophobicContact CD1-CE2 4.23Å; F111-Y242 AromaticContact CD1-CG 3.71Å; F111-Y242 HydrophobicContact CD1-CG 3.71Å; F111-Y242 HydrophobicContact CE1-CD1 4.22Å; F111-Y242 HydrophobicContact CE1-CD2 4.33Å; F111-Y242 AromaticContact CE1-CG 3.88Å; F111-Y242 HydrophobicContact CE1-CG 3.88Å; F111-Y242 PolarHBondContact O-OH 3.5Å
112S95.4Very high96.8Very high0 Ų020.5 Ų20.50%010%0.104CC..Hα-helixtrans-103.8-2.4178.256.10000114.8F57 S58 I108 M109 T110 T114F57-S112 CarbonylContact C-O 3.36Å; F57-S112 VanDerWaalsContact CA-O 3.24Å; F57-S112 WeakPolarHBondContact CA-O 3.46Å; F57-S112 VanDerWaalsContact CD1-OG 3.32Å; F57-S112 WeakPolarHBondContact CD1-OG 3.44Å; S58-S112 PolarHBondContact N-O 3Å; S58-S112 VanDerWaalsContact O-CA 3.29Å; S58-S112 WeakPolarHBondContact O-CA 3.28Å; S58-S112 WeakPolarHBondContact O-CB 3.46Å; I108-S112 PolarHBondContact O-N 3.08Å; I108-S112 PolarHBondContact O-OG 3.45Å; M109-S112 PolarHBondContact O-N 3.25Å; M109-S112 PolarHBondContact O-OG 3.09Å; T110-S112 PolarHBondContact O-N 3.03Å; S112-T114 PolarHBondContact O-N 2.86Å
113A95.9Very high96.7Very high0 Ų019 Ų190%09%0.094CC..BIsolated β-bridgetrans-63.3126.8-179.900000111.7M109 T110 M118 F119 L122M109-A113 PolarHBondContact O-N 3.24Å; T110-A113 PolarHBondContact O-N 3.18Å; A113-M118 HydrophobicContact CB-CE 3.61Å; A113-F119 HydrophobicContact CB-CB 3.95Å; A113-L122 HydrophobicContact CB-CD1 4.42Å
114T93Very high96.7Very high4 Ų420.1 Ų20.13%0.02510%0.099CC..SBendtrans-82-40.2175.647.30000112.5N55 M56 S58 S112 L177N55-T114 WeakPolarHBondContact O-CB 3.33Å; N55-T114 PolarHBondContact O-OG1 2.74Å; M56-T114 VanDerWaalsContact CA-OG1 3.26Å; M56-T114 WeakPolarHBondContact CA-OG1 3.4Å; M56-T114 PolarHBondContact O-N 2.97Å; M56-T114 VanDerWaalsContact O-N 3.16Å; M56-T114 PolarHBondContact O-OG1 3.37Å; S58-T114 WeakPolarHBondContact OG-CG2 3.29Å; S112-T114 PolarHBondContact O-N 2.86Å; T114-L177 WeakPolarHBondContact O-CB 3.49Å; T114-L177 VanDerWaalsContact O-CG 3.29Å; T114-L177 WeakPolarHBondContact O-CG 3.32Å; T114-L177 PolarHBondContact O-N 3.44Å
115E94.5Very high96.7Very high70 Ų7021.1 Ų21.133%0.32711%0.108SC..BIsolated β-bridgetrans-90131.3179.3-67.8-121.9160.900111.2I117 M118 F119 N176E115-I117 VanDerWaalsContact C-N 3.29Å; E115-I117 PolarHBondContact O-N 3.41Å; E115-M118 HydrophobicContact CB-CB 4.27Å; E115-M118 PolarHBondContact O-N 3.2Å; E115-M118 VanDerWaalsContact O-N 3.15Å; E115-F119 PolarHBondContact O-N 3.33Å; E115-N176 HydrophobicContact CG-CB 4.41Å
116L95.1Very high96.7Very high0 Ų020.6 Ų20.60%011%0.106CC..Hα-helixtrans-63.7-30.9-177.5-75172.7000113.6F119 Y120 L165 L175 L177 L180 R246 I247 I250L116-F119 HydrophobicContact CD2-CD1 4.4Å; L116-F119 WeakPolarHBondContact O-CB 3.49Å; L116-F119 PolarHBondContact O-N 3.36Å; L116-Y120 PolarHBondContact O-N 3.46Å; L116-L165 HydrophobicContact CB-CD2 3.9Å; L116-L165 HydrophobicContact CD1-CD2 4.07Å; L116-L175 HydrophobicContact CB-CB 4.22Å; L116-L175 HydrophobicContact CB-CD2 4.3Å; L116-L175 HydrophobicContact CD1-CD2 4.21Å; L116-L175 PolarHBondContact N-O 3.39Å; L116-L177 HydrophobicContact CD1-CD2 4.24Å; L116-L177 HydrophobicContact CD2-CD1 4.42Å; L116-L177 HydrophobicContact CD2-CD2 3.77Å; L116-L177 HydrophobicContact CD2-CG 4.18Å; L116-L177 HydrophobicContact CG-CD2 3.93Å; L116-L177 HydrophobicContact CG-CG 4.17Å; L116-L180 HydrophobicContact CD1-CD1 3.78Å; L116-R246 HydrophobicContact CD2-CB 4.38Å; L116-I247 HydrophobicContact CD1-CG1 4.22Å; L116-I247 HydrophobicContact CD2-CD1 4.27Å; L116-I247 HydrophobicContact CD2-CG1 4.14Å; L116-I250 HydrophobicContact CD1-CD1 3.58Å
117I96.6Very high96.6Very high47 Ų4719.5 Ų19.524%0.24110%0.1CC..Hα-helixtrans-70.4-37.7175.8-163.664.6000111.6E115 F119 Y120 I121 L162 L175E115-I117 VanDerWaalsContact C-N 3.29Å; E115-I117 PolarHBondContact O-N 3.41Å; I117-F119 VanDerWaalsContact C-N 3.34Å; I117-Y120 WeakPolarHBondContact O-CB 3.33Å; I117-Y120 PolarHBondContact O-N 2.74Å; I117-I121 WeakPolarHBondContact O-CG1 3.12Å; I117-I121 PolarHBondContact O-N 3.33Å; I117-L162 HydrophobicContact CD1-CD1 3.56Å; I117-L175 HydrophobicContact CB-CD1 3.97Å
118M96.5Very high96.6Very high44 Ų4424.7 Ų24.722%0.21713%0.126CC..Hα-helixtrans-66.6-41.2173.8-170.2176.496.700110.3M56 F57 A113 E115 Y120 I121 L122M56-M118 HydrophobicContact CB-CE 4.44Å; M56-M118 HydrophobicContact CB-SD 4.49Å; M56-M118 VanDerWaalsContact O-CE 3.3Å; M56-M118 WeakPolarHBondContact O-CE 3.36Å; F57-M118 HydrophobicContact CD1-CE 3.98Å; F57-M118 HydrophobicContact CE1-CE 3.51Å; F57-M118 HydrophobicContact CZ-CE 4.02Å; A113-M118 HydrophobicContact CB-CE 3.61Å; E115-M118 HydrophobicContact CB-CB 4.27Å; E115-M118 PolarHBondContact O-N 3.2Å; E115-M118 VanDerWaalsContact O-N 3.15Å; M118-Y120 VanDerWaalsContact C-N 3.32Å; M118-Y120 PolarHBondContact O-N 3.13Å; M118-I121 PolarHBondContact O-N 3.43Å; M118-L122 HydrophobicContact CE-CD1 4.07Å; M118-L122 HydrophobicContact CG-CD1 3.9Å; M118-L122 HydrophobicContact CG-CG 4.46Å; M118-L122 WeakPolarHBondContact O-CB 3.48Å; M118-L122 VanDerWaalsContact O-CG 3.28Å; M118-L122 WeakPolarHBondContact O-CG 3.17Å; M118-L122 PolarHBondContact O-N 3.19Å
119F97Very high96.6Very high3 Ų325 Ų251%0.01313%0.129CC..Hα-helixtrans-55.4-47.1171.1168.6-105.7000111.4T110 A113 E115 L116 I117 L122 F123 F204 Y242T110-F119 WeakPolarHBondContact O-CD2 3.38Å; A113-F119 HydrophobicContact CB-CB 3.95Å; E115-F119 PolarHBondContact O-N 3.33Å; L116-F119 HydrophobicContact CD2-CD1 4.4Å; L116-F119 WeakPolarHBondContact O-CB 3.49Å; L116-F119 PolarHBondContact O-N 3.36Å; I117-F119 VanDerWaalsContact C-N 3.34Å; F119-L122 PolarHBondContact O-N 2.89Å; F119-F123 HydrophobicContact CZ-CD2 4.34Å; F119-F123 WeakPolarHBondContact O-CB 3.4Å; F119-F123 PolarHBondContact O-N 3.25Å; F119-F204 AromaticContact CE1-CE1 3.69Å; F119-F204 HydrophobicContact CE1-CE1 3.69Å; F119-F204 AromaticContact CE1-CZ 3.84Å; F119-F204 HydrophobicContact CE1-CZ 3.84Å; F119-F204 HydrophobicContact CZ-CE1 4.04Å; F119-Y242 HydrophobicContact CD2-CD1 4.32Å; F119-Y242 AromaticContact CD2-CE1 3.97Å; F119-Y242 HydrophobicContact CD2-CE1 3.97Å; F119-Y242 AromaticContact CE2-CD1 3.55Å; F119-Y242 HydrophobicContact CE2-CD1 3.55Å; F119-Y242 AromaticContact CE2-CE1 3.67Å; F119-Y242 HydrophobicContact CE2-CE1 3.67Å; F119-Y242 HydrophobicContact CZ-CD1 4.02Å; F119-Y242 HydrophobicContact CZ-CE1 4.4Å
120Y97.6Very high96.6Very high21 Ų2123.4 Ų23.48%0.08212%0.121CC..Hα-helixtrans-60.2-49.9177.9174.1-93.6000112.9L116 I117 M118 L122 F123 E124 S158 L161 L162 L165L116-Y120 PolarHBondContact O-N 3.46Å; I117-Y120 WeakPolarHBondContact O-CB 3.33Å; I117-Y120 PolarHBondContact O-N 2.74Å; M118-Y120 VanDerWaalsContact C-N 3.32Å; M118-Y120 PolarHBondContact O-N 3.13Å; Y120-L122 VanDerWaalsContact C-N 3.31Å; Y120-L122 PolarHBondContact O-N 3.28Å; Y120-F123 WeakPolarHBondContact O-CB 3.22Å; Y120-F123 PolarHBondContact O-N 3.2Å; Y120-E124 HydrophobicContact CD2-CG 4.47Å; Y120-E124 HydrophobicContact CE1-CG 4.14Å; Y120-E124 HydrophobicContact CE2-CG 3.91Å; Y120-E124 PolarHBondContact O-N 3.42Å; Y120-S158 WeakPolarHBondContact CE2-O 3.47Å; Y120-S158 PolarHBondContact OH-O 2.94Å; Y120-L161 HydrophobicContact CD2-CD2 3.81Å; Y120-L161 HydrophobicContact CD2-CG 4.11Å; Y120-L161 HydrophobicContact CE2-CD2 4.25Å; Y120-L161 HydrophobicContact CE2-CG 4.42Å; Y120-L162 HydrophobicContact CD1-CD1 3.83Å; Y120-L162 HydrophobicContact CE1-CB 3.9Å; Y120-L162 HydrophobicContact CE1-CD1 3.71Å; Y120-L162 HydrophobicContact CE1-CD2 4.05Å; Y120-L162 HydrophobicContact CE1-CG 4.09Å; Y120-L162 HydrophobicContact CE2-CB 4.09Å; Y120-L165 HydrophobicContact CD2-CD1 4.46Å; Y120-L165 HydrophobicContact CG-CD1 4.35Å
121I98.2Very high96.6Very high105 Ų10525.5 Ų25.554%0.53813%0.132SC..Hα-helixtrans-58.9-46.4-179.5-67.6165.7000110.1I117 M118 A125I117-I121 WeakPolarHBondContact O-CG1 3.12Å; I117-I121 PolarHBondContact O-N 3.33Å; M118-I121 PolarHBondContact O-N 3.43Å; I121-A125 VanDerWaalsContact O-CB 3.23Å; I121-A125 WeakPolarHBondContact O-CB 3.26Å; I121-A125 PolarHBondContact O-N 2.91Å
122L97.9Very high96.6Very high19 Ų1928.1 Ų28.110%0.09915%0.145CC..Hα-helixtrans-68.2-38179.1-67.5168.3000111.6L106 M109 T110 A113 M118 F119 Y120 A125 T126L106-L122 HydrophobicContact CD2-CD2 3.96Å; M109-L122 HydrophobicContact CB-CD1 3.61Å; M109-L122 HydrophobicContact CB-CD2 4.08Å; M109-L122 HydrophobicContact CB-CG 4.46Å; M109-L122 HydrophobicContact CE-CD2 3.85Å; T110-L122 HydrophobicContact CG2-CB 3.41Å; T110-L122 VanDerWaalsContact CG2-CB 3.41Å; A113-L122 HydrophobicContact CB-CD1 4.42Å; M118-L122 HydrophobicContact CE-CD1 4.07Å; M118-L122 HydrophobicContact CG-CD1 3.9Å; M118-L122 HydrophobicContact CG-CG 4.46Å; M118-L122 WeakPolarHBondContact O-CB 3.48Å; M118-L122 VanDerWaalsContact O-CG 3.28Å; M118-L122 WeakPolarHBondContact O-CG 3.17Å; M118-L122 PolarHBondContact O-N 3.19Å; F119-L122 PolarHBondContact O-N 2.89Å; Y120-L122 VanDerWaalsContact C-N 3.31Å; Y120-L122 PolarHBondContact O-N 3.28Å; L122-A125 PolarHBondContact O-N 3.4Å; L122-T126 WeakPolarHBondContact O-CG2 3.3Å; L122-T126 PolarHBondContact O-N 2.95Å; L122-T126 VanDerWaalsContact O-N 3.12Å
123F96.8Very high96.7Very high1 Ų128.1 Ų28.10%0.00415%0.145CC..Hα-helixtrans-59.9-46.7177.4165.2-96.4000111.5F119 Y120 T126 F204 K207 L239F119-F123 HydrophobicContact CZ-CD2 4.34Å; F119-F123 WeakPolarHBondContact O-CB 3.4Å; F119-F123 PolarHBondContact O-N 3.25Å; Y120-F123 WeakPolarHBondContact O-CB 3.22Å; Y120-F123 PolarHBondContact O-N 3.2Å; F123-T126 PolarHBondContact O-N 3.35Å; F123-T126 PolarHBondContact O-OG1 3.25Å; F123-F204 HydrophobicContact CE2-CD1 4.25Å; F123-F204 HydrophobicContact CE2-CE1 4.26Å; F123-F204 HydrophobicContact CZ-CD1 4.2Å; F123-F204 HydrophobicContact CZ-CE1 4.23Å; F123-K207 HydrophobicContact CE2-CD 4.2Å; F123-K207 HydrophobicContact CE2-CG 3.73Å; F123-K207 HydrophobicContact CZ-CB 4.47Å; F123-K207 HydrophobicContact CZ-CD 4.11Å; F123-K207 HydrophobicContact CZ-CG 3.44Å; F123-K207 VanDerWaalsContact CZ-CG 3.44Å; F123-L239 HydrophobicContact CD2-CB 4.11Å; F123-L239 HydrophobicContact CD2-CD1 4.33Å; F123-L239 HydrophobicContact CE2-CB 4.18Å
124E97Very high96.8Very high24 Ų2428.2 Ų28.211%0.11215%0.146CC..Hα-helixtrans-71.6-35.7174.3-70.1-59.4121.300111.9Y120 T126 L127 S158Y120-E124 HydrophobicContact CD2-CG 4.47Å; Y120-E124 HydrophobicContact CE1-CG 4.14Å; Y120-E124 HydrophobicContact CE2-CG 3.91Å; Y120-E124 PolarHBondContact O-N 3.42Å; E124-T126 PolarHBondContact O-N 3.49Å; E124-T126 VanDerWaalsContact O-N 3.16Å; E124-L127 WeakPolarHBondContact O-CB 3.38Å; E124-L127 WeakPolarHBondContact O-CG 3.37Å; E124-L127 PolarHBondContact O-N 2.9Å; E124-L127 WeakPolarHBondContact OE2-CD1 3.26Å; E124-S158 WeakPolarHBondContact OE1-CB 3.4Å; E124-S158 PolarHBondContact OE1-OG 3.31Å; E124-S158 VanDerWaalsContact OE1-OG 3.13Å; E124-S158 PolarHBondContact OE2-OG 3.06Å
125A97.8Very high96.9Very high25 Ų2529.6 Ų29.621%0.20715%0.154CC..Hα-helixtrans-59.2-30177.300000112.6L106 I121 L122 L127 I128 P129L106-A125 HydrophobicContact CD1-CB 4.16Å; L106-A125 WeakPolarHBondContact CD1-O 2.95Å; L106-A125 HydrophobicContact CD2-CB 3.8Å; I121-A125 VanDerWaalsContact O-CB 3.23Å; I121-A125 WeakPolarHBondContact O-CB 3.26Å; I121-A125 PolarHBondContact O-N 2.91Å; L122-A125 PolarHBondContact O-N 3.4Å; A125-L127 PolarHBondContact O-N 3.3Å; A125-I128 PolarHBondContact O-N 3.06Å; A125-I128 VanDerWaalsContact O-N 3.15Å; A125-P129 WeakPolarHBondContact O-CD 3.42Å
126T97.6Very high97Very high0 Ų033.2 Ų33.20%017%0.165CC..THydrogen-bonded Turntrans-61.4-21.1174.167.10000113.5L103 L106 L107 T110 L122 F123 E124 I128 T130 L239L103-T126 HydrophobicContact CD1-CG2 4.26Å; L106-T126 HydrophobicContact CB-CG2 3.96Å; L107-T126 HydrophobicContact CD2-CG2 3.76Å; L107-T126 HydrophobicContact CG-CG2 4.11Å; T110-T126 HydrophobicContact CG2-CG2 4.16Å; L122-T126 WeakPolarHBondContact O-CG2 3.3Å; L122-T126 PolarHBondContact O-N 2.95Å; L122-T126 VanDerWaalsContact O-N 3.12Å; F123-T126 PolarHBondContact O-N 3.35Å; F123-T126 PolarHBondContact O-OG1 3.25Å; E124-T126 PolarHBondContact O-N 3.49Å; E124-T126 VanDerWaalsContact O-N 3.16Å; T126-I128 VanDerWaalsContact C-N 3.29Å; T126-I128 PolarHBondContact O-N 2.88Å; T126-T130 WeakPolarHBondContact O-CB 3.49Å; T126-T130 WeakPolarHBondContact O-CG2 3.44Å; T126-T130 PolarHBondContact O-OG1 3.12Å; T126-L239 HydrophobicContact CG2-CD1 4.3Å
127L96.5Very high97Very high5 Ų534.3 Ų34.33%0.02617%0.169CC..Hα-helixtrans-65.5-32.3176.3-67.1174.9000112.4E124 A125 T130 L131 F150 T154E124-L127 WeakPolarHBondContact O-CB 3.38Å; E124-L127 WeakPolarHBondContact O-CG 3.37Å; E124-L127 PolarHBondContact O-N 2.9Å; E124-L127 WeakPolarHBondContact OE2-CD1 3.26Å; A125-L127 PolarHBondContact O-N 3.3Å; L127-T130 VanDerWaalsContact C-OG1 3.28Å; L127-T130 VanDerWaalsContact CA-OG1 3.25Å; L127-T130 WeakPolarHBondContact CA-OG1 3.48Å; L127-T130 PolarHBondContact O-OG1 3.24Å; L127-L131 WeakPolarHBondContact O-CB 3.36Å; L127-L131 PolarHBondContact O-N 3.22Å; L127-F150 HydrophobicContact CD2-CD1 4.25Å; L127-F150 HydrophobicContact CD2-CE1 3.44Å; L127-F150 VanDerWaalsContact CD2-CE1 3.44Å; L127-F150 HydrophobicContact CD2-CE2 4.25Å; L127-F150 HydrophobicContact CD2-CZ 3.45Å; L127-F150 VanDerWaalsContact CD2-CZ 3.45Å; L127-T154 VanDerWaalsContact CD1-OG1 3.23Å; L127-T154 WeakPolarHBondContact CD1-OG1 3.28Å; L127-T154 HydrophobicContact CD2-CG2 4.02Å; L127-T154 WeakPolarHBondContact CD2-OG1 3.35Å
128I96.9Very high96.9Very high112 Ų11232.2 Ų32.257%0.57416%0.159SC*.Hα-helixtrans-68.6-55.9-172.6-60.1165.9000110.8A125 T126 T130 L131 I132A125-I128 PolarHBondContact O-N 3.06Å; A125-I128 VanDerWaalsContact O-N 3.15Å; T126-I128 VanDerWaalsContact C-N 3.29Å; T126-I128 PolarHBondContact O-N 2.88Å; I128-T130 VanDerWaalsContact C-N 3.28Å; I128-T130 PolarHBondContact O-N 3.19Å; I128-L131 PolarHBondContact O-N 3.34Å; I128-I132 HydrophobicContact CG2-CD1 4Å; I128-I132 VanDerWaalsContact O-CG1 3.28Å; I128-I132 WeakPolarHBondContact O-CG1 3.45Å; I128-I132 PolarHBondContact O-N 2.84Å; I128-I132 VanDerWaalsContact O-N 3.15Å
129P97.5Very high96.6Very high7 Ų734.3 Ų34.35%0.04517%0.171CC..Hα-helixtrans-63-36.4178.4-2234.1000112.5M99 L103 L106 A125 I132 I133M99-P129 HydrophobicContact SD-CB 4.42Å; L103-P129 HydrophobicContact CB-CB 3.95Å; L103-P129 HydrophobicContact CB-CG 4.39Å; L103-P129 HydrophobicContact CD1-CB 4.44Å; L106-P129 HydrophobicContact CD1-CG 3.87Å; A125-P129 WeakPolarHBondContact O-CD 3.42Å; P129-I132 PolarHBondContact O-N 3.11Å; P129-I133 WeakPolarHBondContact O-CB 3.03Å; P129-I133 WeakPolarHBondContact O-CD1 3.25Å; P129-I133 WeakPolarHBondContact O-CG1 3.26Å; P129-I133 PolarHBondContact O-N 2.97Å
130T96.9Very high96.4Very high4 Ų438 Ų383%0.02519%0.188CC..Hα-helixtrans-67.5-44.5-178.450.60000111.9L103 T126 L127 I128 I132 I133 I134 F150 L236L103-T130 HydrophobicContact CD1-CG2 3.6Å; L103-T130 HydrophobicContact CD2-CG2 3.42Å; L103-T130 VanDerWaalsContact CD2-CG2 3.42Å; L103-T130 HydrophobicContact CG-CG2 4.17Å; T126-T130 WeakPolarHBondContact O-CB 3.49Å; T126-T130 WeakPolarHBondContact O-CG2 3.44Å; T126-T130 PolarHBondContact O-OG1 3.12Å; L127-T130 VanDerWaalsContact C-OG1 3.28Å; L127-T130 VanDerWaalsContact CA-OG1 3.25Å; L127-T130 WeakPolarHBondContact CA-OG1 3.48Å; L127-T130 PolarHBondContact O-OG1 3.24Å; I128-T130 VanDerWaalsContact C-N 3.28Å; I128-T130 PolarHBondContact O-N 3.19Å; T130-I132 VanDerWaalsContact C-N 3.32Å; T130-I132 PolarHBondContact O-N 3Å; T130-I133 PolarHBondContact O-N 2.96Å; T130-I134 VanDerWaalsContact O-CG1 3.28Å; T130-I134 WeakPolarHBondContact O-CG1 3.37Å; T130-I134 PolarHBondContact O-N 3.37Å; T130-F150 VanDerWaalsContact OG1-CE1 3.32Å; T130-F150 WeakPolarHBondContact OG1-CE1 3.38Å; T130-L236 HydrophobicContact CG2-CD1 3.4Å; T130-L236 HydrophobicContact CG2-CD2 4.27Å; T130-L236 HydrophobicContact CG2-CG 4.48Å
131L97.1Very high96Very high44 Ų4442.9 Ų42.923%0.2322%0.22CC..Hα-helixtrans-58.6-45.4174.3-178.571.5000111.3L127 I128 I133 I134 T135 G147 L151L127-L131 WeakPolarHBondContact O-CB 3.36Å; L127-L131 PolarHBondContact O-N 3.22Å; I128-L131 PolarHBondContact O-N 3.34Å; L131-I133 VanDerWaalsContact C-N 3.33Å; L131-I133 PolarHBondContact O-N 2.98Å; L131-I134 PolarHBondContact O-N 3.33Å; L131-T135 HydrophobicContact CD1-CG2 3.87Å; L131-T135 HydrophobicContact CG-CG2 4.24Å; L131-T135 WeakPolarHBondContact O-CB 3.24Å; L131-T135 WeakPolarHBondContact O-CG2 3.41Å; L131-T135 PolarHBondContact O-N 3.4Å; L131-T135 PolarHBondContact O-OG1 3.4Å; L131-G147 WeakPolarHBondContact CD1-O 3.29Å; L131-L151 HydrophobicContact CD1-CB 4.46Å; L131-L151 HydrophobicContact CD2-CD1 4.21Å
132I97.6Very high95.8Very high55 Ų5543.4 Ų43.428%0.28222%0.221SC..Hα-helixtrans-62.6-43.3178.3-62.1167.1000109.9M99 I128 P129 T130 I134 R136 W137M99-I132 HydrophobicContact CE-CD1 3.75Å; M99-I132 HydrophobicContact CE-CG2 4.12Å; M99-I132 HydrophobicContact CG-CG2 4.37Å; M99-I132 HydrophobicContact SD-CB 4.42Å; M99-I132 HydrophobicContact SD-CD1 3.93Å; M99-I132 HydrophobicContact SD-CG2 4.31Å; I128-I132 HydrophobicContact CG2-CD1 4Å; I128-I132 VanDerWaalsContact O-CG1 3.28Å; I128-I132 WeakPolarHBondContact O-CG1 3.45Å; I128-I132 PolarHBondContact O-N 2.84Å; I128-I132 VanDerWaalsContact O-N 3.15Å; P129-I132 PolarHBondContact O-N 3.11Å; T130-I132 VanDerWaalsContact C-N 3.32Å; T130-I132 PolarHBondContact O-N 3Å; I132-I134 PolarHBondContact O-N 2.9Å; I132-R136 WeakPolarHBondContact O-CB 3.32Å; I132-R136 PolarHBondContact O-N 3.26Å; I132-W137 HydrophobicContact CG2-CZ3 3.96Å
133I97.1Very high95.7Very high1 Ų146 Ų461%0.00523%0.229CC..Hα-helixtrans-58.5-47.2177.7-70.9161.2000111.5Y96 M99 L100 L103 P129 T130 L131 W137 P225Y96-I133 HydrophobicContact CE2-CG2 4.25Å; M99-I133 HydrophobicContact CB-CD1 4.09Å; M99-I133 HydrophobicContact CB-CG1 3.94Å; L100-I133 HydrophobicContact CD2-CD1 3.76Å; L103-I133 HydrophobicContact CD2-CD1 4.2Å; P129-I133 WeakPolarHBondContact O-CB 3.03Å; P129-I133 WeakPolarHBondContact O-CD1 3.25Å; P129-I133 WeakPolarHBondContact O-CG1 3.26Å; P129-I133 PolarHBondContact O-N 2.97Å; T130-I133 PolarHBondContact O-N 2.96Å; L131-I133 VanDerWaalsContact C-N 3.33Å; L131-I133 PolarHBondContact O-N 2.98Å; I133-W137 PolarHBondContact O-N 3.5Å; I133-P225 HydrophobicContact CG2-CG 3.63Å
134I96.6Very high95.6Very high2 Ų250.8 Ų50.81%0.0125%0.254CS..Hα-helixtrans-67.5-53.5-178.3-62.5163.9000110.8T130 L131 I132 R136 G138 F150 A224 L232T130-I134 VanDerWaalsContact O-CG1 3.28Å; T130-I134 WeakPolarHBondContact O-CG1 3.37Å; T130-I134 PolarHBondContact O-N 3.37Å; L131-I134 PolarHBondContact O-N 3.33Å; I132-I134 PolarHBondContact O-N 2.9Å; I134-R136 PolarHBondContact O-N 2.93Å; I134-G138 WeakPolarHBondContact O-CA 3.42Å; I134-G138 PolarHBondContact O-N 3.38Å; I134-F150 HydrophobicContact CD1-CD1 4.28Å; I134-A224 HydrophobicContact CG1-CB 4.1Å; I134-L232 HydrophobicContact CD1-CD1 4.11Å; I134-L232 HydrophobicContact CG1-CD1 4.49Å
135T96.9Very high95.6Very high33 Ų3354.2 Ų54.220%0.20227%0.273CS..Hα-helixtrans-73.6-28.1-17157.30000113.1L131 R143 L144L131-T135 HydrophobicContact CD1-CG2 3.87Å; L131-T135 HydrophobicContact CG-CG2 4.24Å; L131-T135 WeakPolarHBondContact O-CB 3.24Å; L131-T135 WeakPolarHBondContact O-CG2 3.41Å; L131-T135 PolarHBondContact O-N 3.4Å; L131-T135 PolarHBondContact O-OG1 3.4Å; T135-R143 VanDerWaalsContact O-CD 3.3Å; T135-R143 WeakPolarHBondContact O-CD 3.32Å; T135-R143 VanDerWaalsContact O-CZ 3.29Å; T135-R143 PolarHBondContact O-NE 2.75Å; T135-L144 HydrophobicContact CG2-CD2 4.33Å
136R95.8Very high95.5Very high146 Ų14653.1 Ų53.155%0.55126%0.264SS*.Hα-helixtrans-91.9-44.2-177.9-174.663.51781792.1113.7I132 I134 R143I132-R136 WeakPolarHBondContact O-CB 3.32Å; I132-R136 PolarHBondContact O-N 3.26Å; I134-R136 PolarHBondContact O-N 2.93Å; R136-R143 PolarHBondContact O-NH1 2.86Å
137W95.8Very high95.4Very high23 Ų2353.1 Ų53.19%0.08726%0.264CS..Hα-helixtrans-110.47.1-174.7-65.9-87.6000114.1L85 L95 Y96 M99 I132 I133 P225L85-W137 HydrophobicContact CD2-CG 4.49Å; L95-W137 HydrophobicContact CB-CH2 4.31Å; L95-W137 HydrophobicContact CB-CZ2 4.3Å; Y96-W137 HydrophobicContact CD2-CB 4.32Å; Y96-W137 AromaticContact CD2-CD2 3.44Å; Y96-W137 HydrophobicContact CD2-CD2 3.44Å; Y96-W137 VanDerWaalsContact CD2-CD2 3.44Å; Y96-W137 AromaticContact CD2-CE2 3.67Å; Y96-W137 AromaticContact CD2-CE3 3.67Å; Y96-W137 HydrophobicContact CD2-CE3 3.67Å; Y96-W137 AromaticContact CD2-CG 3.75Å; Y96-W137 HydrophobicContact CD2-CG 3.75Å; Y96-W137 HydrophobicContact CD2-CH2 4.27Å; Y96-W137 HydrophobicContact CD2-CZ2 4.11Å; Y96-W137 HydrophobicContact CD2-CZ3 4.04Å; Y96-W137 HydrophobicContact CE2-CB 4.15Å; Y96-W137 HydrophobicContact CE2-CD2 4.12Å; Y96-W137 HydrophobicContact CE2-CE3 4.29Å; Y96-W137 HydrophobicContact CE2-CG 4.08Å; Y96-W137 HydrophobicContact CG-CD2 4.4Å; Y96-W137 HydrophobicContact CG-CZ2 4.38Å; M99-W137 HydrophobicContact CG-CH2 4.35Å; M99-W137 HydrophobicContact CG-CZ3 4.32Å; I132-W137 HydrophobicContact CG2-CZ3 3.96Å; I133-W137 PolarHBondContact O-N 3.5Å; W137-P225 HydrophobicContact CB-CB 4.48Å; W137-P225 HydrophobicContact CB-CG 4.09Å
138G93.5Very high95.4Very high2 Ų257.1 Ų57.12%0.02129%0.285CS..  trans-66.3148.6166.200000111.7I134 R143 E223I134-G138 WeakPolarHBondContact O-CA 3.42Å; I134-G138 PolarHBondContact O-N 3.38Å; G138-R143 WeakPolarHBondContact O-CD 3.41Å; G138-R143 PolarHBondContact O-NH1 3.27Å; G138-E223 WeakPolarHBondContact CA-O 3.36Å
139N90Very high95.3Very high88 Ų8856 Ų5647%0.47127%0.274SS..SBendtrans-84.2-38.5-171.1-74.82.5000114.2Y335N139-Y335 VanDerWaalsContact ND2-CE1 3.28Å; N139-Y335 WeakPolarHBondContact ND2-CE1 3.32Å; N139-Y335 PolarHBondContact ND2-OH 3.12Å
140Q92.9Very high95.2Very high82 Ų8255.7 Ų55.738%0.38327%0.272SS..SBendtrans-93.3167.5-176.1-50.5-72-15.100112.3E142 R143 E223Q140-E142 VanDerWaalsContact C-N 3.29Å; Q140-E142 PolarHBondContact O-N 3.32Å; Q140-R143 WeakPolarHBondContact O-CB 3.47Å; Q140-R143 VanDerWaalsContact O-CD 3.27Å; Q140-R143 WeakPolarHBondContact O-CD 2.98Å; Q140-R143 WeakPolarHBondContact O-CG 3.46Å; Q140-R143 PolarHBondContact O-N 3.45Å; Q140-E223 WeakPolarHBondContact CB-OE2 3.45Å; Q140-E223 VanDerWaalsContact CG-OE2 3.28Å; Q140-E223 WeakPolarHBondContact CG-OE2 3.45Å
141T90.3Very high95.2Very high123 Ų12357.6 Ų57.676%0.75528%0.282SS*.THydrogen-bonded Turntrans-62.4-34176.152.60000112.7R143T141-R143 PolarHBondContact O-N 3.09Å
142E94.1Very high95.1Very high116 Ų11660.6 Ų60.654%0.54229%0.293SS..THydrogen-bonded Turntrans-65.9-9-178.1-63.7-171.8177.700114.2Q140 L144 N145 A146 E223Q140-E142 VanDerWaalsContact C-N 3.29Å; Q140-E142 PolarHBondContact O-N 3.32Å; E142-L144 PolarHBondContact O-N 2.99Å; E142-L144 VanDerWaalsContact O-N 3.15Å; E142-N145 PolarHBondContact O-N 2.69Å; E142-A146 PolarHBondContact O-N 3.28Å; E142-E223 HydrophobicContact CB-CG 4.18Å
143R95.3Very high95Very high73 Ų7360.8 Ų60.828%0.27529%0.291SS..Hα-helixtrans-55.1-32.3177.771.7-170.9179.3168.77.4113.9T135 R136 G138 Q140 T141 G147 E223T135-R143 VanDerWaalsContact O-CD 3.3Å; T135-R143 WeakPolarHBondContact O-CD 3.32Å; T135-R143 VanDerWaalsContact O-CZ 3.29Å; T135-R143 PolarHBondContact O-NE 2.75Å; R136-R143 PolarHBondContact O-NH1 2.86Å; G138-R143 WeakPolarHBondContact O-CD 3.41Å; G138-R143 PolarHBondContact O-NH1 3.27Å; Q140-R143 WeakPolarHBondContact O-CB 3.47Å; Q140-R143 VanDerWaalsContact O-CD 3.27Å; Q140-R143 WeakPolarHBondContact O-CD 2.98Å; Q140-R143 WeakPolarHBondContact O-CG 3.46Å; Q140-R143 PolarHBondContact O-N 3.45Å; T141-R143 PolarHBondContact O-N 3.09Å; R143-G147 PolarHBondContact O-N 2.88Å; R143-E223 HydrophobicContact CB-CB 4.28Å
144L94.8Very high95Very high101 Ų10160.9 Ų60.953%0.52929%0.291SS..Hα-helixtrans-69.2-47.7176.7-66.6178.1000110.6T135 E142 A146 G147 I148T135-L144 HydrophobicContact CG2-CD2 4.33Å; E142-L144 PolarHBondContact O-N 2.99Å; E142-L144 VanDerWaalsContact O-N 3.15Å; L144-A146 VanDerWaalsContact C-N 3.34Å; L144-A146 PolarHBondContact O-N 3.11Å; L144-G147 PolarHBondContact O-N 2.92Å; L144-I148 WeakPolarHBondContact O-CG1 3.3Å; L144-I148 PolarHBondContact O-N 2.75Å
145N96.6Very high94.9Very high96 Ų9663.4 Ų63.451%0.51331%0.305SS..Hα-helixtrans-61.5-44175.3-74.7-5.9000110.8E142 G147 I148 Y149E142-N145 PolarHBondContact O-N 2.69Å; N145-G147 VanDerWaalsContact C-N 3.3Å; N145-G147 PolarHBondContact O-N 3.36Å; N145-I148 WeakPolarHBondContact O-CB 3.47Å; N145-I148 PolarHBondContact O-N 3.35Å; N145-I148 VanDerWaalsContact O-N 3.16Å; N145-Y149 WeakPolarHBondContact O-CD2 3.26Å; N145-Y149 PolarHBondContact O-N 3.14Å
146A95.6Very high94.9Very high2 Ų267.3 Ų67.32%0.01732%0.323CS..Hα-helixtrans-58.8-41.2175.700000112.2E142 L144 Y149 F150 K219 E223E142-A146 PolarHBondContact O-N 3.28Å; L144-A146 VanDerWaalsContact C-N 3.34Å; L144-A146 PolarHBondContact O-N 3.11Å; A146-Y149 PolarHBondContact O-N 3.15Å; A146-F150 WeakPolarHBondContact O-CB 3.27Å; A146-F150 PolarHBondContact O-N 3.29Å; A146-K219 HydrophobicContact CB-CB 4.05Å; A146-E223 HydrophobicContact CB-CB 4.07Å; A146-E223 HydrophobicContact CB-CG 4.24Å
147G95.7Very high94.8Very high1 Ų160.5 Ų60.51%0.0130%0.298CS..Hα-helixtrans-62.6-42173.700000113.2L131 R143 L144 N145 F150 L151L131-G147 WeakPolarHBondContact CD1-O 3.29Å; R143-G147 PolarHBondContact O-N 2.88Å; L144-G147 PolarHBondContact O-N 2.92Å; N145-G147 VanDerWaalsContact C-N 3.3Å; N145-G147 PolarHBondContact O-N 3.36Å; G147-F150 PolarHBondContact O-N 3.39Å; G147-L151 WeakPolarHBondContact O-CB 3.47Å; G147-L151 PolarHBondContact O-N 2.87Å
148I95.6Very high94.8Very high88 Ų8859.4 Ų59.445%0.45129%0.294SS..Hα-helixtrans-62.3-48175.5-68.8167000110.5L144 N145 F150 L151 F152L144-I148 WeakPolarHBondContact O-CG1 3.3Å; L144-I148 PolarHBondContact O-N 2.75Å; N145-I148 WeakPolarHBondContact O-CB 3.47Å; N145-I148 PolarHBondContact O-N 3.35Å; N145-I148 VanDerWaalsContact O-N 3.16Å; I148-F150 PolarHBondContact O-N 3.25Å; I148-L151 PolarHBondContact O-N 3.47Å; I148-F152 HydrophobicContact CG2-CD2 3.61Å; I148-F152 HydrophobicContact CG2-CE2 3.86Å; I148-F152 VanDerWaalsContact O-CD2 3.31Å; I148-F152 WeakPolarHBondContact O-CD2 3.44Å; I148-F152 PolarHBondContact O-N 2.99Å
149Y95.4Very high94.9Very high88 Ų8863.6 Ų63.635%0.34532%0.315SS..Hα-helixtrans-58-48.5175.8-81.8-73.6000111.5N145 A146 L151 Y153 K219N145-Y149 WeakPolarHBondContact O-CD2 3.26Å; N145-Y149 PolarHBondContact O-N 3.14Å; A146-Y149 PolarHBondContact O-N 3.15Å; Y149-L151 PolarHBondContact O-N 3.2Å; Y149-Y153 HydrophobicContact CD1-CD2 4.29Å; Y149-Y153 AromaticContact CD1-CE2 3.65Å; Y149-Y153 HydrophobicContact CD1-CE2 3.65Å; Y149-Y153 HydrophobicContact CE1-CE2 4.31Å; Y149-Y153 VanDerWaalsContact O-CB 3.28Å; Y149-Y153 WeakPolarHBondContact O-CB 3.48Å; Y149-Y153 WeakPolarHBondContact O-CD2 3.22Å; Y149-Y153 PolarHBondContact O-N 3.43Å; Y149-Y153 VanDerWaalsContact O-N 3.14Å; Y149-K219 HydrophobicContact CD2-CD 3.8Å; Y149-K219 HydrophobicContact CE2-CD 4.03Å; Y149-K219 HydrophobicContact CG-CD 4.39Å; Y149-K219 PolarHBondContact OH-NZ 3.48Å
150F95.2Very high95.3Very high1 Ų161.7 Ų61.70%0.00431%0.307CS..Hα-helixtrans-59-48.7179.4176-113000112L127 T130 I134 A146 G147 I148 T154 W216 L232L127-F150 HydrophobicContact CD2-CD1 4.25Å; L127-F150 HydrophobicContact CD2-CE1 3.44Å; L127-F150 VanDerWaalsContact CD2-CE1 3.44Å; L127-F150 HydrophobicContact CD2-CE2 4.25Å; L127-F150 HydrophobicContact CD2-CZ 3.45Å; L127-F150 VanDerWaalsContact CD2-CZ 3.45Å; T130-F150 VanDerWaalsContact OG1-CE1 3.32Å; T130-F150 WeakPolarHBondContact OG1-CE1 3.38Å; I134-F150 HydrophobicContact CD1-CD1 4.28Å; A146-F150 WeakPolarHBondContact O-CB 3.27Å; A146-F150 PolarHBondContact O-N 3.29Å; G147-F150 PolarHBondContact O-N 3.39Å; I148-F150 PolarHBondContact O-N 3.25Å; F150-T154 WeakPolarHBondContact O-CG2 3.3Å; F150-T154 PolarHBondContact O-N 3.41Å; F150-T154 PolarHBondContact O-OG1 2.94Å; F150-W216 HydrophobicContact CD2-CD2 4.37Å; F150-W216 AromaticContact CD2-CE3 3.53Å; F150-W216 HydrophobicContact CD2-CE3 3.53Å; F150-W216 HydrophobicContact CD2-CH2 4.29Å; F150-W216 AromaticContact CD2-CZ3 3.48Å; F150-W216 HydrophobicContact CD2-CZ3 3.48Å; F150-W216 VanDerWaalsContact CD2-CZ3 3.48Å; F150-W216 HydrophobicContact CE2-CE3 4.22Å; F150-W216 HydrophobicContact CE2-CH2 4.17Å; F150-W216 AromaticContact CE2-CZ3 3.69Å; F150-W216 HydrophobicContact CE2-CZ3 3.69Å; F150-L232 HydrophobicContact CE2-CD2 3.97Å; F150-L232 HydrophobicContact CZ-CD2 4.17Å
151L96.2Very high95.4Very high44 Ų4457.8 Ų57.823%0.2329%0.289CS..Hα-helixtrans-63.4-54-178.7-178.583.8000112.2L131 G147 I148 Y149 T154 L155L131-L151 HydrophobicContact CD1-CB 4.46Å; L131-L151 HydrophobicContact CD2-CD1 4.21Å; G147-L151 WeakPolarHBondContact O-CB 3.47Å; G147-L151 PolarHBondContact O-N 2.87Å; I148-L151 PolarHBondContact O-N 3.47Å; Y149-L151 PolarHBondContact O-N 3.2Å; L151-T154 PolarHBondContact O-N 3.43Å; L151-T154 PolarHBondContact O-OG1 2.8Å; L151-L155 HydrophobicContact CD1-CD1 4Å; L151-L155 HydrophobicContact CD1-CG 4.49Å; L151-L155 HydrophobicContact CD2-CD1 4.13Å; L151-L155 HydrophobicContact CG-CD1 3.73Å; L151-L155 HydrophobicContact CG-CG 4.39Å; L151-L155 WeakPolarHBondContact O-CG 3.19Å; L151-L155 PolarHBondContact O-N 3.14Å
152F96.8Very high95.8Very high108 Ų10854.5 Ų54.547%0.47427%0.267SS..Hα-helixtrans-72.7-34.4-170.6-78.2-69.1000112.6I148 T154 L155 I156I148-F152 HydrophobicContact CG2-CD2 3.61Å; I148-F152 HydrophobicContact CG2-CE2 3.86Å; I148-F152 VanDerWaalsContact O-CD2 3.31Å; I148-F152 WeakPolarHBondContact O-CD2 3.44Å; I148-F152 PolarHBondContact O-N 2.99Å; F152-T154 VanDerWaalsContact C-N 3.29Å; F152-T154 PolarHBondContact O-N 3.29Å; F152-L155 PolarHBondContact O-N 3.35Å; F152-I156 WeakPolarHBondContact O-CB 3.41Å; F152-I156 WeakPolarHBondContact O-CD1 3.45Å; F152-I156 WeakPolarHBondContact O-CG1 3.33Å; F152-I156 PolarHBondContact O-N 3.17Å
153Y95.6Very high96Very high59 Ų5954.4 Ų54.423%0.23127%0.269CS..Hα-helixtrans-58.9-47.2173.3-86.2-120.2000110Y149 G157 I206 V213 W216Y149-Y153 HydrophobicContact CD1-CD2 4.29Å; Y149-Y153 AromaticContact CD1-CE2 3.65Å; Y149-Y153 HydrophobicContact CD1-CE2 3.65Å; Y149-Y153 HydrophobicContact CE1-CE2 4.31Å; Y149-Y153 VanDerWaalsContact O-CB 3.28Å; Y149-Y153 WeakPolarHBondContact O-CB 3.48Å; Y149-Y153 WeakPolarHBondContact O-CD2 3.22Å; Y149-Y153 PolarHBondContact O-N 3.43Å; Y149-Y153 VanDerWaalsContact O-N 3.14Å; Y153-G157 PolarHBondContact O-N 2.94Å; Y153-I206 HydrophobicContact CD1-CG2 4.31Å; Y153-I206 WeakPolarHBondContact O-CD1 3.41Å; Y153-I206 WeakPolarHBondContact O-CG2 3.34Å; Y153-V213 HydrophobicContact CD1-CG1 3.51Å; Y153-V213 HydrophobicContact CE1-CG1 3.66Å; Y153-V213 WeakPolarHBondContact CE1-O 3.4Å; Y153-W216 HydrophobicContact CD1-CB 4.34Å; Y153-W216 AromaticContact CD1-CD1 3.53Å; Y153-W216 HydrophobicContact CD1-CG 4.27Å; Y153-W216 HydrophobicContact CG-CB 4.25Å; Y153-W216 AromaticContact CG-CD1 3.99Å; Y153-W216 HydrophobicContact CG-CG 4.4Å
154T95.3Very high96Very high3 Ų351.1 Ų51.12%0.01826%0.257CS..Hα-helixtrans-68.2-42.5-178.6540000112.5L127 F150 L151 F152 G157 S158 K207L127-T154 VanDerWaalsContact CD1-OG1 3.23Å; L127-T154 WeakPolarHBondContact CD1-OG1 3.28Å; L127-T154 HydrophobicContact CD2-CG2 4.02Å; L127-T154 WeakPolarHBondContact CD2-OG1 3.35Å; F150-T154 WeakPolarHBondContact O-CG2 3.3Å; F150-T154 PolarHBondContact O-N 3.41Å; F150-T154 PolarHBondContact O-OG1 2.94Å; L151-T154 PolarHBondContact O-N 3.43Å; L151-T154 PolarHBondContact O-OG1 2.8Å; F152-T154 VanDerWaalsContact C-N 3.29Å; F152-T154 PolarHBondContact O-N 3.29Å; T154-G157 PolarHBondContact O-N 3.41Å; T154-S158 WeakPolarHBondContact O-CB 3.5Å; T154-S158 PolarHBondContact O-N 2.97Å; T154-S158 PolarHBondContact O-OG 3.37Å; T154-K207 HydrophobicContact CG2-CD 3.69Å; T154-K207 VanDerWaalsContact CG2-CE 3.44Å; T154-K207 HydrophobicContact CG2-CG 4.38Å
155L95.8Very high96.1Very high55 Ų5546.3 Ų46.329%0.28823%0.232SC..Hα-helixtrans-65.4-41.2-179.9-74175.3000112.7L151 F152 G157 S158 I159L151-L155 HydrophobicContact CD1-CD1 4Å; L151-L155 HydrophobicContact CD1-CG 4.49Å; L151-L155 HydrophobicContact CD2-CD1 4.13Å; L151-L155 HydrophobicContact CG-CD1 3.73Å; L151-L155 HydrophobicContact CG-CG 4.39Å; L151-L155 WeakPolarHBondContact O-CG 3.19Å; L151-L155 PolarHBondContact O-N 3.14Å; F152-L155 PolarHBondContact O-N 3.35Å; L155-G157 VanDerWaalsContact C-N 3.27Å; L155-G157 PolarHBondContact O-N 3.43Å; L155-S158 WeakPolarHBondContact CA-OG 3.28Å; L155-S158 PolarHBondContact O-N 3.34Å; L155-S158 PolarHBondContact O-OG 3.09Å; L155-I159 WeakPolarHBondContact O-CD1 3.4Å; L155-I159 VanDerWaalsContact O-CG1 3.28Å; L155-I159 WeakPolarHBondContact O-CG1 3.49Å; L155-I159 PolarHBondContact O-N 3.36Å
156I96.1Very high96.1Very high115 Ų11545.5 Ų45.559%0.5923%0.227SC*.Hα-helixtrans-63.2-37.2179.3-69.6166.1000110.8F152 P160F152-I156 WeakPolarHBondContact O-CB 3.41Å; F152-I156 WeakPolarHBondContact O-CD1 3.45Å; F152-I156 WeakPolarHBondContact O-CG1 3.33Å; F152-I156 PolarHBondContact O-N 3.17Å; I156-P160 WeakPolarHBondContact O-CD 3.17Å; I156-P160 WeakPolarHBondContact O-CG 3.46Å
157G94.4Very high96.1Very high3 Ų347.1 Ų47.13%0.03124%0.238CC..Hα-helixtrans-75.3-36.8174.800000113.5Y153 T154 L155 P160 A203Y153-G157 PolarHBondContact O-N 2.94Å; T154-G157 PolarHBondContact O-N 3.41Å; L155-G157 VanDerWaalsContact C-N 3.27Å; L155-G157 PolarHBondContact O-N 3.43Å; G157-P160 WeakPolarHBondContact O-CD 3.2Å; G157-A203 WeakPolarHBondContact O-CB 3.38Å
158S95.4Very high96Very high0 Ų047.4 Ų47.40%024%0.239CC..Hα-helixtrans-81.5-29.1-170.374.70000114Y120 E124 T154 L155 L161 L162Y120-S158 WeakPolarHBondContact CE2-O 3.47Å; Y120-S158 PolarHBondContact OH-O 2.94Å; E124-S158 WeakPolarHBondContact OE1-CB 3.4Å; E124-S158 PolarHBondContact OE1-OG 3.31Å; E124-S158 VanDerWaalsContact OE1-OG 3.13Å; E124-S158 PolarHBondContact OE2-OG 3.06Å; T154-S158 WeakPolarHBondContact O-CB 3.5Å; T154-S158 PolarHBondContact O-N 2.97Å; T154-S158 PolarHBondContact O-OG 3.37Å; L155-S158 WeakPolarHBondContact CA-OG 3.28Å; L155-S158 PolarHBondContact O-N 3.34Å; L155-S158 PolarHBondContact O-OG 3.09Å; S158-L161 WeakPolarHBondContact O-CB 3.1Å; S158-L161 PolarHBondContact O-N 2.85Å; S158-L162 PolarHBondContact O-N 3.11Å
159I96.1Very high95.9Very high90 Ų9046.2 Ų46.246%0.46223%0.232SC..Hα-helixtrans-62.8-46.1177.2-66.1162.2000111.8L155 L161 L162 I163L155-I159 WeakPolarHBondContact O-CD1 3.4Å; L155-I159 VanDerWaalsContact O-CG1 3.28Å; L155-I159 WeakPolarHBondContact O-CG1 3.49Å; L155-I159 PolarHBondContact O-N 3.36Å; I159-L161 VanDerWaalsContact C-N 3.29Å; I159-L161 PolarHBondContact O-N 2.91Å; I159-L162 WeakPolarHBondContact O-CB 3.18Å; I159-L162 PolarHBondContact O-N 2.58Å; I159-L162 VanDerWaalsContact O-N 3.16Å; I159-I163 HydrophobicContact CG2-CD1 4.4Å; I159-I163 PolarHBondContact O-N 3.36Å
160P97.3Very high95.9Very high47 Ų4747.9 Ų47.931%0.30525%0.247SC..Hα-helixtrans-56.6-39.9171.2-27.434.8000113.6I156 G157 L162 I163 A164 A199I156-P160 WeakPolarHBondContact O-CD 3.17Å; I156-P160 WeakPolarHBondContact O-CG 3.46Å; G157-P160 WeakPolarHBondContact O-CD 3.2Å; P160-L162 VanDerWaalsContact C-N 3.32Å; P160-L162 PolarHBondContact O-N 3.16Å; P160-I163 PolarHBondContact O-N 2.81Å; P160-A164 WeakPolarHBondContact O-CB 3.37Å; P160-A164 PolarHBondContact O-N 3.01Å; P160-A199 HydrophobicContact CB-CB 3.97Å
161L97Very high95.7Very high1 Ų155.4 Ų55.41%0.00528%0.281CS..Hα-helixtrans-60.7-41.2176.1172.567.1000111.4Y120 S158 I159 I163 A164 L165 A199 A203 F204 I247Y120-L161 HydrophobicContact CD2-CD2 3.81Å; Y120-L161 HydrophobicContact CD2-CG 4.11Å; Y120-L161 HydrophobicContact CE2-CD2 4.25Å; Y120-L161 HydrophobicContact CE2-CG 4.42Å; S158-L161 WeakPolarHBondContact O-CB 3.1Å; S158-L161 PolarHBondContact O-N 2.85Å; I159-L161 VanDerWaalsContact C-N 3.29Å; I159-L161 PolarHBondContact O-N 2.91Å; L161-I163 PolarHBondContact O-N 3.45Å; L161-A164 PolarHBondContact O-N 3.06Å; L161-L165 HydrophobicContact CD1-CD1 4.13Å; L161-L165 HydrophobicContact CD1-CD2 4.47Å; L161-L165 HydrophobicContact CD1-CG 4.01Å; L161-L165 HydrophobicContact CG-CD1 4.08Å; L161-L165 HydrophobicContact CG-CG 4.35Å; L161-L165 WeakPolarHBondContact O-CG 3.48Å; L161-L165 PolarHBondContact O-N 3.23Å; L161-A199 WeakPolarHBondContact CA-O 3.28Å; L161-A199 PolarHBondContact N-O 3.35Å; L161-A203 HydrophobicContact CB-CB 3.8Å; L161-A203 HydrophobicContact CD2-CB 3.61Å; L161-A203 HydrophobicContact CG-CB 4.29Å; L161-F204 HydrophobicContact CD1-CE2 4.16Å; L161-F204 HydrophobicContact CD1-CZ 4.28Å; L161-F204 HydrophobicContact CD2-CE1 4.05Å; L161-F204 HydrophobicContact CD2-CE2 4.07Å; L161-F204 HydrophobicContact CD2-CZ 3.54Å; L161-I247 HydrophobicContact CD1-CD1 4.06Å
162L97.7Very high95.4Very high54 Ų5455.9 Ų55.928%0.28328%0.283SS..Hα-helixtrans-59.7-46.8176.4178.459.6000111.8I117 Y120 S158 I159 P160 A164 L165 I166I117-L162 HydrophobicContact CD1-CD1 3.56Å; Y120-L162 HydrophobicContact CD1-CD1 3.83Å; Y120-L162 HydrophobicContact CE1-CB 3.9Å; Y120-L162 HydrophobicContact CE1-CD1 3.71Å; Y120-L162 HydrophobicContact CE1-CD2 4.05Å; Y120-L162 HydrophobicContact CE1-CG 4.09Å; Y120-L162 HydrophobicContact CE2-CB 4.09Å; S158-L162 PolarHBondContact O-N 3.11Å; I159-L162 WeakPolarHBondContact O-CB 3.18Å; I159-L162 PolarHBondContact O-N 2.58Å; I159-L162 VanDerWaalsContact O-N 3.16Å; P160-L162 VanDerWaalsContact C-N 3.32Å; P160-L162 PolarHBondContact O-N 3.16Å; L162-A164 VanDerWaalsContact C-N 3.3Å; L162-A164 PolarHBondContact O-N 2.99Å; L162-L165 PolarHBondContact O-N 3.5Å; L162-I166 HydrophobicContact CD1-CD1 3.87Å; L162-I166 HydrophobicContact CD1-CG1 4.27Å; L162-I166 HydrophobicContact CG-CD1 3.93Å; L162-I166 WeakPolarHBondContact O-CG1 3.02Å; L162-I166 PolarHBondContact O-N 3.2Å
163I97.4Very high95.1Very high113 Ų11352.9 Ų52.958%0.57928%0.283SS*.Hα-helixtrans-61.5-43.2179.3-62.1167.8000110I159 P160 L161 I166 S167I159-I163 HydrophobicContact CG2-CD1 4.4Å; I159-I163 PolarHBondContact O-N 3.36Å; P160-I163 PolarHBondContact O-N 2.81Å; L161-I163 PolarHBondContact O-N 3.45Å; I163-I166 PolarHBondContact O-N 2.94Å; I163-S167 PolarHBondContact O-N 3.32Å
164A96.5Very high94.9Very high4 Ų452.1 Ų52.13%0.03328%0.284CS..Hα-helixtrans-64-42.1176.800000112.8P160 L161 L162 I166 S167 I168 L196 A199P160-A164 WeakPolarHBondContact O-CB 3.37Å; P160-A164 PolarHBondContact O-N 3.01Å; L161-A164 PolarHBondContact O-N 3.06Å; L162-A164 VanDerWaalsContact C-N 3.3Å; L162-A164 PolarHBondContact O-N 2.99Å; A164-I166 PolarHBondContact O-N 3.47Å; A164-S167 PolarHBondContact O-N 3.48Å; A164-S167 PolarHBondContact O-OG 3.03Å; A164-I168 WeakPolarHBondContact O-CD1 3.34Å; A164-I168 WeakPolarHBondContact O-CG1 3.42Å; A164-I168 PolarHBondContact O-N 3.29Å; A164-L196 HydrophobicContact CB-CD1 3.67Å; A164-A199 HydrophobicContact CB-CB 3.92Å
165L96.6Very high94.8Very high1 Ų152 Ų521%0.00528%0.284CS..Hα-helixtrans-65.1-40.4177.1-71176.3000111.6L116 Y120 L161 L162 I168 Q169 L175 I247L116-L165 HydrophobicContact CB-CD2 3.9Å; L116-L165 HydrophobicContact CD1-CD2 4.07Å; Y120-L165 HydrophobicContact CD2-CD1 4.46Å; Y120-L165 HydrophobicContact CG-CD1 4.35Å; L161-L165 HydrophobicContact CD1-CD1 4.13Å; L161-L165 HydrophobicContact CD1-CD2 4.47Å; L161-L165 HydrophobicContact CD1-CG 4.01Å; L161-L165 HydrophobicContact CG-CD1 4.08Å; L161-L165 HydrophobicContact CG-CG 4.35Å; L161-L165 WeakPolarHBondContact O-CG 3.48Å; L161-L165 PolarHBondContact O-N 3.23Å; L162-L165 PolarHBondContact O-N 3.5Å; L165-I168 PolarHBondContact O-N 2.74Å; L165-Q169 WeakPolarHBondContact O-CB 3.16Å; L165-Q169 PolarHBondContact O-N 3.18Å; L165-L175 HydrophobicContact CB-CD1 4.19Å; L165-L175 HydrophobicContact CD2-CD2 4.22Å; L165-L175 WeakPolarHBondContact O-CD1 3.33Å; L165-I247 HydrophobicContact CD2-CD1 4.48Å
166I96.9Very high94.7Very high79 Ų7950.6 Ų50.641%0.40528%0.276SS..Hα-helixtrans-65.5-40.2176.4-65.7165.9000111L162 I163 A164 Q169 N170L162-I166 HydrophobicContact CD1-CD1 3.87Å; L162-I166 HydrophobicContact CD1-CG1 4.27Å; L162-I166 HydrophobicContact CG-CD1 3.93Å; L162-I166 WeakPolarHBondContact O-CG1 3.02Å; L162-I166 PolarHBondContact O-N 3.2Å; I163-I166 PolarHBondContact O-N 2.94Å; A164-I166 PolarHBondContact O-N 3.47Å; I166-Q169 WeakPolarHBondContact O-CB 3.43Å; I166-Q169 PolarHBondContact O-N 2.94Å; I166-N170 VanDerWaalsContact O-CG 3.29Å; I166-N170 PolarHBondContact O-N 3Å; I166-N170 PolarHBondContact O-ND2 3.4Å
167S95.1Very high94.4Very high35 Ų3545.5 Ų45.525%0.24525%0.25CS..Hα-helixtrans-64.6-43.317669.80000111.4I163 A164 Q169 N170 H171I163-S167 PolarHBondContact O-N 3.32Å; A164-S167 PolarHBondContact O-N 3.48Å; A164-S167 PolarHBondContact O-OG 3.03Å; S167-Q169 VanDerWaalsContact C-N 3.32Å; S167-Q169 PolarHBondContact O-N 3.32Å; S167-N170 PolarHBondContact O-N 3.29Å; S167-H171 PolarHBondContact O-CD2 2.86Å; S167-H171 PolarHBondContact O-N 3.48Å
168I93.4Very high94Very high8 Ų847.2 Ų47.24%0.04126%0.258CS..Hα-helixtrans-60.9-42.3175.1-65.8161.2000110.7A164 L165 N170 H171 M172 L175 L196 I250A164-I168 WeakPolarHBondContact O-CD1 3.34Å; A164-I168 WeakPolarHBondContact O-CG1 3.42Å; A164-I168 PolarHBondContact O-N 3.29Å; L165-I168 PolarHBondContact O-N 2.74Å; I168-N170 VanDerWaalsContact C-N 3.31Å; I168-N170 PolarHBondContact O-N 2.73Å; I168-H171 PolarHBondContact O-N 2.91Å; I168-M172 HydrophobicContact CG2-CG 3.93Å; I168-M172 WeakPolarHBondContact O-CB 3.37Å; I168-M172 WeakPolarHBondContact O-CG 3.13Å; I168-M172 PolarHBondContact O-N 3.37Å; I168-L175 HydrophobicContact CB-CD2 4.1Å; I168-L175 HydrophobicContact CG2-CD2 3.71Å; I168-L196 HydrophobicContact CD1-CD1 4.44Å; I168-L196 HydrophobicContact CG1-CD1 4.39Å; I168-L196 HydrophobicContact CG1-CD2 4.44Å; I168-I250 HydrophobicContact CD1-CG2 4.23Å
169Q94.6Very high93.7Very high62 Ų6250.3 Ų50.329%0.2927%0.274SS..Hα-helixtrans-58.6-42.6175.7178.558.429.500111.7L165 I166 S167 G173 T174 L175L165-Q169 WeakPolarHBondContact O-CB 3.16Å; L165-Q169 PolarHBondContact O-N 3.18Å; I166-Q169 WeakPolarHBondContact O-CB 3.43Å; I166-Q169 PolarHBondContact O-N 2.94Å; S167-Q169 VanDerWaalsContact C-N 3.32Å; S167-Q169 PolarHBondContact O-N 3.32Å; Q169-G173 PolarHBondContact NE2-O 3.15Å; Q169-G173 CarbonylContact O-C 3.48Å; Q169-G173 WeakPolarHBondContact O-CA 3.46Å; Q169-G173 PolarHBondContact O-N 3Å; Q169-T174 VanDerWaalsContact OE1-CA 3.25Å; Q169-L175 HydrophobicContact CB-CD1 3.82Å; Q169-L175 HydrophobicContact CB-CG 3.84Å; Q169-L175 HydrophobicContact CG-CD1 4.45Å; Q169-L175 HydrophobicContact CG-CG 4.48Å
170N94.8Very high93.2Very high123 Ų12346.2 Ų46.266%0.65825%0.253SS*.Hα-helixtrans-69.7-32.9179.2-68.1-18000112.6I166 S167 I168I166-N170 VanDerWaalsContact O-CG 3.29Å; I166-N170 PolarHBondContact O-N 3Å; I166-N170 PolarHBondContact O-ND2 3.4Å; S167-N170 PolarHBondContact O-N 3.29Å; I168-N170 VanDerWaalsContact C-N 3.31Å; I168-N170 PolarHBondContact O-N 2.73Å
171H90.6Very high92.6Very high159 Ų15946.2 Ų46.274%0.73625%0.254SS*.Hα-helixtrans-81-45.4179.5-71.2-57.8000113.2S167 I168S167-H171 PolarHBondContact O-CD2 2.86Å; S167-H171 PolarHBondContact O-N 3.48Å; I168-H171 PolarHBondContact O-N 2.91Å
172M89.4Confident91.9Very high55 Ų5554.5 Ų54.527%0.27129%0.29SS..Hα-helixtrans-90.3-14.5-175.7-56.7-59.5-71.400112.9I168 T174 T183I168-M172 HydrophobicContact CG2-CG 3.93Å; I168-M172 WeakPolarHBondContact O-CB 3.37Å; I168-M172 WeakPolarHBondContact O-CG 3.13Å; I168-M172 PolarHBondContact O-N 3.37Å; M172-T174 PolarHBondContact O-N 3.02Å; M172-T174 VanDerWaalsContact O-N 3.1Å; M172-T183 WeakPolarHBondContact CE-O 3.4Å
173G91.1Very high91.1Very high45 Ų4554.6 Ų54.646%0.46429%0.293SS..SBendtrans75.2-17.7-174.500000114.8Q169Q169-G173 PolarHBondContact NE2-O 3.15Å; Q169-G173 CarbonylContact O-C 3.48Å; Q169-G173 WeakPolarHBondContact O-CA 3.46Å; Q169-G173 PolarHBondContact O-N 3Å
174T92.1Very high90.2Very high42 Ų4251.9 Ų51.926%0.25828%0.282SS..  trans-145.4149.8178.965.60000112.6Q169 M172 I179Q169-T174 VanDerWaalsContact OE1-CA 3.25Å; M172-T174 PolarHBondContact O-N 3.02Å; M172-T174 VanDerWaalsContact O-N 3.1Å; T174-I179 HydrophobicContact CG2-CD1 4.34Å
175L93.3Very high89.4Confident2 Ų258.4 Ų58.41%0.0131%0.311CS..  trans-115.512.4174.6-80.8178.2000112.6L116 I117 L165 I168 Q169 L177L116-L175 HydrophobicContact CB-CB 4.22Å; L116-L175 HydrophobicContact CB-CD2 4.3Å; L116-L175 HydrophobicContact CD1-CD2 4.21Å; L116-L175 PolarHBondContact N-O 3.39Å; I117-L175 HydrophobicContact CB-CD1 3.97Å; L165-L175 HydrophobicContact CB-CD1 4.19Å; L165-L175 HydrophobicContact CD2-CD2 4.22Å; L165-L175 WeakPolarHBondContact O-CD1 3.33Å; I168-L175 HydrophobicContact CB-CD2 4.1Å; I168-L175 HydrophobicContact CG2-CD2 3.71Å; Q169-L175 HydrophobicContact CB-CD1 3.82Å; Q169-L175 HydrophobicContact CB-CG 3.84Å; Q169-L175 HydrophobicContact CG-CD1 4.45Å; Q169-L175 HydrophobicContact CG-CG 4.48Å; L175-L177 PolarHBondContact O-N 3.33Å
176N93.1Very high88.7Confident25 Ų2563.4 Ų63.413%0.13434%0.342CS..BIsolated β-bridgetrans-70.7119176.4-176.9-6.9000109.6E115 M178 I179 L180E115-N176 HydrophobicContact CG-CB 4.41Å; N176-M178 PolarHBondContact O-N 3.45Å; N176-M178 PolarHBondContact OD1-N 3.15Å; N176-M178 VanDerWaalsContact OD1-N 3.13Å; N176-I179 HydrophobicContact CB-CB 4.34Å; N176-I179 HydrophobicContact CB-CD1 4.03Å; N176-I179 HydrophobicContact CB-CG1 4.13Å; N176-I179 PolarHBondContact O-N 2.98Å; N176-L180 WeakPolarHBondContact O-CG 3.44Å; N176-L180 PolarHBondContact O-N 3.44Å
177L89.3Confident88.2Confident8 Ų861 Ų614%0.04233%0.33CS..Hα-helixtrans-53.2-30.6-179.5-75.3168.4000113.7T114 L116 L175 S181 R246T114-L177 WeakPolarHBondContact O-CB 3.49Å; T114-L177 VanDerWaalsContact O-CG 3.29Å; T114-L177 WeakPolarHBondContact O-CG 3.32Å; T114-L177 PolarHBondContact O-N 3.44Å; L116-L177 HydrophobicContact CD1-CD2 4.24Å; L116-L177 HydrophobicContact CD2-CD1 4.42Å; L116-L177 HydrophobicContact CD2-CD2 3.77Å; L116-L177 HydrophobicContact CD2-CG 4.18Å; L116-L177 HydrophobicContact CG-CD2 3.93Å; L116-L177 HydrophobicContact CG-CG 4.17Å; L175-L177 PolarHBondContact O-N 3.33Å; L177-S181 PolarHBondContact O-N 2.91Å; L177-R246 HydrophobicContact CD1-CG 4.16Å; L177-R246 HydrophobicContact CD2-CB 4.03Å; L177-R246 HydrophobicContact CD2-CG 4.44Å
178M86Confident87.8Confident38 Ų3865 Ų6519%0.18735%0.348CS..Hα-helixtrans-75.1-34.9179.2-62.4-58.2-77.200112.7K50 N52 N176 S181 F182K50-M178 HydrophobicContact CB-CE 3.83Å; K50-M178 HydrophobicContact CB-SD 4.34Å; K50-M178 HydrophobicContact CD-CE 3.61Å; K50-M178 HydrophobicContact CD-SD 3.31Å; K50-M178 WeakPolarHBondContact CD-SD 3.44Å; K50-M178 HydrophobicContact CG-CE 4.29Å; K50-M178 HydrophobicContact CG-SD 4.46Å; N52-M178 VanDerWaalsContact ND2-CE 3.25Å; N52-M178 WeakPolarHBondContact ND2-CE 2.87Å; N52-M178 WeakPolarHBondContact OD1-CE 3.27Å; N176-M178 PolarHBondContact O-N 3.45Å; N176-M178 PolarHBondContact OD1-N 3.15Å; N176-M178 VanDerWaalsContact OD1-N 3.13Å; M178-S181 PolarHBondContact O-OG 2.99Å; M178-F182 WeakPolarHBondContact O-CD2 3.35Å; M178-F182 WeakPolarHBondContact O-CE2 3.09Å
179I88.6Confident87.4Confident66 Ų6670 Ų7034%0.33838%0.384SS..Hα-helixtrans-78.4-42.6178.3-61.3176.1000108.9T174 N176 S181 F182 T183T174-I179 HydrophobicContact CG2-CD1 4.34Å; N176-I179 HydrophobicContact CB-CB 4.34Å; N176-I179 HydrophobicContact CB-CD1 4.03Å; N176-I179 HydrophobicContact CB-CG1 4.13Å; N176-I179 PolarHBondContact O-N 2.98Å; I179-S181 PolarHBondContact O-N 3.46Å; I179-F182 PolarHBondContact O-N 3.19Å; I179-T183 HydrophobicContact CG2-CG2 3.81Å; I179-T183 PolarHBondContact O-N 3.21Å; I179-T183 PolarHBondContact O-OG1 3.02Å
180L87.6Confident87.4Confident4 Ų469 Ų692%0.02138%0.384CS..Hα-helixtrans-53-40.8178.7-75.4167.3000112L116 N176 F182 T183 T184 I250L116-L180 HydrophobicContact CD1-CD1 3.78Å; N176-L180 WeakPolarHBondContact O-CG 3.44Å; N176-L180 PolarHBondContact O-N 3.44Å; L180-F182 PolarHBondContact O-N 3.48Å; L180-T183 PolarHBondContact O-N 2.73Å; L180-T184 WeakPolarHBondContact O-CG2 3.5Å; L180-T184 PolarHBondContact O-N 3.36Å; L180-I250 HydrophobicContact CD1-CD1 3.98Å; L180-I250 HydrophobicContact CD1-CG1 4.4Å; L180-I250 HydrophobicContact CD2-CG1 4.39Å
181S82.9Confident87.3Confident46 Ų4673.4 Ų73.432%0.32239%0.391SS..Hα-helixtrans-60.7-19.1177.852.90000115.1L177 M178 I179L177-S181 PolarHBondContact O-N 2.91Å; M178-S181 PolarHBondContact O-OG 2.99Å; I179-S181 PolarHBondContact O-N 3.46Å
182F83.5Confident87.5Confident176 Ų17669.5 Ų69.577%0.77238%0.382SS*.Hα-helixtrans-101.3-29176-61.1-68.5000113M178 I179 L180M178-F182 WeakPolarHBondContact O-CD2 3.35Å; M178-F182 WeakPolarHBondContact O-CE2 3.09Å; I179-F182 PolarHBondContact O-N 3.19Å; L180-F182 PolarHBondContact O-N 3.48Å
183T81.3Confident87.7Confident55 Ų5568.5 Ų68.534%0.33738%0.378SS..Hα-helixtrans-101.81.8-171.961.90000113.4M172 I179 L180 H185M172-T183 WeakPolarHBondContact CE-O 3.4Å; I179-T183 HydrophobicContact CG2-CG2 3.81Å; I179-T183 PolarHBondContact O-N 3.21Å; I179-T183 PolarHBondContact O-OG1 3.02Å; L180-T183 PolarHBondContact O-N 2.73Å; T183-H185 PolarHBondContact O-N 2.86Å
184T77.4Confident87.9Confident57 Ų5767.6 Ų67.635%0.3536%0.362SS..PPolyproline II helixtrans-58.2121.7-176.547.20000112.2L180 I249L180-T184 WeakPolarHBondContact O-CG2 3.5Å; L180-T184 PolarHBondContact O-N 3.36Å; T184-I249 HydrophobicContact CG2-CG2 3.74Å
185H79.2Confident88.1Confident140 Ų14071.2 Ų71.265%0.64838%0.379SS*.PPolyproline II helixtrans-88.6141.8166.5-66.3-59.9000109.7T183 L187T183-H185 PolarHBondContact O-N 2.86Å; H185-L187 PolarHBondContact O-N 3.06Å
186T82.9Confident88.1Confident106 Ų10672.6 Ų72.665%0.6539%0.387SS*.PPolyproline II helixtrans-66.3130.8173.849.40000109.9
187L85.6Confident88.3Confident30 Ų3071.4 Ų71.416%0.15738%0.38CS..PPolyproline II helixtrans-83.4124.1175.2-64174.9000111H185 I250 L251 D252 L254H185-L187 PolarHBondContact O-N 3.06Å; L187-I250 VanDerWaalsContact CD1-O 3.25Å; L187-I250 WeakPolarHBondContact CD1-O 3.39Å; L187-L251 HydrophobicContact CD1-CD2 4.18Å; L187-D252 PolarHBondContact N-O 3.09Å; L187-L254 HydrophobicContact CB-CD1 3.36Å; L187-L254 HydrophobicContact CB-CG 3.93Å; L187-L254 HydrophobicContact CD1-CD1 3.93Å; L187-L254 HydrophobicContact CG-CD1 4.29Å
188D86.6Confident88.6Confident118 Ų11874.2 Ų74.263%0.63140%0.395SS*.PPolyproline II helixtrans-75.7157.6176.6-66-26.6000112.7S190 N193D188-S190 PolarHBondContact O-N 2.85Å; D188-N193 PolarHBondContact N-ND2 2.92Å; D188-N193 WeakPolarHBondContact O-CB 3.3Å; D188-N193 PolarHBondContact O-ND2 3.48Å
189S86.4Confident89.1Confident113 Ų11373.2 Ų73.279%0.7939%0.393SS*.SBendtrans-73.586.9176.661.70000112.1
190S93.7Very high89.5Confident40 Ų4070.1 Ų70.128%0.2838%0.377SS..  trans-130156.7173.370.70000111D188 S192 N193 N194D188-S190 PolarHBondContact O-N 2.85Å; S190-S192 PolarHBondContact O-N 2.83Å; S190-S192 PolarHBondContact OG-OG 3.18Å; S190-N193 PolarHBondContact O-N 3.31Å; S190-N193 VanDerWaalsContact O-N 3.14Å; S190-N193 WeakPolarHBondContact OG-CB 3.37Å; S190-N193 PolarHBondContact OG-N 3.19Å; S190-N193 PolarHBondContact OG-ND2 3.47Å; S190-N194 VanDerWaalsContact O-CG 3.28Å; S190-N194 PolarHBondContact O-N 3.44Å
191W93.8Very high89.8Confident216 Ų21670.1 Ų70.182%0.81838%0.377SS*.Hα-helixtrans-59.9-34.5176.6-75.5105000112.7N194 L195W191-N194 PolarHBondContact O-N 2.92Å; W191-L195 WeakPolarHBondContact O-CG 3.1Å; W191-L195 PolarHBondContact O-N 2.96Å
192S94.4Very high90.4Very high78 Ų7870.7 Ų70.755%0.54538%0.375SS..Hα-helixtrans-63.3-44175.159.50000111.3S190 L195 L196S190-S192 PolarHBondContact O-N 2.83Å; S190-S192 PolarHBondContact OG-OG 3.18Å; S192-L195 PolarHBondContact O-N 3.32Å; S192-L196 WeakPolarHBondContact O-CB 3.48Å; S192-L196 PolarHBondContact O-N 3.47Å
193N93.6Very high91Very high34 Ų3462.4 Ų62.418%0.18234%0.339CS..Hα-helixtrans-74.4-31-179-60.6-11000111.6D188 S190 L196 W197 L254D188-N193 PolarHBondContact N-ND2 2.92Å; D188-N193 WeakPolarHBondContact O-CB 3.3Å; D188-N193 PolarHBondContact O-ND2 3.48Å; S190-N193 PolarHBondContact O-N 3.31Å; S190-N193 VanDerWaalsContact O-N 3.14Å; S190-N193 WeakPolarHBondContact OG-CB 3.37Å; S190-N193 PolarHBondContact OG-N 3.19Å; S190-N193 PolarHBondContact OG-ND2 3.47Å; N193-L196 PolarHBondContact O-N 3.03Å; N193-W197 WeakPolarHBondContact O-CB 3.49Å; N193-W197 PolarHBondContact O-N 3.13Å; N193-L254 HydrophobicContact CB-CD1 3.42Å; N193-L254 VanDerWaalsContact CB-CD1 3.42Å
194N94.9Very high91.8Very high26 Ų2659.8 Ų59.814%0.13932%0.323CS..Hα-helixtrans-63.1-41.3170.4-69.3-12.7000111.7S190 W191 W197 L198 M258S190-N194 VanDerWaalsContact O-CG 3.28Å; S190-N194 PolarHBondContact O-N 3.44Å; W191-N194 PolarHBondContact O-N 2.92Å; N194-W197 PolarHBondContact O-N 3.38Å; N194-L198 WeakPolarHBondContact O-CB 3.36Å; N194-L198 PolarHBondContact O-N 3.48Å; N194-M258 HydrophobicContact CB-CE 4Å; N194-M258 HydrophobicContact CB-SD 4.13Å
195L95.5Very high92.6Very high117 Ų11757.1 Ų57.161%0.61331%0.307SS*.Hα-helixtrans-68-40.5174.4-74.2170.8000111.9W191 S192 W197 L198 A199W191-L195 WeakPolarHBondContact O-CG 3.1Å; W191-L195 PolarHBondContact O-N 2.96Å; S192-L195 PolarHBondContact O-N 3.32Å; L195-W197 VanDerWaalsContact C-N 3.35Å; L195-L198 PolarHBondContact O-N 3.15Å; L195-A199 WeakPolarHBondContact O-CB 3.45Å; L195-A199 PolarHBondContact O-N 2.94Å
196L94.9Very high93.5Very high32 Ų3251.2 Ų51.217%0.16828%0.28CS..Hα-helixtrans-59.9-45.9174.2-176.370.4000111A164 I168 S192 N193 L198 A199 C200A164-L196 HydrophobicContact CB-CD1 3.67Å; I168-L196 HydrophobicContact CD1-CD1 4.44Å; I168-L196 HydrophobicContact CG1-CD1 4.39Å; I168-L196 HydrophobicContact CG1-CD2 4.44Å; S192-L196 WeakPolarHBondContact O-CB 3.48Å; S192-L196 PolarHBondContact O-N 3.47Å; N193-L196 PolarHBondContact O-N 3.03Å; L196-L198 VanDerWaalsContact C-N 3.31Å; L196-L198 PolarHBondContact O-N 3.47Å; L196-A199 PolarHBondContact O-N 3.31Å; L196-C200 WeakPolarHBondContact O-CB 3.38Å; L196-C200 PolarHBondContact O-N 3.26Å; L196-C200 PolarHBondContact O-SG 2.95Å; L196-C200 VanDerWaalsContact O-SG 3.38Å
197W95.9Very high94Very high0 Ų046.3 Ų46.30%025%0.249CC..Hα-helixtrans-57.3-46.4176-175.199.2000111.2N193 N194 L195 C200 M201 L251 T255 M258 F262 M303N193-W197 WeakPolarHBondContact O-CB 3.49Å; N193-W197 PolarHBondContact O-N 3.13Å; N194-W197 PolarHBondContact O-N 3.38Å; L195-W197 VanDerWaalsContact C-N 3.35Å; W197-C200 PolarHBondContact O-N 2.83Å; W197-M201 HydrophobicContact CD2-CG 4.05Å; W197-M201 HydrophobicContact CE3-CB 4.45Å; W197-M201 HydrophobicContact CE3-CG 4.29Å; W197-M201 HydrophobicContact CH2-CB 4.26Å; W197-M201 HydrophobicContact CH2-CG 4.09Å; W197-M201 HydrophobicContact CZ2-CG 3.86Å; W197-M201 HydrophobicContact CZ3-CB 4.21Å; W197-M201 HydrophobicContact CZ3-CG 4.28Å; W197-M201 WeakPolarHBondContact O-CB 3.25Å; W197-M201 WeakPolarHBondContact O-CG 3.32Å; W197-M201 PolarHBondContact O-N 3.26Å; W197-L251 HydrophobicContact CB-CD2 4.27Å; W197-L251 HydrophobicContact CG-CD1 4.34Å; W197-L251 HydrophobicContact CG-CD2 4.32Å; W197-T255 VanDerWaalsContact NE1-CG2 3.29Å; W197-M258 HydrophobicContact CD2-CB 3.56Å; W197-M258 HydrophobicContact CD2-CG 4.06Å; W197-M258 HydrophobicContact CE3-CB 3.71Å; W197-M258 HydrophobicContact CE3-CE 3.87Å; W197-M258 HydrophobicContact CE3-CG 4.25Å; W197-M258 HydrophobicContact CG-CB 4.16Å; W197-M258 HydrophobicContact CG-CG 4.21Å; W197-M258 HydrophobicContact CH2-CB 3.98Å; W197-M258 HydrophobicContact CZ2-CB 3.81Å; W197-M258 HydrophobicContact CZ3-CB 3.94Å; W197-M258 HydrophobicContact CZ3-CE 4.42Å; W197-F262 AromaticContact CH2-CD2 3.55Å; W197-F262 HydrophobicContact CH2-CD2 3.55Å; W197-F262 AromaticContact CH2-CE2 3.58Å; W197-F262 HydrophobicContact CH2-CE2 3.58Å; W197-F262 AromaticContact CZ3-CD2 3.87Å; W197-F262 HydrophobicContact CZ3-CD2 3.87Å; W197-F262 AromaticContact CZ3-CE2 3.36Å; W197-F262 HydrophobicContact CZ3-CE2 3.36Å; W197-F262 HydrophobicContact CZ3-CZ 4.12Å; W197-M303 HydrophobicContact CH2-CE 4.13Å; W197-M303 HydrophobicContact CZ2-CE 4.32Å; W197-M303 HydrophobicContact CZ2-SD 4.21Å
198L96Very high94.2Very high66 Ų6644.9 Ų44.935%0.34624%0.242SC..Hα-helixtrans-66.2-42.4179.6-166.5143.6000111.5N194 L195 L196 C200 M201 M202N194-L198 WeakPolarHBondContact O-CB 3.36Å; N194-L198 PolarHBondContact O-N 3.48Å; L195-L198 PolarHBondContact O-N 3.15Å; L196-L198 VanDerWaalsContact C-N 3.31Å; L196-L198 PolarHBondContact O-N 3.47Å; L198-C200 VanDerWaalsContact C-N 3.33Å; L198-C200 PolarHBondContact O-N 3.37Å; L198-M201 PolarHBondContact O-N 2.94Å; L198-M202 HydrophobicContact CD1-CE 3.92Å; L198-M202 HydrophobicContact CD2-CE 3.83Å; L198-M202 HydrophobicContact CD2-CG 3.53Å; L198-M202 HydrophobicContact CG-CE 3.81Å; L198-M202 HydrophobicContact CG-CG 3.84Å; L198-M202 VanDerWaalsContact O-CB 3.29Å; L198-M202 WeakPolarHBondContact O-CB 3.07Å; L198-M202 WeakPolarHBondContact O-CG 3.47Å; L198-M202 PolarHBondContact O-N 2.9Å
199A96.5Very high94.1Very high17 Ų1739.2 Ų39.214%0.1421%0.212CC..Hα-helixtrans-61.3-40.2175.400000112.2P160 L161 A164 L195 L196P160-A199 HydrophobicContact CB-CB 3.97Å; L161-A199 WeakPolarHBondContact CA-O 3.28Å; L161-A199 PolarHBondContact N-O 3.35Å; A164-A199 HydrophobicContact CB-CB 3.92Å; L195-A199 WeakPolarHBondContact O-CB 3.45Å; L195-A199 PolarHBondContact O-N 2.94Å; L196-A199 PolarHBondContact O-N 3.31Å
200C96.1Very high94.5Very high1 Ų134.2 Ų34.21%0.00718%0.176CC..Hα-helixtrans-67.3-40.6175.8-76.50000113L196 W197 L198 F204 I247 L251L196-C200 WeakPolarHBondContact O-CB 3.38Å; L196-C200 PolarHBondContact O-N 3.26Å; L196-C200 PolarHBondContact O-SG 2.95Å; L196-C200 VanDerWaalsContact O-SG 3.38Å; W197-C200 PolarHBondContact O-N 2.83Å; L198-C200 VanDerWaalsContact C-N 3.33Å; L198-C200 PolarHBondContact O-N 3.37Å; C200-F204 VanDerWaalsContact O-CD2 3.27Å; C200-F204 WeakPolarHBondContact O-CD2 3.48Å; C200-F204 WeakPolarHBondContact O-CE2 2.86Å; C200-I247 HydrophobicContact CB-CG2 3.88Å; C200-L251 HydrophobicContact CB-CD1 4.02Å; C200-L251 HydrophobicContact CB-CD2 4.09Å
201M95.8Very high94.5Very high5 Ų534.8 Ų34.83%0.02517%0.173CC..Hα-helixtrans-88.5-31.7-172.2-66.8-58.9-77.700114.1W197 L198 A203 F204 L205 M244 I247 L251 M303W197-M201 HydrophobicContact CD2-CG 4.05Å; W197-M201 HydrophobicContact CE3-CB 4.45Å; W197-M201 HydrophobicContact CE3-CG 4.29Å; W197-M201 HydrophobicContact CH2-CB 4.26Å; W197-M201 HydrophobicContact CH2-CG 4.09Å; W197-M201 HydrophobicContact CZ2-CG 3.86Å; W197-M201 HydrophobicContact CZ3-CB 4.21Å; W197-M201 HydrophobicContact CZ3-CG 4.28Å; W197-M201 WeakPolarHBondContact O-CB 3.25Å; W197-M201 WeakPolarHBondContact O-CG 3.32Å; W197-M201 PolarHBondContact O-N 3.26Å; L198-M201 PolarHBondContact O-N 2.94Å; M201-A203 PolarHBondContact O-N 3.28Å; M201-F204 PolarHBondContact O-N 2.65Å; M201-F204 VanDerWaalsContact O-N 3.14Å; M201-L205 HydrophobicContact CB-CD1 4.17Å; M201-L205 WeakPolarHBondContact O-CG 3.31Å; M201-L205 PolarHBondContact O-N 3.01Å; M201-M244 HydrophobicContact CE-CB 4.19Å; M201-M244 HydrophobicContact CE-CE 3.59Å; M201-M244 HydrophobicContact CE-CG 3.86Å; M201-M244 HydrophobicContact CE-SD 4.48Å; M201-I247 HydrophobicContact SD-CG2 4.34Å; M201-L251 HydrophobicContact CG-CD1 3.61Å; M201-L251 HydrophobicContact SD-CD1 3.53Å; M201-L251 VanDerWaalsContact SD-CD1 3.53Å; M201-M303 HydrophobicContact CE-CE 3.4Å; M201-M303 HydrophobicContact CE-SD 3.7Å
202M95.4Very high94.5Very high57 Ų5726.8 Ų26.828%0.28116%0.157SC..Hα-helixtrans-60.2-42.1-172.4-80.2-61.6-166.100113.2L198 F204 L205 I206 F262L198-M202 HydrophobicContact CD1-CE 3.92Å; L198-M202 HydrophobicContact CD2-CE 3.83Å; L198-M202 HydrophobicContact CD2-CG 3.53Å; L198-M202 HydrophobicContact CG-CE 3.81Å; L198-M202 HydrophobicContact CG-CG 3.84Å; L198-M202 VanDerWaalsContact O-CB 3.29Å; L198-M202 WeakPolarHBondContact O-CB 3.07Å; L198-M202 WeakPolarHBondContact O-CG 3.47Å; L198-M202 PolarHBondContact O-N 2.9Å; M202-F204 PolarHBondContact O-N 3.46Å; M202-L205 PolarHBondContact O-N 2.79Å; M202-L205 HydrophobicContact SD-CD1 4.44Å; M202-I206 VanDerWaalsContact O-CG1 3.28Å; M202-I206 WeakPolarHBondContact O-CG1 3.22Å; M202-I206 PolarHBondContact O-N 3.24Å; M202-F262 HydrophobicContact CE-CE1 4.14Å; M202-F262 HydrophobicContact CE-CZ 3.98Å; M202-F262 HydrophobicContact SD-CE1 4.4Å
203A95.8Very high94.5Very high2 Ų225.2 Ų25.22%0.01714%0.144CC..Hα-helixtrans-53.1-44.2177.200000112.4G157 L161 M201 I206 K207G157-A203 WeakPolarHBondContact O-CB 3.38Å; L161-A203 HydrophobicContact CB-CB 3.8Å; L161-A203 HydrophobicContact CD2-CB 3.61Å; L161-A203 HydrophobicContact CG-CB 4.29Å; M201-A203 PolarHBondContact O-N 3.28Å; A203-I206 PolarHBondContact O-N 2.65Å; A203-K207 PolarHBondContact O-N 2.93Å
204F96.6Very high94.6Very high0 Ų024.1 Ų24.10%014%0.138CC..Hα-helixtrans-77.6-34.5-179.1-53.6-56.3000112.8F119 F123 L161 C200 M201 M202 I206 K207 M208 G240 M244 I247F119-F204 AromaticContact CE1-CE1 3.69Å; F119-F204 HydrophobicContact CE1-CE1 3.69Å; F119-F204 AromaticContact CE1-CZ 3.84Å; F119-F204 HydrophobicContact CE1-CZ 3.84Å; F119-F204 HydrophobicContact CZ-CE1 4.04Å; F123-F204 HydrophobicContact CE2-CD1 4.25Å; F123-F204 HydrophobicContact CE2-CE1 4.26Å; F123-F204 HydrophobicContact CZ-CD1 4.2Å; F123-F204 HydrophobicContact CZ-CE1 4.23Å; L161-F204 HydrophobicContact CD1-CE2 4.16Å; L161-F204 HydrophobicContact CD1-CZ 4.28Å; L161-F204 HydrophobicContact CD2-CE1 4.05Å; L161-F204 HydrophobicContact CD2-CE2 4.07Å; L161-F204 HydrophobicContact CD2-CZ 3.54Å; C200-F204 VanDerWaalsContact O-CD2 3.27Å; C200-F204 WeakPolarHBondContact O-CD2 3.48Å; C200-F204 WeakPolarHBondContact O-CE2 2.86Å; M201-F204 PolarHBondContact O-N 2.65Å; M201-F204 VanDerWaalsContact O-N 3.14Å; M202-F204 PolarHBondContact O-N 3.46Å; F204-I206 PolarHBondContact O-N 3.36Å; F204-K207 PolarHBondContact O-N 2.78Å; F204-M208 VanDerWaalsContact O-CB 3.32Å; F204-M208 WeakPolarHBondContact O-CB 3.28Å; F204-M208 PolarHBondContact O-N 3.02Å; F204-G240 WeakPolarHBondContact CB-O 3.16Å; F204-M244 HydrophobicContact CB-CG 3.44Å; F204-M244 VanDerWaalsContact CB-CG 3.44Å; F204-M244 HydrophobicContact CB-SD 4.18Å; F204-M244 HydrophobicContact CD2-CG 4.17Å; F204-M244 HydrophobicContact CG-CG 4.04Å; F204-I247 HydrophobicContact CE2-CB 4.42Å; F204-I247 HydrophobicContact CE2-CD1 3.31Å; F204-I247 HydrophobicContact CE2-CG1 4.43Å; F204-I247 HydrophobicContact CZ-CD1 3.46Å; F204-I247 VanDerWaalsContact CZ-CD1 3.46Å
205L96.1Very high94.7Very high1 Ų126.9 Ų26.91%0.00515%0.152CC..Hα-helixtrans-69.5-17.5173.6-71.4171.6000113.5M201 M202 M208 L210 M244 F262 I299 M303M201-L205 HydrophobicContact CB-CD1 4.17Å; M201-L205 WeakPolarHBondContact O-CG 3.31Å; M201-L205 PolarHBondContact O-N 3.01Å; M202-L205 PolarHBondContact O-N 2.79Å; M202-L205 HydrophobicContact SD-CD1 4.44Å; L205-M208 CarbonylContact C-O 3.59Å; L205-L210 HydrophobicContact CB-CB 4.32Å; L205-L210 HydrophobicContact CB-CD2 4.34Å; L205-L210 HydrophobicContact CD1-CD2 4.45Å; L205-L210 HydrophobicContact CD2-CB 4.49Å; L205-L210 HydrophobicContact CD2-CD1 4.31Å; L205-L210 HydrophobicContact CD2-CD2 4.45Å; L205-L210 WeakPolarHBondContact O-CB 3.44Å; L205-L210 PolarHBondContact O-N 3.16Å; L205-M244 HydrophobicContact CD2-CE 4.21Å; L205-M244 HydrophobicContact CD2-SD 4.42Å; L205-F262 HydrophobicContact CD1-CD1 3.49Å; L205-F262 VanDerWaalsContact CD1-CD1 3.49Å; L205-F262 HydrophobicContact CD1-CE1 3.52Å; L205-F262 HydrophobicContact CD1-CG 4.08Å; L205-F262 HydrophobicContact CD1-CZ 4.16Å; L205-I299 HydrophobicContact CD2-CG2 3.82Å; L205-M303 HydrophobicContact CD1-CE 4.13Å; L205-M303 HydrophobicContact CD2-CE 3.9Å; L205-M303 HydrophobicContact CG-CE 4.37Å
206I96.4Very high94.7Very high17 Ų1721.4 Ų21.49%0.08712%0.123CC..Hα-helixtrans-83.4-41.8169.7-63.1-178.7000110.5Y153 M202 A203 F204 V213 W216Y153-I206 HydrophobicContact CD1-CG2 4.31Å; Y153-I206 WeakPolarHBondContact O-CD1 3.41Å; Y153-I206 WeakPolarHBondContact O-CG2 3.34Å; M202-I206 VanDerWaalsContact O-CG1 3.28Å; M202-I206 WeakPolarHBondContact O-CG1 3.22Å; M202-I206 PolarHBondContact O-N 3.24Å; A203-I206 PolarHBondContact O-N 2.65Å; F204-I206 PolarHBondContact O-N 3.36Å; I206-V213 HydrophobicContact CB-CG1 4.39Å; I206-V213 HydrophobicContact CD1-CG1 4.38Å; I206-V213 HydrophobicContact CG1-CG1 3.83Å; I206-V213 HydrophobicContact CG2-CG1 4.1Å; I206-W216 WeakPolarHBondContact O-CZ2 3.34Å; I206-W216 PolarHBondContact O-NE1 2.87Å
207K93.9Very high94.6Very high2 Ų219.9 Ų19.91%0.00912%0.115CC..Hα-helixtrans-68.4-44.3176.4-76.9-74.5-168.4166.60113.5F123 T154 A203 F204 P209 W216 L237F123-K207 HydrophobicContact CE2-CD 4.2Å; F123-K207 HydrophobicContact CE2-CG 3.73Å; F123-K207 HydrophobicContact CZ-CB 4.47Å; F123-K207 HydrophobicContact CZ-CD 4.11Å; F123-K207 HydrophobicContact CZ-CG 3.44Å; F123-K207 VanDerWaalsContact CZ-CG 3.44Å; T154-K207 HydrophobicContact CG2-CD 3.69Å; T154-K207 VanDerWaalsContact CG2-CE 3.44Å; T154-K207 HydrophobicContact CG2-CG 4.38Å; A203-K207 PolarHBondContact O-N 2.93Å; F204-K207 PolarHBondContact O-N 2.78Å; K207-P209 VanDerWaalsContact O-CD 3.24Å; K207-P209 WeakPolarHBondContact O-CD 3.42Å; K207-W216 WeakPolarHBondContact O-CZ2 3.37Å; K207-L237 WeakPolarHBondContact O-CD2 3.23Å
208M89.2Confident94.5Very high0 Ų020.4 Ų20.40%012%0.119CC..THydrogen-bonded Turntrans-82.995.8163.4-74-76.8-78.700105.2F204 L205 L210 L237 S241 M295 V298 I299F204-M208 VanDerWaalsContact O-CB 3.32Å; F204-M208 WeakPolarHBondContact O-CB 3.28Å; F204-M208 PolarHBondContact O-N 3.02Å; L205-M208 CarbonylContact C-O 3.59Å; M208-L210 VanDerWaalsContact C-N 3.31Å; M208-L210 PolarHBondContact O-N 2.6Å; M208-L237 WeakPolarHBondContact CG-O 3.12Å; M208-L237 HydrophobicContact SD-CB 4.44Å; M208-S241 WeakPolarHBondContact CE-OG 3.37Å; M208-S241 VanDerWaalsContact CG-N 3.3Å; M208-S241 PolarHBondContact SD-OG 3.38Å; M208-M295 HydrophobicContact CE-CB 3.94Å; M208-M295 HydrophobicContact CE-CG 4.38Å; M208-M295 HydrophobicContact CE-SD 3.96Å; M208-M295 HydrophobicContact SD-CB 4.23Å; M208-M295 HydrophobicContact SD-CG 4.23Å; M208-M295 HydrophobicContact SD-SD 3.85Å; M208-V298 HydrophobicContact CE-CB 3.64Å; M208-V298 HydrophobicContact CE-CG1 3.45Å; M208-V298 VanDerWaalsContact CE-CG1 3.45Å; M208-I299 HydrophobicContact CB-CD1 3.96Å; M208-I299 HydrophobicContact CB-CG1 3.99Å; M208-I299 HydrophobicContact CE-CG1 4.03Å
209P85.3Confident94.3Very high0 Ų021 Ų210%012%0.119CC..THydrogen-bonded Turntrans-57.290.6-165.431.4-45.1000110.9K207 Y211 H214 L217 L237 V292K207-P209 VanDerWaalsContact O-CD 3.24Å; K207-P209 WeakPolarHBondContact O-CD 3.42Å; P209-Y211 PolarHBondContact O-N 3.18Å; P209-H214 HydrophobicContact CB-CB 3.63Å; P209-L217 HydrophobicContact CB-CB 4.41Å; P209-L217 HydrophobicContact CB-CD1 3.99Å; P209-L217 HydrophobicContact CG-CD1 3.47Å; P209-L217 VanDerWaalsContact CG-CD1 3.47Å; P209-L237 HydrophobicContact CG-CD2 4.39Å; P209-V292 HydrophobicContact CB-CG1 4.48Å; P209-V292 HydrophobicContact CB-CG2 4.32Å; P209-V292 HydrophobicContact CG-CB 4.43Å; P209-V292 HydrophobicContact CG-CG1 4.27Å; P209-V292 HydrophobicContact CG-CG2 4Å
210L93.9Very high94.1Very high7 Ų720.2 Ų20.24%0.03711%0.112CC..  trans-61.2141.1174.1179.770.6000107.6L205 M208 G212 V213 H214 F262 L265 I299L205-L210 HydrophobicContact CB-CB 4.32Å; L205-L210 HydrophobicContact CB-CD2 4.34Å; L205-L210 HydrophobicContact CD1-CD2 4.45Å; L205-L210 HydrophobicContact CD2-CB 4.49Å; L205-L210 HydrophobicContact CD2-CD1 4.31Å; L205-L210 HydrophobicContact CD2-CD2 4.45Å; L205-L210 WeakPolarHBondContact O-CB 3.44Å; L205-L210 PolarHBondContact O-N 3.16Å; M208-L210 VanDerWaalsContact C-N 3.31Å; M208-L210 PolarHBondContact O-N 2.6Å; L210-G212 PolarHBondContact O-N 3.19Å; L210-V213 CarbonylContact O-C 3.51Å; L210-V213 WeakPolarHBondContact O-CA 3.15Å; L210-V213 PolarHBondContact O-N 3.08Å; L210-H214 PolarHBondContact O-N 2.95Å; L210-F262 HydrophobicContact CD1-CD1 4.46Å; L210-F262 HydrophobicContact CD2-CD1 3.56Å; L210-F262 HydrophobicContact CD2-CE1 3.89Å; L210-L265 HydrophobicContact CD1-CB 4.39Å; L210-L265 HydrophobicContact CD1-CD2 4Å; L210-L265 HydrophobicContact CD1-CG 4.45Å; L210-L265 HydrophobicContact CD2-CD2 3.62Å; L210-L265 HydrophobicContact CG-CD2 3.64Å; L210-L265 HydrophobicContact CG-CG 4.46Å; L210-I299 HydrophobicContact CB-CD1 4.44Å; L210-I299 HydrophobicContact CD1-CD1 4.32Å; L210-I299 HydrophobicContact CD1-CG2 4.38Å
211Y94.4Very high94Very high53 Ų5320.2 Ų20.221%0.20811%0.112CC..THydrogen-bonded Turntrans-54.6141174.9-176.7-103000110.2P209 V213 H214 L265 G269 M272 T273P209-Y211 PolarHBondContact O-N 3.18Å; Y211-V213 VanDerWaalsContact C-N 3.33Å; Y211-V213 PolarHBondContact O-N 3.46Å; Y211-H214 AromaticContact CD2-CE1 3.67Å; Y211-H214 AromaticContact CE2-CE1 3.83Å; Y211-L265 WeakPolarHBondContact CB-O 3.3Å; Y211-L265 HydrophobicContact CD1-CD1 3.98Å; Y211-L265 HydrophobicContact CD1-CG 4.28Å; Y211-L265 WeakPolarHBondContact O-CD2 3.22Å; Y211-G269 VanDerWaalsContact CG-CA 3.41Å; Y211-M272 HydrophobicContact CE2-CB 3.81Å; Y211-T273 HydrophobicContact CD2-CG2 3.87Å; Y211-T273 HydrophobicContact CE2-CG2 4.18Å
212G94.1Very high93.9Very high47 Ų4720.6 Ų20.649%0.48511%0.114SC..THydrogen-bonded Turntrans88.7-46.3-164.200000114.6L210 H214L210-G212 PolarHBondContact O-N 3.19Å; G212-H214 PolarHBondContact N-ND1 2.99Å
213V94.9Very high93.9Very high45 Ų4518.1 Ų18.127%0.27310%0.102SC..THydrogen-bonded Turntrans-98.9-2.8-179.4-161.80000113.1Y153 I206 L210 Y211 L215Y153-V213 HydrophobicContact CD1-CG1 3.51Å; Y153-V213 HydrophobicContact CE1-CG1 3.66Å; Y153-V213 WeakPolarHBondContact CE1-O 3.4Å; I206-V213 HydrophobicContact CB-CG1 4.39Å; I206-V213 HydrophobicContact CD1-CG1 4.38Å; I206-V213 HydrophobicContact CG1-CG1 3.83Å; I206-V213 HydrophobicContact CG2-CG1 4.1Å; L210-V213 CarbonylContact O-C 3.51Å; L210-V213 WeakPolarHBondContact O-CA 3.15Å; L210-V213 PolarHBondContact O-N 3.08Å; Y211-V213 VanDerWaalsContact C-N 3.33Å; Y211-V213 PolarHBondContact O-N 3.46Å; V213-L215 VanDerWaalsContact C-N 3.26Å; V213-L215 PolarHBondContact O-N 3.37Å; V213-L215 VanDerWaalsContact O-N 3.17Å
214H96.1Very high93.8Very high12 Ų1218.1 Ų18.16%0.05610%0.102CC..THydrogen-bonded Turntrans-66.9-6.7179.868.7-69.5000117.1P209 L210 Y211 G212 W216 L217 P218 V292P209-H214 HydrophobicContact CB-CB 3.63Å; L210-H214 PolarHBondContact O-N 2.95Å; Y211-H214 AromaticContact CD2-CE1 3.67Å; Y211-H214 AromaticContact CE2-CE1 3.83Å; G212-H214 PolarHBondContact N-ND1 2.99Å; H214-W216 PolarHBondContact O-N 3.5Å; H214-W216 VanDerWaalsContact O-N 3.12Å; H214-L217 WeakPolarHBondContact O-CB 3.25Å; H214-L217 PolarHBondContact O-N 3.11Å; H214-P218 WeakPolarHBondContact O-CD 3.09Å; H214-V292 HydrophobicContact CB-CG1 3.8Å; H214-V292 HydrophobicContact CB-CG2 4.16Å
215L95Very high93.7Very high84 Ų8418.4 Ų18.444%0.4410%0.104SC..THydrogen-bonded Turntrans-61.9-25.1-169.5-67.7176.9000114.6V213 L217V213-L215 VanDerWaalsContact C-N 3.26Å; V213-L215 PolarHBondContact O-N 3.37Å; V213-L215 VanDerWaalsContact O-N 3.17Å; L215-L217 VanDerWaalsContact C-N 3.28Å; L215-L217 PolarHBondContact O-N 2.88Å
216W95.6Very high93.7Very high2 Ų218.4 Ų18.41%0.00810%0.104CC..Hα-helixtrans-67.9-30.4176.268-95.3000112F150 Y153 I206 K207 H214 K219 A220 L237F150-W216 HydrophobicContact CD2-CD2 4.37Å; F150-W216 AromaticContact CD2-CE3 3.53Å; F150-W216 HydrophobicContact CD2-CE3 3.53Å; F150-W216 HydrophobicContact CD2-CH2 4.29Å; F150-W216 AromaticContact CD2-CZ3 3.48Å; F150-W216 HydrophobicContact CD2-CZ3 3.48Å; F150-W216 VanDerWaalsContact CD2-CZ3 3.48Å; F150-W216 HydrophobicContact CE2-CE3 4.22Å; F150-W216 HydrophobicContact CE2-CH2 4.17Å; F150-W216 AromaticContact CE2-CZ3 3.69Å; F150-W216 HydrophobicContact CE2-CZ3 3.69Å; Y153-W216 HydrophobicContact CD1-CB 4.34Å; Y153-W216 AromaticContact CD1-CD1 3.53Å; Y153-W216 HydrophobicContact CD1-CG 4.27Å; Y153-W216 HydrophobicContact CG-CB 4.25Å; Y153-W216 AromaticContact CG-CD1 3.99Å; Y153-W216 HydrophobicContact CG-CG 4.4Å; I206-W216 WeakPolarHBondContact O-CZ2 3.34Å; I206-W216 PolarHBondContact O-NE1 2.87Å; K207-W216 WeakPolarHBondContact O-CZ2 3.37Å; H214-W216 PolarHBondContact O-N 3.5Å; H214-W216 VanDerWaalsContact O-N 3.12Å; W216-K219 PolarHBondContact O-N 2.62Å; W216-A220 HydrophobicContact CE3-CB 3.99Å; W216-A220 HydrophobicContact CZ3-CB 4.32Å; W216-A220 VanDerWaalsContact O-CB 3.25Å; W216-A220 WeakPolarHBondContact O-CB 3.15Å; W216-A220 PolarHBondContact O-N 2.72Å; W216-L237 HydrophobicContact CH2-CD2 3.91Å; W216-L237 HydrophobicContact CZ2-CD2 4.35Å
217L92.9Very high93.6Very high0 Ų017.6 Ų17.60%010%0.1CC..Hα-helixtrans-69.8-52.4-170-171.8164.6000112.4P209 H214 L215 K219 A220 H221 L237 A288 V292P209-L217 HydrophobicContact CB-CB 4.41Å; P209-L217 HydrophobicContact CB-CD1 3.99Å; P209-L217 HydrophobicContact CG-CD1 3.47Å; P209-L217 VanDerWaalsContact CG-CD1 3.47Å; H214-L217 WeakPolarHBondContact O-CB 3.25Å; H214-L217 PolarHBondContact O-N 3.11Å; L215-L217 VanDerWaalsContact C-N 3.28Å; L215-L217 PolarHBondContact O-N 2.88Å; L217-K219 PolarHBondContact O-N 2.89Å; L217-A220 PolarHBondContact O-N 3.45Å; L217-A220 VanDerWaalsContact O-N 3.17Å; L217-H221 WeakPolarHBondContact CD2-CD2 3.24Å; L217-H221 VanDerWaalsContact CG-CD2 3.43Å; L217-H221 WeakPolarHBondContact CG-CD2 3.26Å; L217-H221 PolarHBondContact O-CD2 3.37Å; L217-H221 VanDerWaalsContact O-CD2 3.31Å; L217-H221 PolarHBondContact O-N 3.3Å; L217-L237 HydrophobicContact CD1-CD1 3.96Å; L217-L237 HydrophobicContact CD1-CD2 3.52Å; L217-L237 HydrophobicContact CD1-CG 4.38Å; L217-A288 HydrophobicContact CD2-CB 3.68Å; L217-A288 WeakPolarHBondContact CD2-O 3.06Å; L217-V292 HydrophobicContact CD1-CG2 4.03Å; L217-V292 HydrophobicContact CD2-CG2 4.2Å
218P93.8Very high93.6Very high11 Ų1117.7 Ų17.77%0.07110%0.102CC..Hα-helixtrans-54.4-41.4176.6-26.935.1000112.2H214 V222 Y289H214-P218 WeakPolarHBondContact O-CD 3.09Å; P218-V222 WeakPolarHBondContact O-CB 3.39Å; P218-V222 WeakPolarHBondContact O-CG2 3.12Å; P218-V222 PolarHBondContact O-N 3.48Å; P218-V222 VanDerWaalsContact O-N 3.1Å; P218-Y289 HydrophobicContact CB-CE2 3.91Å; P218-Y289 HydrophobicContact CG-CD1 4.19Å; P218-Y289 HydrophobicContact CG-CD2 4.3Å; P218-Y289 HydrophobicContact CG-CE1 3.69Å; P218-Y289 HydrophobicContact CG-CE2 3.79Å; P218-Y289 HydrophobicContact CG-CG 4.48Å; P218-Y289 VanDerWaalsContact CG-CZ 3.46Å
219K92.4Very high93.9Very high79 Ų7917.7 Ų17.734%0.34310%0.102SC..Hα-helixtrans-65.9-49.1176.9-64.6-177.4-179.5-179.60112A146 Y149 W216 L217 H221 V222 E223A146-K219 HydrophobicContact CB-CB 4.05Å; Y149-K219 HydrophobicContact CD2-CD 3.8Å; Y149-K219 HydrophobicContact CE2-CD 4.03Å; Y149-K219 HydrophobicContact CG-CD 4.39Å; Y149-K219 PolarHBondContact OH-NZ 3.48Å; W216-K219 PolarHBondContact O-N 2.62Å; L217-K219 PolarHBondContact O-N 2.89Å; K219-H221 PolarHBondContact O-N 3.2Å; K219-V222 PolarHBondContact O-N 3.36Å; K219-E223 WeakPolarHBondContact O-CB 3.41Å; K219-E223 PolarHBondContact O-N 3.13Å
220A93.6Very high94.5Very high0 Ų017.7 Ų17.70%010%0.102CC..Hα-helixtrans-61.8-45.1-177.700000112.3W216 L217 A224 L232W216-A220 HydrophobicContact CE3-CB 3.99Å; W216-A220 HydrophobicContact CZ3-CB 4.32Å; W216-A220 VanDerWaalsContact O-CB 3.25Å; W216-A220 WeakPolarHBondContact O-CB 3.15Å; W216-A220 PolarHBondContact O-N 2.72Å; L217-A220 PolarHBondContact O-N 3.45Å; L217-A220 VanDerWaalsContact O-N 3.17Å; A220-A224 WeakPolarHBondContact O-CB 3.48Å; A220-A224 PolarHBondContact O-N 3.28Å; A220-L232 HydrophobicContact CB-CD1 4.46Å
221H93.9Very high94.6Very high0 Ų017.5 Ų17.50%010%0.1CC..Hα-helixtrans-71-39.1179.6-81-98.8000113.6L217 K219 E223 L232 A233 A288 F328L217-H221 WeakPolarHBondContact CD2-CD2 3.24Å; L217-H221 VanDerWaalsContact CG-CD2 3.43Å; L217-H221 WeakPolarHBondContact CG-CD2 3.26Å; L217-H221 PolarHBondContact O-CD2 3.37Å; L217-H221 VanDerWaalsContact O-CD2 3.31Å; L217-H221 PolarHBondContact O-N 3.3Å; K219-H221 PolarHBondContact O-N 3.2Å; H221-E223 VanDerWaalsContact C-N 3.34Å; H221-L232 VanDerWaalsContact CE1-CB 3.43Å; H221-L232 WeakPolarHBondContact CE1-CB 3.06Å; H221-A233 PolarHBondContact CE1-N 3.48Å; H221-A233 VanDerWaalsContact CE1-N 3.27Å; H221-A288 HydrophobicContact CB-CB 4.01Å; H221-F328 HydrophobicContact CB-CE1 4.12Å; H221-F328 HydrophobicContact CB-CZ 3.9Å; H221-F328 AromaticContact CE1-CE2 3.94Å; H221-F328 AromaticContact CG-CZ 3.81Å; H221-F328 AromaticContact ND1-CE2 3.39Å; H221-F328 WeakPolarHBondContact ND1-CE2 3.22Å; H221-F328 AromaticContact ND1-CZ 3.24Å; H221-F328 WeakPolarHBondContact ND1-CZ 3.27Å
222V93.3Very high94.6Very high13 Ų1315.1 Ų15.18%0.0799%0.091CC..Hα-helixtrans-69-38.4-176.7169.30000110.4P218 K219 K284 R341P218-V222 WeakPolarHBondContact O-CB 3.39Å; P218-V222 WeakPolarHBondContact O-CG2 3.12Å; P218-V222 PolarHBondContact O-N 3.48Å; P218-V222 VanDerWaalsContact O-N 3.1Å; K219-V222 PolarHBondContact O-N 3.36Å; V222-K284 HydrophobicContact CG2-CB 4.01Å; V222-R341 PolarHBondContact O-NH1 2.99Å
223E94.1Very high94.4Very high5 Ų512.9 Ų12.92%0.0237%0.068CC..Hα-helixtrans-90.1-16.9-178.7-61.9-49.8141.500115.3G138 Q140 E142 R143 A146 K219 H221 R341G138-E223 WeakPolarHBondContact CA-O 3.36Å; Q140-E223 WeakPolarHBondContact CB-OE2 3.45Å; Q140-E223 VanDerWaalsContact CG-OE2 3.28Å; Q140-E223 WeakPolarHBondContact CG-OE2 3.45Å; E142-E223 HydrophobicContact CB-CG 4.18Å; R143-E223 HydrophobicContact CB-CB 4.28Å; A146-E223 HydrophobicContact CB-CB 4.07Å; A146-E223 HydrophobicContact CB-CG 4.24Å; K219-E223 WeakPolarHBondContact O-CB 3.41Å; K219-E223 PolarHBondContact O-N 3.13Å; H221-E223 VanDerWaalsContact C-N 3.34Å; E223-R341 IonicContact OE1-CZ 3.13Å; E223-R341 IonicContact OE1-NH1 3.34Å; E223-R341 PolarHBondContact OE1-NH1 3.12Å; E223-R341 IonicContact OE1-NH2 2.74Å; E223-R341 PolarHBondContact OE1-NH2 2.9Å; E223-R341 IonicContact OE2-NH1 2.98Å; E223-R341 PolarHBondContact OE2-NH1 2.82Å
224A94.6Very high94.4Very high3 Ų310.7 Ų10.73%0.0256%0.055CC..SBendtrans-65.8147.817300000112.6I134 A220 L232 K284I134-A224 HydrophobicContact CG1-CB 4.1Å; A220-A224 WeakPolarHBondContact O-CB 3.48Å; A220-A224 PolarHBondContact O-N 3.28Å; A224-L232 HydrophobicContact CB-CD1 4.12Å; A224-K284 PolarHBondContact O-NZ 3.33Å
225P95.3Very high94.5Very high5 Ų510.4 Ų10.43%0.0325%0.054CC..  trans-62.7167.1162.629.5-34.8000110.5H84 Y96 I133 W137 A227 G228 S229H84-P225 WeakPolarHBondContact NE2-CB 3.13Å; Y96-P225 HydrophobicContact CE2-CG 4.37Å; I133-P225 HydrophobicContact CG2-CG 3.63Å; W137-P225 HydrophobicContact CB-CB 4.48Å; W137-P225 HydrophobicContact CB-CG 4.09Å; P225-A227 PolarHBondContact O-N 2.99Å; P225-G228 WeakPolarHBondContact O-CA 3.22Å; P225-G228 PolarHBondContact O-N 3.08Å; P225-S229 PolarHBondContact O-N 3.3Å
226I95.5Very high94.5Very high1 Ų16.5 Ų6.51%0.0053%0.034CC..Hα-helixtrans-55-48.5-172.8-175.750.3000113.1A80 G228 S229 M230 F328 N332A80-I226 HydrophobicContact CB-CG1 3.88Å; A80-I226 HydrophobicContact CB-CG2 3.87Å; I226-G228 VanDerWaalsContact C-N 3.29Å; I226-G228 PolarHBondContact O-N 2.88Å; I226-S229 WeakPolarHBondContact CA-OG 3.43Å; I226-S229 PolarHBondContact O-N 2.96Å; I226-S229 PolarHBondContact O-OG 3.03Å; I226-M230 HydrophobicContact CD1-CG 4.09Å; I226-M230 HydrophobicContact CD1-SD 4.33Å; I226-M230 HydrophobicContact CG1-CG 4.39Å; I226-M230 HydrophobicContact CG1-SD 4.02Å; I226-M230 VanDerWaalsContact O-CG 3.26Å; I226-M230 WeakPolarHBondContact O-CG 3.36Å; I226-M230 PolarHBondContact O-N 2.82Å; I226-F328 HydrophobicContact CD1-CB 4.07Å; I226-F328 VanDerWaalsContact CD1-O 3.25Å; I226-F328 WeakPolarHBondContact CD1-O 3.42Å; I226-N332 HydrophobicContact CB-CB 4.22Å; I226-N332 HydrophobicContact CD1-CB 3.69Å; I226-N332 HydrophobicContact CG1-CB 3.82Å
227A94.6Very high94.3Very high0 Ų06.5 Ų6.50%03%0.034CC..Hα-helixtrans-61.9-38178.200000112.3M77 Y96 L100 P225 M230 I231M77-A227 HydrophobicContact CB-CB 3.84Å; M77-A227 HydrophobicContact CG-CB 4.02Å; M77-A227 HydrophobicContact SD-CB 4.07Å; Y96-A227 WeakPolarHBondContact OH-CB 3.36Å; L100-A227 HydrophobicContact CD1-CB 4.1Å; L100-A227 HydrophobicContact CD2-CB 3.87Å; P225-A227 PolarHBondContact O-N 2.99Å; A227-M230 PolarHBondContact O-N 2.69Å; A227-I231 WeakPolarHBondContact O-CG1 3.42Å; A227-I231 PolarHBondContact O-N 3.03Å
228G94.2Very high94.5Very high5 Ų56.5 Ų6.55%0.0523%0.034CC..Hα-helixtrans-60.6-49.2174.800000111.3P225 I226 M230 I231 L232P225-G228 WeakPolarHBondContact O-CA 3.22Å; P225-G228 PolarHBondContact O-N 3.08Å; I226-G228 VanDerWaalsContact C-N 3.29Å; I226-G228 PolarHBondContact O-N 2.88Å; G228-M230 VanDerWaalsContact C-N 3.3Å; G228-M230 PolarHBondContact O-N 3.41Å; G228-I231 PolarHBondContact O-N 3.44Å; G228-L232 VanDerWaalsContact O-CB 3.31Å; G228-L232 WeakPolarHBondContact O-CB 3.43Å; G228-L232 WeakPolarHBondContact O-CD1 3.31Å; G228-L232 VanDerWaalsContact O-CG 3.22Å; G228-L232 WeakPolarHBondContact O-CG 3.17Å; G228-L232 PolarHBondContact O-N 2.94Å
229S95.1Very high94.6Very high0 Ų06 Ų60%03%0.03CC..Hα-helixtrans-62.1-35.5176.862.60000113P225 I226 A233P225-S229 PolarHBondContact O-N 3.3Å; I226-S229 WeakPolarHBondContact CA-OG 3.43Å; I226-S229 PolarHBondContact O-N 2.96Å; I226-S229 PolarHBondContact O-OG 3.03Å; S229-A233 VanDerWaalsContact O-CB 3.26Å; S229-A233 WeakPolarHBondContact O-CB 3.5Å; S229-A233 PolarHBondContact O-N 3.15Å
230M97.1Very high94.7Very high0 Ų02.2 Ų2.20%01%0.014CC..Hα-helixtrans-64.8-47.7175.9-67.7166.973.900111.8L73 L76 M77 A80 I226 A227 G228 A233 A234 C329L73-M230 HydrophobicContact CD1-CE 4.46Å; L73-M230 HydrophobicContact CD2-CB 4.4Å; L76-M230 HydrophobicContact CB-CE 3.94Å; M77-M230 HydrophobicContact CG-CB 4.29Å; M77-M230 HydrophobicContact CG-CE 4.07Å; M77-M230 HydrophobicContact CG-SD 4.13Å; A80-M230 HydrophobicContact CB-CE 4.47Å; A80-M230 HydrophobicContact CB-SD 3.63Å; I226-M230 HydrophobicContact CD1-CG 4.09Å; I226-M230 HydrophobicContact CD1-SD 4.33Å; I226-M230 HydrophobicContact CG1-CG 4.39Å; I226-M230 HydrophobicContact CG1-SD 4.02Å; I226-M230 VanDerWaalsContact O-CG 3.26Å; I226-M230 WeakPolarHBondContact O-CG 3.36Å; I226-M230 PolarHBondContact O-N 2.82Å; A227-M230 PolarHBondContact O-N 2.69Å; G228-M230 VanDerWaalsContact C-N 3.3Å; G228-M230 PolarHBondContact O-N 3.41Å; M230-A233 PolarHBondContact O-N 3.25Å; M230-A234 WeakPolarHBondContact O-CB 3.32Å; M230-A234 PolarHBondContact O-N 3.15Å; M230-C329 PolarHBondContact SD-SG 3.27Å
231I96.4Very high94.8Very high2 Ų22.2 Ų2.21%0.011%0.014CC..Hα-helixtrans-70.2-41.9-178.1-58.8157.8000111.3L73 M77 L100 L103 L107 A227 G228 A233 I235 L236L73-I231 HydrophobicContact CD2-CB 4.35Å; L73-I231 HydrophobicContact CD2-CG1 3.91Å; M77-I231 HydrophobicContact CE-CD1 3.72Å; M77-I231 HydrophobicContact CE-CG1 3.57Å; M77-I231 HydrophobicContact CG-CG1 4.33Å; M77-I231 HydrophobicContact SD-CB 4.42Å; M77-I231 HydrophobicContact SD-CD1 3.06Å; M77-I231 WeakPolarHBondContact SD-CD1 3.47Å; M77-I231 HydrophobicContact SD-CG1 2.95Å; M77-I231 WeakPolarHBondContact SD-CG1 3.32Å; L100-I231 HydrophobicContact CD2-CD1 3.6Å; L103-I231 HydrophobicContact CD2-CB 4.42Å; L103-I231 HydrophobicContact CD2-CD1 3.44Å; L103-I231 VanDerWaalsContact CD2-CD1 3.44Å; L103-I231 HydrophobicContact CD2-CG1 4.39Å; L103-I231 HydrophobicContact CD2-CG2 3.8Å; L103-I231 HydrophobicContact CG-CD1 4.48Å; L103-I231 HydrophobicContact CG-CG2 4.34Å; L107-I231 HydrophobicContact CD1-CG2 4.01Å; A227-I231 WeakPolarHBondContact O-CG1 3.42Å; A227-I231 PolarHBondContact O-N 3.03Å; G228-I231 PolarHBondContact O-N 3.44Å; I231-A233 VanDerWaalsContact C-N 3.28Å; I231-A233 PolarHBondContact O-N 3.32Å; I231-I235 HydrophobicContact CG2-CB 4.49Å; I231-I235 HydrophobicContact CG2-CD1 4.4Å; I231-I235 PolarHBondContact O-N 2.94Å; I231-L236 HydrophobicContact CG2-CD1 3.87Å; I231-L236 HydrophobicContact CG2-CG 3.98Å; I231-L236 PolarHBondContact O-N 3.37Å
232L93.3Very high94.9Very high3 Ų32.2 Ų2.22%0.0161%0.014CC..Iπ-helixtrans-53.3-52.3174.3-74.7162.7000109.2I134 F150 A220 H221 A224 G228 L236 L237I134-L232 HydrophobicContact CD1-CD1 4.11Å; I134-L232 HydrophobicContact CG1-CD1 4.49Å; F150-L232 HydrophobicContact CE2-CD2 3.97Å; F150-L232 HydrophobicContact CZ-CD2 4.17Å; A220-L232 HydrophobicContact CB-CD1 4.46Å; H221-L232 VanDerWaalsContact CE1-CB 3.43Å; H221-L232 WeakPolarHBondContact CE1-CB 3.06Å; A224-L232 HydrophobicContact CB-CD1 4.12Å; G228-L232 VanDerWaalsContact O-CB 3.31Å; G228-L232 WeakPolarHBondContact O-CB 3.43Å; G228-L232 WeakPolarHBondContact O-CD1 3.31Å; G228-L232 VanDerWaalsContact O-CG 3.22Å; G228-L232 WeakPolarHBondContact O-CG 3.17Å; G228-L232 PolarHBondContact O-N 2.94Å; L232-L236 HydrophobicContact CB-CD1 4.44Å; L232-L236 HydrophobicContact CD2-CB 4.42Å; L232-L236 HydrophobicContact CD2-CD1 3.49Å; L232-L236 VanDerWaalsContact CD2-CD1 3.49Å; L232-L236 HydrophobicContact CG-CD1 3.9Å; L232-L236 PolarHBondContact O-N 2.96Å; L232-L237 WeakPolarHBondContact O-CG 3.41Å; L232-L237 PolarHBondContact O-N 3.11Å
233A91.9Very high95Very high0 Ų01.6 Ų1.60%01%0.01CC..Iπ-helixtrans-69.4-49.7-176.600000112.2H221 S229 M230 I231 K238 S324 F328H221-A233 PolarHBondContact CE1-N 3.48Å; H221-A233 VanDerWaalsContact CE1-N 3.27Å; S229-A233 VanDerWaalsContact O-CB 3.26Å; S229-A233 WeakPolarHBondContact O-CB 3.5Å; S229-A233 PolarHBondContact O-N 3.15Å; M230-A233 PolarHBondContact O-N 3.25Å; I231-A233 VanDerWaalsContact C-N 3.28Å; I231-A233 PolarHBondContact O-N 3.32Å; A233-K238 PolarHBondContact O-NZ 3.31Å; A233-S324 WeakPolarHBondContact CB-OG 3.16Å; A233-F328 HydrophobicContact CB-CD2 3.83Å; A233-F328 HydrophobicContact CB-CE2 3.66Å
234A94.5Very high95.1Very high0 Ų01.4 Ų1.40%01%0.009CC..Iπ-helixtrans-75.2-36.4-169.400000113.1L73 M230 K238 G321L73-A234 HydrophobicContact CD1-CB 3.87Å; L73-A234 HydrophobicContact CD2-CB 3.86Å; M230-A234 WeakPolarHBondContact O-CB 3.32Å; M230-A234 PolarHBondContact O-N 3.15Å; A234-K238 VanDerWaalsContact O-CD 3.25Å; A234-K238 WeakPolarHBondContact O-CD 3.25Å; A234-K238 VanDerWaalsContact O-CE 3.26Å; A234-K238 WeakPolarHBondContact O-CE 3.39Å; A234-G321 WeakPolarHBondContact CB-O 3.37Å
235I96.8Very high95.1Very high5 Ų51.5 Ų1.53%0.0261%0.009CC..Iπ-helixtrans-128.4-47.2-165.2-53.9163.6000113T70 L73 L107 F111 I231 L237 K238 L239T70-I235 HydrophobicContact CG2-CB 4.4Å; T70-I235 HydrophobicContact CG2-CD1 3.65Å; T70-I235 HydrophobicContact CG2-CG1 3.93Å; T70-I235 HydrophobicContact CG2-CG2 3.54Å; L73-I235 HydrophobicContact CB-CD1 4.12Å; L73-I235 HydrophobicContact CD2-CD1 3.62Å; L73-I235 HydrophobicContact CD2-CG1 4.24Å; L73-I235 HydrophobicContact CG-CD1 4.5Å; L107-I235 HydrophobicContact CD1-CB 4.42Å; L107-I235 HydrophobicContact CD1-CD1 4.17Å; L107-I235 HydrophobicContact CD1-CG2 3.91Å; L107-I235 HydrophobicContact CD2-CG2 3.73Å; L107-I235 HydrophobicContact CG-CG2 4.3Å; F111-I235 HydrophobicContact CE2-CG2 3.6Å; F111-I235 HydrophobicContact CZ-CG2 3.86Å; I231-I235 HydrophobicContact CG2-CB 4.49Å; I231-I235 HydrophobicContact CG2-CD1 4.4Å; I231-I235 PolarHBondContact O-N 2.94Å; I235-L237 VanDerWaalsContact C-N 3.3Å; I235-L237 PolarHBondContact O-N 3.42Å; I235-K238 CarbonylContact O-C 3.59Å; I235-K238 WeakPolarHBondContact O-CA 3.13Å; I235-K238 WeakPolarHBondContact O-CB 3.28Å; I235-K238 PolarHBondContact O-N 3.47Å; I235-L239 PolarHBondContact O-N 3.01Å; I235-L239 VanDerWaalsContact O-N 3.08Å
236L94.9Very high94.9Very high3 Ų31.8 Ų1.82%0.0161%0.01CC..Iπ-helixtrans-66.8-32.6-170.2-68.8163000112.8L107 T130 I231 L232 K238 L239L107-L236 HydrophobicContact CD2-CD2 4.17Å; T130-L236 HydrophobicContact CG2-CD1 3.4Å; T130-L236 HydrophobicContact CG2-CD2 4.27Å; T130-L236 HydrophobicContact CG2-CG 4.48Å; I231-L236 HydrophobicContact CG2-CD1 3.87Å; I231-L236 HydrophobicContact CG2-CG 3.98Å; I231-L236 PolarHBondContact O-N 3.37Å; L232-L236 HydrophobicContact CB-CD1 4.44Å; L232-L236 HydrophobicContact CD2-CB 4.42Å; L232-L236 HydrophobicContact CD2-CD1 3.49Å; L232-L236 VanDerWaalsContact CD2-CD1 3.49Å; L232-L236 HydrophobicContact CG-CD1 3.9Å; L232-L236 PolarHBondContact O-N 2.96Å; L236-K238 VanDerWaalsContact C-N 3.29Å; L236-L239 HydrophobicContact CD2-CD1 3.75Å; L236-L239 WeakPolarHBondContact O-CB 3.15Å; L236-L239 PolarHBondContact O-N 3.44Å
237L93Very high94.8Very high1 Ų11.8 Ų1.81%0.0051%0.01CC..Hα-helixtrans-62.8-40.1169.7-57176.4000110.6K207 M208 P209 W216 L217 L232 I235 L239 G240 M295K207-L237 WeakPolarHBondContact O-CD2 3.23Å; M208-L237 WeakPolarHBondContact CG-O 3.12Å; M208-L237 HydrophobicContact SD-CB 4.44Å; P209-L237 HydrophobicContact CG-CD2 4.39Å; W216-L237 HydrophobicContact CH2-CD2 3.91Å; W216-L237 HydrophobicContact CZ2-CD2 4.35Å; L217-L237 HydrophobicContact CD1-CD1 3.96Å; L217-L237 HydrophobicContact CD1-CD2 3.52Å; L217-L237 HydrophobicContact CD1-CG 4.38Å; L232-L237 WeakPolarHBondContact O-CG 3.41Å; L232-L237 PolarHBondContact O-N 3.11Å; I235-L237 VanDerWaalsContact C-N 3.3Å; I235-L237 PolarHBondContact O-N 3.42Å; L237-L239 VanDerWaalsContact C-N 3.26Å; L237-L239 PolarHBondContact O-N 3.03Å; L237-G240 PolarHBondContact O-N 3.5Å; L237-M295 HydrophobicContact CB-CG 4.28Å; L237-M295 HydrophobicContact CB-SD 4.16Å; L237-M295 HydrophobicContact CD1-CG 4.03Å
238K96.8Very high94.6Very high0 Ų02.2 Ų2.20%01%0.013CC..Hα-helixtrans-70-22.6-175.9-73.557.3168.1175.50112.6L66 A233 A234 I235 L236 G240 S241 Y242 M295 M317 H320L66-K238 HydrophobicContact CD2-CB 3.92Å; L66-K238 HydrophobicContact CD2-CG 4.12Å; A233-K238 PolarHBondContact O-NZ 3.31Å; A234-K238 VanDerWaalsContact O-CD 3.25Å; A234-K238 WeakPolarHBondContact O-CD 3.25Å; A234-K238 VanDerWaalsContact O-CE 3.26Å; A234-K238 WeakPolarHBondContact O-CE 3.39Å; I235-K238 CarbonylContact O-C 3.59Å; I235-K238 WeakPolarHBondContact O-CA 3.13Å; I235-K238 WeakPolarHBondContact O-CB 3.28Å; I235-K238 PolarHBondContact O-N 3.47Å; L236-K238 VanDerWaalsContact C-N 3.29Å; K238-G240 PolarHBondContact O-N 3.1Å; K238-S241 WeakPolarHBondContact CA-OG 3.41Å; K238-S241 PolarHBondContact O-N 3.32Å; K238-S241 PolarHBondContact O-OG 3.41Å; K238-Y242 VanDerWaalsContact O-CB 3.25Å; K238-Y242 WeakPolarHBondContact O-CB 3.3Å; K238-Y242 PolarHBondContact O-N 2.98Å; K238-M295 HydrophobicContact CD-SD 4.31Å; K238-M317 HydrophobicContact CB-SD 4.28Å; K238-M317 WeakPolarHBondContact CE-O 3.23Å; K238-M317 HydrophobicContact CG-CB 3.86Å; K238-M317 HydrophobicContact CG-CG 3.97Å; K238-M317 HydrophobicContact CG-SD 4.08Å; K238-H320 PolarHBondContact NZ-CD2 2.91Å
239L94.9Very high94.4Very high0 Ų04.8 Ų4.80%03%0.025CC..Hα-helixtrans-58.7-37.6170-72.6173.7000111.9L107 T110 F111 F123 T126 I235 L236 L237 G243L107-L239 HydrophobicContact CD2-CD1 3.67Å; L107-L239 HydrophobicContact CD2-CD2 4.04Å; L107-L239 HydrophobicContact CD2-CG 4.06Å; T110-L239 HydrophobicContact CG2-CD2 4.35Å; T110-L239 WeakPolarHBondContact OG1-CD2 3.36Å; F111-L239 HydrophobicContact CD1-CD2 4.33Å; F111-L239 HydrophobicContact CE1-CD2 3.63Å; F111-L239 HydrophobicContact CE1-CG 4.43Å; F111-L239 HydrophobicContact CE2-CD2 3.97Å; F111-L239 HydrophobicContact CZ-CD2 3.42Å; F111-L239 VanDerWaalsContact CZ-CD2 3.42Å; F111-L239 HydrophobicContact CZ-CG 3.99Å; F123-L239 HydrophobicContact CD2-CB 4.11Å; F123-L239 HydrophobicContact CD2-CD1 4.33Å; F123-L239 HydrophobicContact CE2-CB 4.18Å; T126-L239 HydrophobicContact CG2-CD1 4.3Å; I235-L239 PolarHBondContact O-N 3.01Å; I235-L239 VanDerWaalsContact O-N 3.08Å; L236-L239 HydrophobicContact CD2-CD1 3.75Å; L236-L239 WeakPolarHBondContact O-CB 3.15Å; L236-L239 PolarHBondContact O-N 3.44Å; L237-L239 VanDerWaalsContact C-N 3.26Å; L237-L239 PolarHBondContact O-N 3.03Å; L239-G243 PolarHBondContact O-N 3.16Å
240G95.3Very high94.2Very high0 Ų05.6 Ų5.60%03%0.029CC..Hα-helixtrans-66.9-47.9178.900000111.7F204 L237 K238 G243 M244F204-G240 WeakPolarHBondContact CB-O 3.16Å; L237-G240 PolarHBondContact O-N 3.5Å; K238-G240 PolarHBondContact O-N 3.1Å; G240-G243 PolarHBondContact O-N 2.94Å; G240-M244 WeakPolarHBondContact O-CG 3.43Å; G240-M244 PolarHBondContact O-N 3.18Å
241S95.1Very high93.9Very high0 Ų05.6 Ų5.60%03%0.029CC..Hα-helixtrans-65.7-40.3177.420.70000112.5M208 K238 G243 M244 I245 I302 M317M208-S241 WeakPolarHBondContact CE-OG 3.37Å; M208-S241 VanDerWaalsContact CG-N 3.3Å; M208-S241 PolarHBondContact SD-OG 3.38Å; K238-S241 WeakPolarHBondContact CA-OG 3.41Å; K238-S241 PolarHBondContact O-N 3.32Å; K238-S241 PolarHBondContact O-OG 3.41Å; S241-G243 VanDerWaalsContact C-N 3.34Å; S241-G243 PolarHBondContact O-N 2.66Å; S241-M244 PolarHBondContact O-N 3.25Å; S241-I245 WeakPolarHBondContact O-CG1 3.28Å; S241-I245 PolarHBondContact O-N 2.92Å; S241-I302 VanDerWaalsContact CB-CD1 3.48Å; S241-M317 WeakPolarHBondContact CB-SD 3.36Å; S241-M317 PolarHBondContact OG-SD 3.48Å
242Y96.1Very high93.5Very high1 Ų18.5 Ų8.50%0.0045%0.045CC..Hα-helixtrans-56.7-48.2171.3177-98000111.4L62 L66 F111 F119 K238 M244 I245 R246L62-Y242 HydrophobicContact CD2-CD2 3.45Å; L62-Y242 VanDerWaalsContact CD2-CD2 3.45Å; L62-Y242 HydrophobicContact CD2-CE2 3.57Å; L62-Y242 HydrophobicContact CD2-CG 4.5Å; L62-Y242 HydrophobicContact CG-CD2 3.86Å; L62-Y242 HydrophobicContact CG-CE2 4.08Å; L66-Y242 HydrophobicContact CD1-CD2 3.89Å; L66-Y242 HydrophobicContact CD1-CG 4.36Å; F111-Y242 AromaticContact CD1-CD1 3.89Å; F111-Y242 HydrophobicContact CD1-CD1 3.89Å; F111-Y242 AromaticContact CD1-CD2 3.87Å; F111-Y242 HydrophobicContact CD1-CD2 3.87Å; F111-Y242 HydrophobicContact CD1-CE1 4.22Å; F111-Y242 HydrophobicContact CD1-CE2 4.23Å; F111-Y242 AromaticContact CD1-CG 3.71Å; F111-Y242 HydrophobicContact CD1-CG 3.71Å; F111-Y242 HydrophobicContact CE1-CD1 4.22Å; F111-Y242 HydrophobicContact CE1-CD2 4.33Å; F111-Y242 AromaticContact CE1-CG 3.88Å; F111-Y242 HydrophobicContact CE1-CG 3.88Å; F111-Y242 PolarHBondContact O-OH 3.5Å; F119-Y242 HydrophobicContact CD2-CD1 4.32Å; F119-Y242 AromaticContact CD2-CE1 3.97Å; F119-Y242 HydrophobicContact CD2-CE1 3.97Å; F119-Y242 AromaticContact CE2-CD1 3.55Å; F119-Y242 HydrophobicContact CE2-CD1 3.55Å; F119-Y242 AromaticContact CE2-CE1 3.67Å; F119-Y242 HydrophobicContact CE2-CE1 3.67Å; F119-Y242 HydrophobicContact CZ-CD1 4.02Å; F119-Y242 HydrophobicContact CZ-CE1 4.4Å; K238-Y242 VanDerWaalsContact O-CB 3.25Å; K238-Y242 WeakPolarHBondContact O-CB 3.3Å; K238-Y242 PolarHBondContact O-N 2.98Å; Y242-M244 PolarHBondContact O-N 2.8Å; Y242-I245 PolarHBondContact O-N 3.41Å; Y242-R246 HydrophobicContact CD1-CG 4.38Å; Y242-R246 HydrophobicContact CE1-CG 3.97Å; Y242-R246 HydrophobicContact CE2-CG 4.35Å; Y242-R246 WeakPolarHBondContact O-CG 3.11Å; Y242-R246 PolarHBondContact O-N 3.45Å; Y242-R246 VanDerWaalsContact O-N 3.08Å; Y242-R246 PolarHBondContact OH-NE 3.12Å; Y242-R246 PolarHBondContact OH-NH2 3.06Å
243G95.9Very high93.3Very high0 Ų011 Ų110%06%0.061CC..Hα-helixtrans-60.1-44176.800000113L239 G240 S241 I245 R246 I247L239-G243 PolarHBondContact O-N 3.16Å; G240-G243 PolarHBondContact O-N 2.94Å; S241-G243 VanDerWaalsContact C-N 3.34Å; S241-G243 PolarHBondContact O-N 2.66Å; G243-I245 PolarHBondContact O-N 3.44Å; G243-R246 PolarHBondContact O-N 2.76Å; G243-I247 WeakPolarHBondContact O-CB 3.27Å; G243-I247 PolarHBondContact O-N 2.82Å
244M95.4Very high93.3Very high0 Ų011.5 Ų11.50%06%0.063CC..Hα-helixtrans-59.7-44.6176.6-69.2170.56700112.2M201 F204 L205 G240 S241 Y242 R246 I247 S248 I299 I302 M303M201-M244 HydrophobicContact CE-CB 4.19Å; M201-M244 HydrophobicContact CE-CE 3.59Å; M201-M244 HydrophobicContact CE-CG 3.86Å; M201-M244 HydrophobicContact CE-SD 4.48Å; F204-M244 HydrophobicContact CB-CG 3.44Å; F204-M244 VanDerWaalsContact CB-CG 3.44Å; F204-M244 HydrophobicContact CB-SD 4.18Å; F204-M244 HydrophobicContact CD2-CG 4.17Å; F204-M244 HydrophobicContact CG-CG 4.04Å; L205-M244 HydrophobicContact CD2-CE 4.21Å; L205-M244 HydrophobicContact CD2-SD 4.42Å; G240-M244 WeakPolarHBondContact O-CG 3.43Å; G240-M244 PolarHBondContact O-N 3.18Å; S241-M244 PolarHBondContact O-N 3.25Å; Y242-M244 PolarHBondContact O-N 2.8Å; M244-R246 VanDerWaalsContact C-N 3.3Å; M244-R246 PolarHBondContact O-N 2.92Å; M244-I247 PolarHBondContact O-N 2.83Å; M244-S248 WeakPolarHBondContact O-CB 3.21Å; M244-S248 PolarHBondContact O-N 3.17Å; M244-S248 PolarHBondContact O-OG 2.89Å; M244-I299 HydrophobicContact CE-CG2 4.41Å; M244-I302 HydrophobicContact CB-CG2 3.75Å; M244-I302 HydrophobicContact CE-CB 4.23Å; M244-I302 HydrophobicContact CE-CG2 3.87Å; M244-M303 HydrophobicContact CE-CE 3.67Å; M244-M303 HydrophobicContact CE-CG 4.32Å; M244-M303 HydrophobicContact CE-SD 4.16Å
245I94.4Very high93.2Very high6 Ų611.6 Ų11.63%0.0316%0.064CC..Hα-helixtrans-66.6-33179-64.3165000111.3L62 S241 Y242 G243 S248 I302 F310 T314 M317 L458L62-I245 HydrophobicContact CD1-CD1 3.67Å; L62-I245 HydrophobicContact CD1-CG2 4.33Å; L62-I245 HydrophobicContact CD2-CB 4.15Å; L62-I245 HydrophobicContact CD2-CG2 3.8Å; S241-I245 WeakPolarHBondContact O-CG1 3.28Å; S241-I245 PolarHBondContact O-N 2.92Å; Y242-I245 PolarHBondContact O-N 3.41Å; G243-I245 PolarHBondContact O-N 3.44Å; I245-S248 PolarHBondContact O-OG 2.89Å; I245-I302 HydrophobicContact CD1-CD1 4.02Å; I245-I302 HydrophobicContact CD1-CG1 4.19Å; I245-I302 HydrophobicContact CG1-CD1 3.96Å; I245-I302 HydrophobicContact CG1-CG1 3.98Å; I245-I302 HydrophobicContact CG1-CG2 4.07Å; I245-F310 HydrophobicContact CD1-CD1 4.41Å; I245-F310 HydrophobicContact CG1-CD1 4.07Å; I245-F310 HydrophobicContact CG1-CE1 4.03Å; I245-F310 HydrophobicContact CG2-CE1 4.49Å; I245-T314 HydrophobicContact CD1-CG2 4.48Å; I245-M317 HydrophobicContact CD1-CE 4.08Å; I245-L458 HydrophobicContact CG2-CD1 4.26Å
246R92.9Very high92.9Very high10 Ų1018.6 Ų18.64%0.0389%0.094CC..Hα-helixtrans-71.6-41.3176.8-71.5-54.6-166.3-160-6.2112.9D60 L116 L177 Y242 G243 M244D60-R246 IonicContact OD1-CZ 2.89Å; D60-R246 IonicContact OD1-NH2 2.8Å; D60-R246 PolarHBondContact OD1-NH2 3Å; D60-R246 IonicContact OD2-CZ 2.83Å; D60-R246 IonicContact OD2-NH1 3.35Å; D60-R246 PolarHBondContact OD2-NH1 2.74Å; D60-R246 IonicContact OD2-NH2 3.38Å; D60-R246 PolarHBondContact OD2-NH2 2.82Å; L116-R246 HydrophobicContact CD2-CB 4.38Å; L177-R246 HydrophobicContact CD1-CG 4.16Å; L177-R246 HydrophobicContact CD2-CB 4.03Å; L177-R246 HydrophobicContact CD2-CG 4.44Å; Y242-R246 HydrophobicContact CD1-CG 4.38Å; Y242-R246 HydrophobicContact CE1-CG 3.97Å; Y242-R246 HydrophobicContact CE2-CG 4.35Å; Y242-R246 WeakPolarHBondContact O-CG 3.11Å; Y242-R246 PolarHBondContact O-N 3.45Å; Y242-R246 VanDerWaalsContact O-N 3.08Å; Y242-R246 PolarHBondContact OH-NE 3.12Å; Y242-R246 PolarHBondContact OH-NH2 3.06Å; G243-R246 PolarHBondContact O-N 2.76Å; M244-R246 VanDerWaalsContact C-N 3.3Å; M244-R246 PolarHBondContact O-N 2.92Å
247I92.9Very high92.7Very high1 Ų126 Ų261%0.00512%0.123CC..Hα-helixtrans-84.9-21.2-175.1-86.9154.8000112.7L116 L161 L165 C200 M201 F204 G243 M244 I249 I250 L251L116-I247 HydrophobicContact CD1-CG1 4.22Å; L116-I247 HydrophobicContact CD2-CD1 4.27Å; L116-I247 HydrophobicContact CD2-CG1 4.14Å; L161-I247 HydrophobicContact CD1-CD1 4.06Å; L165-I247 HydrophobicContact CD2-CD1 4.48Å; C200-I247 HydrophobicContact CB-CG2 3.88Å; M201-I247 HydrophobicContact SD-CG2 4.34Å; F204-I247 HydrophobicContact CE2-CB 4.42Å; F204-I247 HydrophobicContact CE2-CD1 3.31Å; F204-I247 HydrophobicContact CE2-CG1 4.43Å; F204-I247 HydrophobicContact CZ-CD1 3.46Å; F204-I247 VanDerWaalsContact CZ-CD1 3.46Å; G243-I247 WeakPolarHBondContact O-CB 3.27Å; G243-I247 PolarHBondContact O-N 2.82Å; M244-I247 PolarHBondContact O-N 2.83Å; I247-I249 PolarHBondContact O-N 2.91Å; I247-I249 VanDerWaalsContact O-N 3.13Å; I247-I250 PolarHBondContact O-N 2.74Å; I247-L251 HydrophobicContact CG2-CD1 3.54Å; I247-L251 HydrophobicContact CG2-CG 3.95Å; I247-L251 PolarHBondContact O-N 3.05Å
248S90.5Very high92.8Very high9 Ų927.2 Ų27.26%0.06313%0.129CC..Hα-helixtrans-55.2-32.9176.459.50000113.2M244 I245 I250 L251 D252M244-S248 WeakPolarHBondContact O-CB 3.21Å; M244-S248 PolarHBondContact O-N 3.17Å; M244-S248 PolarHBondContact O-OG 2.89Å; I245-S248 PolarHBondContact O-OG 2.89Å; S248-I250 PolarHBondContact O-N 2.96Å; S248-L251 PolarHBondContact O-N 3.4Å; S248-D252 PolarHBondContact O-N 3.38Å
249I88.9Confident92.7Very high59 Ų5927.3 Ų27.330%0.30313%0.13SC..Hα-helixtrans-57.7-36.9178-56.6173.6000111.4T184 I247T184-I249 HydrophobicContact CG2-CG2 3.74Å; I247-I249 PolarHBondContact O-N 2.91Å; I247-I249 VanDerWaalsContact O-N 3.13Å
250I90.6Very high92.8Very high17 Ų1733.1 Ų33.19%0.08715%0.153CC..Hα-helixtrans-79.9-27.5-179.9-60.2159.5000111.3L116 I168 L180 L187 I247 S248L116-I250 HydrophobicContact CD1-CD1 3.58Å; I168-I250 HydrophobicContact CD1-CG2 4.23Å; L180-I250 HydrophobicContact CD1-CD1 3.98Å; L180-I250 HydrophobicContact CD1-CG1 4.4Å; L180-I250 HydrophobicContact CD2-CG1 4.39Å; L187-I250 VanDerWaalsContact CD1-O 3.25Å; L187-I250 WeakPolarHBondContact CD1-O 3.39Å; I247-I250 PolarHBondContact O-N 2.74Å; S248-I250 PolarHBondContact O-N 2.96Å
251L91.6Very high92.8Very high0 Ų036.9 Ų36.90%018%0.178CC..Hα-helixtrans-89.9-7.3-166.8-67.7-178.7000114.4L187 W197 C200 M201 I247 S248 L254 T255L187-L251 HydrophobicContact CD1-CD2 4.18Å; W197-L251 HydrophobicContact CB-CD2 4.27Å; W197-L251 HydrophobicContact CG-CD1 4.34Å; W197-L251 HydrophobicContact CG-CD2 4.32Å; C200-L251 HydrophobicContact CB-CD1 4.02Å; C200-L251 HydrophobicContact CB-CD2 4.09Å; M201-L251 HydrophobicContact CG-CD1 3.61Å; M201-L251 HydrophobicContact SD-CD1 3.53Å; M201-L251 VanDerWaalsContact SD-CD1 3.53Å; I247-L251 HydrophobicContact CG2-CD1 3.54Å; I247-L251 HydrophobicContact CG2-CG 3.95Å; I247-L251 PolarHBondContact O-N 3.05Å; S248-L251 PolarHBondContact O-N 3.4Å; L251-L254 WeakPolarHBondContact O-CB 3.45Å; L251-L254 PolarHBondContact O-N 3.41Å; L251-L254 VanDerWaalsContact O-N 3.14Å; L251-T255 HydrophobicContact CB-CG2 3.59Å; L251-T255 PolarHBondContact O-N 2.66Å
252D88.3Confident92.9Very high64 Ų6438 Ų3834%0.34218%0.183SC..THydrogen-bonded Turntrans-75.8142.9178.9-69.9-15.4000111.4L187 S248 T255 Q305L187-D252 PolarHBondContact N-O 3.09Å; S248-D252 PolarHBondContact O-N 3.38Å; D252-T255 WeakPolarHBondContact OD1-CG2 3.12Å; D252-T255 PolarHBondContact OD1-OG1 2.63Å; D252-Q305 VanDerWaalsContact OD1-CD 3.3Å; D252-Q305 PolarHBondContact OD1-NE2 3.44Å; D252-Q305 PolarHBondContact OD1-OE1 3.41Å
253P89.9Confident92.9Very high56 Ų5638.1 Ų38.136%0.36418%0.183SC..THydrogen-bonded Turncis-91.94.13.436.3-36.7000115.8T255 K256P253-T255 PolarHBondContact O-N 3.34Å; P253-K256 WeakPolarHBondContact O-CB 3.35Å; P253-K256 PolarHBondContact O-N 3.46Å; P253-K256 VanDerWaalsContact O-N 3.1Å
254L91.8Very high92.9Very high9 Ų943.6 Ų43.65%0.04721%0.212CC..THydrogen-bonded Turntrans-59-32.1-175.1-77170.6000114L187 N193 L251 K256 Y257 M258L187-L254 HydrophobicContact CB-CD1 3.36Å; L187-L254 HydrophobicContact CB-CG 3.93Å; L187-L254 HydrophobicContact CD1-CD1 3.93Å; L187-L254 HydrophobicContact CG-CD1 4.29Å; N193-L254 HydrophobicContact CB-CD1 3.42Å; N193-L254 VanDerWaalsContact CB-CD1 3.42Å; L251-L254 WeakPolarHBondContact O-CB 3.45Å; L251-L254 PolarHBondContact O-N 3.41Å; L251-L254 VanDerWaalsContact O-N 3.14Å; L254-K256 PolarHBondContact O-N 3.14Å; L254-K256 VanDerWaalsContact O-N 3.16Å; L254-Y257 PolarHBondContact O-N 3.16Å; L254-M258 PolarHBondContact O-N 3.14Å
255T91.9Very high93Very high3 Ų346.6 Ų46.62%0.01823%0.228CC..Hα-helixtrans-44.8-41172.347.20000112.5W197 L251 D252 P253 Y257 M258 A259 Q305W197-T255 VanDerWaalsContact NE1-CG2 3.29Å; L251-T255 HydrophobicContact CB-CG2 3.59Å; L251-T255 PolarHBondContact O-N 2.66Å; D252-T255 WeakPolarHBondContact OD1-CG2 3.12Å; D252-T255 PolarHBondContact OD1-OG1 2.63Å; P253-T255 PolarHBondContact O-N 3.34Å; T255-Y257 PolarHBondContact O-N 3.37Å; T255-Y257 VanDerWaalsContact O-N 3.17Å; T255-M258 PolarHBondContact O-N 2.86Å; T255-A259 WeakPolarHBondContact O-CB 3.31Å; T255-A259 PolarHBondContact O-N 3.36Å; T255-Q305 PolarHBondContact OG1-OE1 2.92Å
256K89.5Confident93.1Very high152 Ų15246.4 Ų46.466%0.66123%0.226SC*.Hα-helixtrans-58.7-31.5-178.6-64.7179.9-179.4176.70113.6P253 L254 Y260P253-K256 WeakPolarHBondContact O-CB 3.35Å; P253-K256 PolarHBondContact O-N 3.46Å; P253-K256 VanDerWaalsContact O-N 3.1Å; L254-K256 PolarHBondContact O-N 3.14Å; L254-K256 VanDerWaalsContact O-N 3.16Å; K256-Y260 WeakPolarHBondContact O-CE2 3.33Å
257Y91.5Very high93.3Very high157 Ų15746.1 Ų46.162%0.61623%0.226SC*.Hα-helixtrans-97.6-42.3176.8161.6-99.2000112L254 T255 A259 Y260L254-Y257 PolarHBondContact O-N 3.16Å; T255-Y257 PolarHBondContact O-N 3.37Å; T255-Y257 VanDerWaalsContact O-N 3.17Å; Y257-A259 VanDerWaalsContact C-N 3.28Å; Y257-A259 PolarHBondContact O-N 2.89Å; Y257-Y260 VanDerWaalsContact O-CD2 3.31Å; Y257-Y260 WeakPolarHBondContact O-CD2 3.38Å
258M94.9Very high93.6Very high27 Ų2752.8 Ų52.813%0.13325%0.251CS..Hα-helixtrans-73.1-20.5-175.1-68.1-63.3-72.800113.3N194 W197 L254 T255 Y260 P261 F262N194-M258 HydrophobicContact CB-CE 4Å; N194-M258 HydrophobicContact CB-SD 4.13Å; W197-M258 HydrophobicContact CD2-CB 3.56Å; W197-M258 HydrophobicContact CD2-CG 4.06Å; W197-M258 HydrophobicContact CE3-CB 3.71Å; W197-M258 HydrophobicContact CE3-CE 3.87Å; W197-M258 HydrophobicContact CE3-CG 4.25Å; W197-M258 HydrophobicContact CG-CB 4.16Å; W197-M258 HydrophobicContact CG-CG 4.21Å; W197-M258 HydrophobicContact CH2-CB 3.98Å; W197-M258 HydrophobicContact CZ2-CB 3.81Å; W197-M258 HydrophobicContact CZ3-CB 3.94Å; W197-M258 HydrophobicContact CZ3-CE 4.42Å; L254-M258 PolarHBondContact O-N 3.14Å; T255-M258 PolarHBondContact O-N 2.86Å; M258-Y260 PolarHBondContact O-N 3.04Å; M258-P261 WeakPolarHBondContact O-CD 3.39Å; M258-F262 WeakPolarHBondContact O-CD2 3.37Å
259A95.2Very high93.9Very high3 Ų352.4 Ų52.43%0.02525%0.249CC..THydrogen-bonded Turntrans-70.2-26.8-177.600000114.6T255 Y257 F262 I263 M303T255-A259 WeakPolarHBondContact O-CB 3.31Å; T255-A259 PolarHBondContact O-N 3.36Å; Y257-A259 VanDerWaalsContact C-N 3.28Å; Y257-A259 PolarHBondContact O-N 2.89Å; A259-F262 PolarHBondContact O-N 3.37Å; A259-I263 HydrophobicContact CB-CD1 3.84Å; A259-I263 HydrophobicContact CB-CG1 4.32Å; A259-I263 WeakPolarHBondContact O-CG1 3.45Å; A259-I263 PolarHBondContact O-N 2.96Å; A259-M303 HydrophobicContact CB-CB 4.05Å; A259-M303 HydrophobicContact CB-SD 4.31Å
260Y95.4Very high94.2Very high121 Ų12149.6 Ų49.648%0.47523%0.234SC..Hα-helixtrans-52.3-49.2-170.5-75.6-79000114.5K256 Y257 M258 F262 I263 L264 W389K256-Y260 WeakPolarHBondContact O-CE2 3.33Å; Y257-Y260 VanDerWaalsContact O-CD2 3.31Å; Y257-Y260 WeakPolarHBondContact O-CD2 3.38Å; M258-Y260 PolarHBondContact O-N 3.04Å; Y260-F262 VanDerWaalsContact C-N 3.29Å; Y260-F262 PolarHBondContact O-N 3.5Å; Y260-I263 PolarHBondContact O-N 3.09Å; Y260-L264 WeakPolarHBondContact O-CG 3.42Å; Y260-L264 PolarHBondContact O-N 3.47Å; Y260-W389 HydrophobicContact CD1-CH2 4.19Å; Y260-W389 AromaticContact CD1-CZ2 3.76Å; Y260-W389 HydrophobicContact CD1-CZ2 3.76Å; Y260-W389 HydrophobicContact CE1-CH2 4.18Å; Y260-W389 AromaticContact CE1-CZ2 3.5Å; Y260-W389 HydrophobicContact CE1-CZ2 3.5Å
261P96.4Very high94.6Very high80 Ų8049.7 Ų49.752%0.51924%0.235SC..Hα-helixtrans-61.8-38.4-179.8-2234.5000112.4M258 L264 L265M258-P261 WeakPolarHBondContact O-CD 3.39Å; P261-L264 PolarHBondContact O-N 2.92Å; P261-L265 VanDerWaalsContact O-CB 3.3Å; P261-L265 WeakPolarHBondContact O-CB 2.84Å; P261-L265 PolarHBondContact O-N 3.07Å
262F96.8Very high94.9Very high24 Ų2452.5 Ų52.511%0.10525%0.248CC..Hα-helixtrans-74-37.6-178.4-61.1-76.2000112W197 M202 L205 L210 M258 A259 Y260 L265 S266 M303W197-F262 AromaticContact CH2-CD2 3.55Å; W197-F262 HydrophobicContact CH2-CD2 3.55Å; W197-F262 AromaticContact CH2-CE2 3.58Å; W197-F262 HydrophobicContact CH2-CE2 3.58Å; W197-F262 AromaticContact CZ3-CD2 3.87Å; W197-F262 HydrophobicContact CZ3-CD2 3.87Å; W197-F262 AromaticContact CZ3-CE2 3.36Å; W197-F262 HydrophobicContact CZ3-CE2 3.36Å; W197-F262 HydrophobicContact CZ3-CZ 4.12Å; M202-F262 HydrophobicContact CE-CE1 4.14Å; M202-F262 HydrophobicContact CE-CZ 3.98Å; M202-F262 HydrophobicContact SD-CE1 4.4Å; L205-F262 HydrophobicContact CD1-CD1 3.49Å; L205-F262 VanDerWaalsContact CD1-CD1 3.49Å; L205-F262 HydrophobicContact CD1-CE1 3.52Å; L205-F262 HydrophobicContact CD1-CG 4.08Å; L205-F262 HydrophobicContact CD1-CZ 4.16Å; L210-F262 HydrophobicContact CD1-CD1 4.46Å; L210-F262 HydrophobicContact CD2-CD1 3.56Å; L210-F262 HydrophobicContact CD2-CE1 3.89Å; M258-F262 WeakPolarHBondContact O-CD2 3.37Å; A259-F262 PolarHBondContact O-N 3.37Å; Y260-F262 VanDerWaalsContact C-N 3.29Å; Y260-F262 PolarHBondContact O-N 3.5Å; F262-L265 PolarHBondContact O-N 3.49Å; F262-S266 VanDerWaalsContact O-CB 3.32Å; F262-S266 WeakPolarHBondContact O-CB 3.37Å; F262-S266 PolarHBondContact O-N 2.96Å; F262-S266 PolarHBondContact O-OG 3.19Å; F262-M303 HydrophobicContact CB-CE 4.07Å; F262-M303 HydrophobicContact CG-CE 4.36Å
263I96.7Very high95.3Very high3 Ų349.5 Ų49.52%0.01523%0.232CC..Hα-helixtrans-60.3-50.5171.8-66.9169.6000109.3A259 Y260 L265 S266 L267 M303 I304 W389A259-I263 HydrophobicContact CB-CD1 3.84Å; A259-I263 HydrophobicContact CB-CG1 4.32Å; A259-I263 WeakPolarHBondContact O-CG1 3.45Å; A259-I263 PolarHBondContact O-N 2.96Å; Y260-I263 PolarHBondContact O-N 3.09Å; I263-L265 PolarHBondContact O-N 3.41Å; I263-S266 WeakPolarHBondContact CA-OG 3.46Å; I263-S266 PolarHBondContact O-N 3.49Å; I263-S266 PolarHBondContact O-OG 3.42Å; I263-L267 HydrophobicContact CG2-CD1 3.72Å; I263-L267 HydrophobicContact CG2-CG 4.2Å; I263-L267 WeakPolarHBondContact O-CG 3Å; I263-L267 PolarHBondContact O-N 3.02Å; I263-M303 HydrophobicContact CD1-CB 4.05Å; I263-M303 HydrophobicContact CG1-CB 3.75Å; I263-M303 HydrophobicContact CG1-CG 4.47Å; I263-I304 HydrophobicContact CD1-CG1 4.04Å; I263-W389 HydrophobicContact CD1-CZ2 4Å; I263-W389 HydrophobicContact CG2-CH2 3.97Å; I263-W389 HydrophobicContact CG2-CZ2 4.5Å; I263-W389 HydrophobicContact CG2-CZ3 4.1Å
264L96.3Very high95.7Very high114 Ų11446.8 Ų46.860%0.59722%0.215SC*.Hα-helixtrans-58.6-45.8178.3-71.5170.8000112.3Y260 P261 S266 L267 W268Y260-L264 WeakPolarHBondContact O-CG 3.42Å; Y260-L264 PolarHBondContact O-N 3.47Å; P261-L264 PolarHBondContact O-N 2.92Å; L264-S266 VanDerWaalsContact C-N 3.3Å; L264-S266 PolarHBondContact O-N 3.45Å; L264-L267 PolarHBondContact O-N 2.88Å; L264-W268 WeakPolarHBondContact O-CB 3.38Å; L264-W268 PolarHBondContact O-N 3.18Å
265L97.2Very high95.9Very high64 Ų6448.1 Ų48.134%0.33523%0.225SC..Hα-helixtrans-65.1-35.3179.6-162.372.3000111.9L210 Y211 P261 F262 I263 G269L210-L265 HydrophobicContact CD1-CB 4.39Å; L210-L265 HydrophobicContact CD1-CD2 4Å; L210-L265 HydrophobicContact CD1-CG 4.45Å; L210-L265 HydrophobicContact CD2-CD2 3.62Å; L210-L265 HydrophobicContact CG-CD2 3.64Å; L210-L265 HydrophobicContact CG-CG 4.46Å; Y211-L265 WeakPolarHBondContact CB-O 3.3Å; Y211-L265 HydrophobicContact CD1-CD1 3.98Å; Y211-L265 HydrophobicContact CD1-CG 4.28Å; Y211-L265 WeakPolarHBondContact O-CD2 3.22Å; P261-L265 VanDerWaalsContact O-CB 3.3Å; P261-L265 WeakPolarHBondContact O-CB 2.84Å; P261-L265 PolarHBondContact O-N 3.07Å; F262-L265 PolarHBondContact O-N 3.49Å; I263-L265 PolarHBondContact O-N 3.41Å; L265-G269 VanDerWaalsContact O-CA 3.27Å; L265-G269 WeakPolarHBondContact O-CA 3.47Å; L265-G269 PolarHBondContact O-N 3.3Å
266S96.9Very high96.2Very high1 Ų149.8 Ų49.81%0.00723%0.233CC..Hα-helixtrans-71.8-44.1175.769.80000112.7F262 I263 L264 G269 M270 A300F262-S266 VanDerWaalsContact O-CB 3.32Å; F262-S266 WeakPolarHBondContact O-CB 3.37Å; F262-S266 PolarHBondContact O-N 2.96Å; F262-S266 PolarHBondContact O-OG 3.19Å; I263-S266 WeakPolarHBondContact CA-OG 3.46Å; I263-S266 PolarHBondContact O-N 3.49Å; I263-S266 PolarHBondContact O-OG 3.42Å; L264-S266 VanDerWaalsContact C-N 3.3Å; L264-S266 PolarHBondContact O-N 3.45Å; S266-G269 PolarHBondContact O-N 3.49Å; S266-M270 PolarHBondContact O-N 3.34Å; S266-A300 WeakPolarHBondContact OG-CB 3.34Å
267L96.9Very high96.6Very high5 Ų542.6 Ų42.63%0.02620%0.202CC..Hα-helixtrans-69-37.4179.4-68.4175.4000112.4I263 L264 M270 A300 L386 T393 L396 M397I263-L267 HydrophobicContact CG2-CD1 3.72Å; I263-L267 HydrophobicContact CG2-CG 4.2Å; I263-L267 WeakPolarHBondContact O-CG 3Å; I263-L267 PolarHBondContact O-N 3.02Å; L264-L267 PolarHBondContact O-N 2.88Å; L267-M270 HydrophobicContact CB-CE 4.19Å; L267-M270 HydrophobicContact CD2-CE 3.63Å; L267-M270 HydrophobicContact CD2-SD 4.26Å; L267-M270 WeakPolarHBondContact O-CE 3.25Å; L267-M270 WeakPolarHBondContact O-CG 3.43Å; L267-A300 HydrophobicContact CD2-CB 4.26Å; L267-L386 HydrophobicContact CD2-CD1 4.14Å; L267-L386 HydrophobicContact CD2-CD2 4.19Å; L267-T393 HydrophobicContact CD1-CG2 3.92Å; L267-L396 HydrophobicContact CB-CD1 4.03Å; L267-L396 HydrophobicContact CD1-CD1 4.28Å; L267-M397 HydrophobicContact CD2-SD 4.29Å
268W97.8Very high96.9Very high141 Ų14137.7 Ų37.753%0.53419%0.186SC..Hα-helixtrans-72.1-41.7170.8-173.2-111.9000111.2L264 M270 I271 M272L264-W268 WeakPolarHBondContact O-CB 3.38Å; L264-W268 PolarHBondContact O-N 3.18Å; W268-M270 PolarHBondContact O-N 2.73Å; W268-I271 PolarHBondContact O-N 3.44Å; W268-M272 HydrophobicContact CD2-CG 4.29Å; W268-M272 HydrophobicContact CG-CG 4.29Å; W268-M272 HydrophobicContact CZ2-CG 4.27Å; W268-M272 HydrophobicContact CZ2-SD 3.73Å; W268-M272 WeakPolarHBondContact O-CG 3.46Å; W268-M272 PolarHBondContact O-N 2.83Å
269G96.9Very high97Very high1 Ų146.1 Ų46.11%0.0122%0.216CC..Hα-helixtrans-59.5-39-179.900000114.1Y211 L265 S266 I271 M272 T273Y211-G269 VanDerWaalsContact CG-CA 3.41Å; L265-G269 VanDerWaalsContact O-CA 3.27Å; L265-G269 WeakPolarHBondContact O-CA 3.47Å; L265-G269 PolarHBondContact O-N 3.3Å; S266-G269 PolarHBondContact O-N 3.49Å; G269-I271 VanDerWaalsContact C-N 3.33Å; G269-I271 PolarHBondContact O-N 3.13Å; G269-M272 PolarHBondContact O-N 3.32Å; G269-T273 WeakPolarHBondContact O-CB 3.31Å; G269-T273 VanDerWaalsContact O-CG2 3.32Å; G269-T273 WeakPolarHBondContact O-CG2 3.38Å; G269-T273 PolarHBondContact O-N 3.43Å; G269-T273 PolarHBondContact O-OG1 3.44Å
270M96.5Very high97Very high0 Ų047.7 Ų47.70%022%0.223CC..Hα-helixtrans-62.7-39.2176.765.7177.8-178.600111.8S266 L267 W268 T273 S274 A296 L297 L396 M397 N400S266-M270 PolarHBondContact O-N 3.34Å; L267-M270 HydrophobicContact CB-CE 4.19Å; L267-M270 HydrophobicContact CD2-CE 3.63Å; L267-M270 HydrophobicContact CD2-SD 4.26Å; L267-M270 WeakPolarHBondContact O-CE 3.25Å; L267-M270 WeakPolarHBondContact O-CG 3.43Å; W268-M270 PolarHBondContact O-N 2.73Å; M270-T273 PolarHBondContact O-OG1 3.42Å; M270-S274 WeakPolarHBondContact O-CB 3.43Å; M270-S274 PolarHBondContact O-N 2.96Å; M270-S274 PolarHBondContact O-OG 3.06Å; M270-A296 HydrophobicContact CB-CB 4.03Å; M270-L297 HydrophobicContact SD-CD2 3.51Å; M270-L297 VanDerWaalsContact SD-CD2 3.51Å; M270-L297 HydrophobicContact SD-CG 4.22Å; M270-L396 HydrophobicContact CE-CB 3.84Å; M270-M397 HydrophobicContact CE-SD 3.64Å; M270-M397 HydrophobicContact SD-SD 3.9Å; M270-N400 HydrophobicContact CE-CB 4.24Å; M270-N400 HydrophobicContact CG-CB 4.36Å; M270-N400 HydrophobicContact SD-CB 4.05Å
271I97.9Very high97.1Very high19 Ų1945.9 Ų45.910%0.09723%0.225CC..Hα-helixtrans-70.3-45.6177.6-61.7174.8000110W268 G269 S274 S275 L396 I399 I403W268-I271 PolarHBondContact O-N 3.44Å; G269-I271 VanDerWaalsContact C-N 3.33Å; G269-I271 PolarHBondContact O-N 3.13Å; I271-S274 WeakPolarHBondContact CA-OG 3.43Å; I271-S274 PolarHBondContact O-OG 2.91Å; I271-S275 WeakPolarHBondContact O-CB 3.23Å; I271-S275 PolarHBondContact O-N 2.71Å; I271-S275 PolarHBondContact O-OG 3.2Å; I271-L396 HydrophobicContact CD1-CB 4.1Å; I271-L396 HydrophobicContact CD1-CD2 3.53Å; I271-L396 HydrophobicContact CD1-CG 4.41Å; I271-I399 HydrophobicContact CD1-CG2 4.29Å; I271-I399 HydrophobicContact CG1-CG2 4.43Å; I271-I399 HydrophobicContact CG2-CG2 4.25Å; I271-I403 HydrophobicContact CG2-CD1 3.98Å
272M97.9Very high97.1Very high59 Ų5944.1 Ų44.129%0.29121%0.211SC..Hα-helixtrans-65.2-45.3-179.1-66.9-55.9-6700111.7Y211 W268 G269 S275 I276Y211-M272 HydrophobicContact CE2-CB 3.81Å; W268-M272 HydrophobicContact CD2-CG 4.29Å; W268-M272 HydrophobicContact CG-CG 4.29Å; W268-M272 HydrophobicContact CZ2-CG 4.27Å; W268-M272 HydrophobicContact CZ2-SD 3.73Å; W268-M272 WeakPolarHBondContact O-CG 3.46Å; W268-M272 PolarHBondContact O-N 2.83Å; G269-M272 PolarHBondContact O-N 3.32Å; M272-S275 PolarHBondContact O-N 2.93Å; M272-S275 PolarHBondContact O-OG 3.02Å; M272-I276 VanDerWaalsContact O-CG1 3.29Å; M272-I276 WeakPolarHBondContact O-CG1 3.36Å; M272-I276 PolarHBondContact O-N 3.46Å
273T97.4Very high97Very high0 Ų043.4 Ų43.40%021%0.208CC..Hα-helixtrans-69.2-36.6179.553.40000112.8Y211 G269 M270 I276 C277 Y289 V292 S293Y211-T273 HydrophobicContact CD2-CG2 3.87Å; Y211-T273 HydrophobicContact CE2-CG2 4.18Å; G269-T273 WeakPolarHBondContact O-CB 3.31Å; G269-T273 VanDerWaalsContact O-CG2 3.32Å; G269-T273 WeakPolarHBondContact O-CG2 3.38Å; G269-T273 PolarHBondContact O-N 3.43Å; G269-T273 PolarHBondContact O-OG1 3.44Å; M270-T273 PolarHBondContact O-OG1 3.42Å; T273-I276 WeakPolarHBondContact O-CB 3.32Å; T273-I276 PolarHBondContact O-N 3.33Å; T273-C277 PolarHBondContact O-N 2.86Å; T273-C277 VanDerWaalsContact O-N 3.11Å; T273-C277 PolarHBondContact O-SG 3.2Å; T273-Y289 HydrophobicContact CG2-CD1 4.42Å; T273-V292 HydrophobicContact CG2-CB 4.2Å; T273-V292 HydrophobicContact CG2-CG1 3.77Å; T273-S293 WeakPolarHBondContact OG1-CA 3.38Å; T273-S293 WeakPolarHBondContact OG1-CB 3.25Å
274S97Very high97Very high0 Ų043.9 Ų43.90%021%0.21CC..Hα-helixtrans-66.6-37.8172.260.70000112M270 I271 I276 C277 L278 I403M270-S274 WeakPolarHBondContact O-CB 3.43Å; M270-S274 PolarHBondContact O-N 2.96Å; M270-S274 PolarHBondContact O-OG 3.06Å; I271-S274 WeakPolarHBondContact CA-OG 3.43Å; I271-S274 PolarHBondContact O-OG 2.91Å; S274-I276 VanDerWaalsContact C-N 3.33Å; S274-I276 PolarHBondContact O-N 3.21Å; S274-C277 VanDerWaalsContact O-CB 3.27Å; S274-C277 WeakPolarHBondContact O-CB 3.15Å; S274-C277 PolarHBondContact O-N 3.41Å; S274-C277 VanDerWaalsContact O-N 3.14Å; S274-L278 PolarHBondContact O-N 2.78Å; S274-I403 WeakPolarHBondContact OG-CG2 3.25Å
275S97.6Very high97Very high36 Ų3638.9 Ų38.925%0.25219%0.185SC..Hα-helixtrans-66.2-34.2173.178.10000112.8I271 M272 C277 L278I271-S275 WeakPolarHBondContact O-CB 3.23Å; I271-S275 PolarHBondContact O-N 2.71Å; I271-S275 PolarHBondContact O-OG 3.2Å; M272-S275 PolarHBondContact O-N 2.93Å; M272-S275 PolarHBondContact O-OG 3.02Å; S275-C277 VanDerWaalsContact C-N 3.29Å; S275-C277 PolarHBondContact O-N 2.93Å; S275-L278 PolarHBondContact O-N 2.98Å
276I97.9Very high97Very high39 Ų3935.8 Ų35.820%0.217%0.169CC..Hα-helixtrans-60.7-41.7171.9-72.4165.7000109.6M272 T273 S274 L278 R279 Q280 Y289M272-I276 VanDerWaalsContact O-CG1 3.29Å; M272-I276 WeakPolarHBondContact O-CG1 3.36Å; M272-I276 PolarHBondContact O-N 3.46Å; T273-I276 WeakPolarHBondContact O-CB 3.32Å; T273-I276 PolarHBondContact O-N 3.33Å; S274-I276 VanDerWaalsContact C-N 3.33Å; S274-I276 PolarHBondContact O-N 3.21Å; I276-L278 PolarHBondContact O-N 2.91Å; I276-R279 PolarHBondContact O-N 3.48Å; I276-Q280 HydrophobicContact CG2-CG 4.16Å; I276-Q280 WeakPolarHBondContact O-CG 3.41Å; I276-Q280 PolarHBondContact O-N 3.06Å; I276-Y289 HydrophobicContact CD1-CE1 4.28Å; I276-Y289 HydrophobicContact CG2-CD1 3.98Å; I276-Y289 HydrophobicContact CG2-CD2 3.85Å; I276-Y289 HydrophobicContact CG2-CE1 4.07Å; I276-Y289 HydrophobicContact CG2-CE2 3.96Å; I276-Y289 HydrophobicContact CG2-CG 3.87Å
277C97.6Very high97Very high0 Ų035.8 Ų35.80%017%0.168CC..Hα-helixtrans-56.8-34.9179.1-63.40000113.2T273 S274 S275 R279 Q280 L286 Y289 S290 Y407T273-C277 PolarHBondContact O-N 2.86Å; T273-C277 VanDerWaalsContact O-N 3.11Å; T273-C277 PolarHBondContact O-SG 3.2Å; S274-C277 VanDerWaalsContact O-CB 3.27Å; S274-C277 WeakPolarHBondContact O-CB 3.15Å; S274-C277 PolarHBondContact O-N 3.41Å; S274-C277 VanDerWaalsContact O-N 3.14Å; S275-C277 VanDerWaalsContact C-N 3.29Å; S275-C277 PolarHBondContact O-N 2.93Å; C277-R279 PolarHBondContact O-N 3.35Å; C277-Q280 PolarHBondContact O-N 2.67Å; C277-L286 HydrophobicContact CB-CD2 4.36Å; C277-L286 HydrophobicContact CB-CG 4.11Å; C277-L286 WeakPolarHBondContact O-CD1 3.46Å; C277-Y289 WeakPolarHBondContact SG-CB 3.35Å; C277-S290 PolarHBondContact SG-N 3.22Å; C277-S290 VanDerWaalsContact SG-N 3.43Å; C277-Y407 HydrophobicContact CB-CD1 3.78Å; C277-Y407 HydrophobicContact CB-CD2 4.13Å; C277-Y407 HydrophobicContact CB-CE1 4.39Å; C277-Y407 HydrophobicContact CB-CG 3.67Å
278L96.8Very high97Very high54 Ų5435.5 Ų35.528%0.28317%0.167SC..THydrogen-bonded Turntrans-63.8-22.2177.7-68173.6000113.7S274 S275 I276 I403 M406S274-L278 PolarHBondContact O-N 2.78Å; S275-L278 PolarHBondContact O-N 2.98Å; I276-L278 PolarHBondContact O-N 2.91Å; L278-I403 HydrophobicContact CD1-CG2 4Å; L278-I403 HydrophobicContact CG-CG2 4.33Å; L278-M406 HydrophobicContact CD2-CB 3.79Å
279R97Very high97Very high204 Ų20430.6 Ų30.677%0.7715%0.149SC*.THydrogen-bonded Turntrans-111.83.8-177-60.3-166.6-63.4-163-0.4113.5I276 C277 T281I276-R279 PolarHBondContact O-N 3.48Å; C277-R279 PolarHBondContact O-N 3.35Å; R279-T281 PolarHBondContact O-N 3.42Å
280Q96.9Very high97Very high37 Ų3730.5 Ų30.517%0.17315%0.148CC..  trans-72.2128.5179.7-75.1-59.5-27.500110.9I276 C277 S285 L286 Y289 M343I276-Q280 HydrophobicContact CG2-CG 4.16Å; I276-Q280 WeakPolarHBondContact O-CG 3.41Å; I276-Q280 PolarHBondContact O-N 3.06Å; C277-Q280 PolarHBondContact O-N 2.67Å; Q280-S285 PolarHBondContact OE1-OG 3.49Å; Q280-L286 HydrophobicContact CB-CB 3.79Å; Q280-L286 HydrophobicContact CB-CD1 4.14Å; Q280-L286 HydrophobicContact CB-CG 4.11Å; Q280-L286 HydrophobicContact CG-CB 4.33Å; Q280-Y289 HydrophobicContact CG-CD2 4.1Å; Q280-M343 WeakPolarHBondContact O-CE 3.23Å
281T96.3Very high97Very high82 Ų8230.5 Ų30.550%0.50315%0.148SC..  trans-84.8-31.8173.151.10000112R279 M343R279-T281 PolarHBondContact O-N 3.42Å; T281-M343 WeakPolarHBondContact O-CB 3.5Å; T281-M343 PolarHBondContact O-N 3.02Å
282D96.1Very high97Very high44 Ų4429.7 Ų29.724%0.23514%0.144CC..BIsolated β-bridgetrans-88.6126.4-179.3-80.6-22.8000111S285 L286D282-S285 VanDerWaalsContact CB-OG 3.26Å; D282-S285 WeakPolarHBondContact CB-OG 3.26Å; D282-S285 PolarHBondContact O-N 3.31Å; D282-S285 PolarHBondContact O-OG 2.89Å; D282-L286 PolarHBondContact O-N 3.48Å
283L95.7Very high96.9Very high9 Ų926.9 Ų26.95%0.04713%0.13CC..Hα-helixtrans-70.9-38.8-174.2-172.6143.8000112.2L286 I287 A331 R341 M343 W360 T415L283-L286 PolarHBondContact O-N 3.23Å; L283-I287 HydrophobicContact CD2-CD1 3.67Å; L283-I287 WeakPolarHBondContact O-CG1 3.38Å; L283-I287 PolarHBondContact O-N 2.94Å; L283-A331 HydrophobicContact CD2-CB 3.1Å; L283-R341 PolarHBondContact N-O 3.08Å; L283-M343 HydrophobicContact CB-CB 4.27Å; L283-M343 HydrophobicContact CD1-CG 4.23Å; L283-M343 HydrophobicContact CD1-SD 4.45Å; L283-W360 HydrophobicContact CD1-CH2 3.74Å; L283-W360 HydrophobicContact CD1-CZ3 4.43Å; L283-W360 HydrophobicContact CD2-CH2 3.99Å; L283-W360 HydrophobicContact CG-CH2 4.42Å; L283-T415 HydrophobicContact CD1-CG2 3.35Å
284K96Very high96.9Very high13 Ų1327 Ų276%0.05713%0.131CC..Hα-helixtrans-66.6-36175.3-77.8-167.1178.8-175.30112.2V222 A224 I287 A288 F328 A331V222-K284 HydrophobicContact CG2-CB 4.01Å; A224-K284 PolarHBondContact O-NZ 3.33Å; K284-I287 PolarHBondContact O-N 2.87Å; K284-A288 WeakPolarHBondContact O-CB 3.42Å; K284-A288 PolarHBondContact O-N 3.48Å; K284-F328 HydrophobicContact CB-CE1 4.41Å; K284-F328 HydrophobicContact CG-CD1 4.41Å; K284-A331 HydrophobicContact CG-CB 4.15Å
285S96.2Very high96.9Very high8 Ų827 Ų276%0.05613%0.131CC..Hα-helixtrans-70.8-38.217871.40000110.5Q280 D282 I287 A288 Y289Q280-S285 PolarHBondContact OE1-OG 3.49Å; D282-S285 VanDerWaalsContact CB-OG 3.26Å; D282-S285 WeakPolarHBondContact CB-OG 3.26Å; D282-S285 PolarHBondContact O-N 3.31Å; D282-S285 PolarHBondContact O-OG 2.89Å; S285-I287 VanDerWaalsContact C-N 3.32Å; S285-I287 PolarHBondContact O-N 3.23Å; S285-A288 WeakPolarHBondContact O-CB 3.3Å; S285-A288 PolarHBondContact O-N 3.42Å; S285-A288 VanDerWaalsContact O-N 3.12Å; S285-Y289 VanDerWaalsContact O-CD2 3.23Å; S285-Y289 WeakPolarHBondContact O-CD2 3.42Å; S285-Y289 PolarHBondContact O-N 2.61Å
286L97.6Very high96.9Very high0 Ų025.4 Ų25.40%012%0.12CC..Hα-helixtrans-56.2-47.5173.6-164.8157.1000110.8C277 Q280 D282 L283 A288 Y289 S290 M343 Y407 Y410 M411C277-L286 HydrophobicContact CB-CD2 4.36Å; C277-L286 HydrophobicContact CB-CG 4.11Å; C277-L286 WeakPolarHBondContact O-CD1 3.46Å; Q280-L286 HydrophobicContact CB-CB 3.79Å; Q280-L286 HydrophobicContact CB-CD1 4.14Å; Q280-L286 HydrophobicContact CB-CG 4.11Å; Q280-L286 HydrophobicContact CG-CB 4.33Å; D282-L286 PolarHBondContact O-N 3.48Å; L283-L286 PolarHBondContact O-N 3.23Å; L286-A288 VanDerWaalsContact C-N 3.35Å; L286-A288 PolarHBondContact O-N 3.38Å; L286-Y289 PolarHBondContact O-N 2.99Å; L286-S290 PolarHBondContact O-N 3.47Å; L286-M343 HydrophobicContact CD1-CE 3.74Å; L286-M343 HydrophobicContact CD1-SD 4.1Å; L286-Y407 HydrophobicContact CD2-CD2 4.18Å; L286-Y410 HydrophobicContact CD1-CD1 4.39Å; L286-M411 HydrophobicContact CD2-CE 3.27Å
287I97.6Very high96.9Very high0 Ų023.8 Ų23.80%011%0.112CC..Hα-helixtrans-63.7-41.5176.5-58.9160.6000110.8L283 K284 S285 S290 S291 L327 F328 A331 M411L283-I287 HydrophobicContact CD2-CD1 3.67Å; L283-I287 WeakPolarHBondContact O-CG1 3.38Å; L283-I287 PolarHBondContact O-N 2.94Å; K284-I287 PolarHBondContact O-N 2.87Å; S285-I287 VanDerWaalsContact C-N 3.32Å; S285-I287 PolarHBondContact O-N 3.23Å; I287-S290 WeakPolarHBondContact CA-OG 3.39Å; I287-S290 PolarHBondContact O-N 3.22Å; I287-S290 PolarHBondContact O-OG 3.27Å; I287-S291 PolarHBondContact O-N 3.29Å; I287-L327 HydrophobicContact CD1-CB 3.91Å; I287-L327 WeakPolarHBondContact CD1-O 3.31Å; I287-L327 HydrophobicContact CG1-CB 4.1Å; I287-L327 HydrophobicContact CG2-CB 3.95Å; I287-L327 HydrophobicContact CG2-CD1 4.49Å; I287-F328 HydrophobicContact CB-CD1 4.44Å; I287-F328 HydrophobicContact CB-CE1 3.97Å; I287-F328 HydrophobicContact CB-CE2 4.4Å; I287-F328 HydrophobicContact CB-CZ 3.94Å; I287-F328 HydrophobicContact CD1-CD1 4.37Å; I287-F328 HydrophobicContact CG2-CD1 4.21Å; I287-F328 HydrophobicContact CG2-CD2 3.84Å; I287-F328 HydrophobicContact CG2-CE1 3.92Å; I287-F328 HydrophobicContact CG2-CE2 3.5Å; I287-F328 HydrophobicContact CG2-CG 4.17Å; I287-F328 HydrophobicContact CG2-CZ 3.54Å; I287-A331 HydrophobicContact CD1-CB 3.85Å; I287-M411 HydrophobicContact CG1-CE 4.06Å
288A96.6Very high96.9Very high0 Ų023.8 Ų23.80%011%0.112CC..Hα-helixtrans-60.1-47.3176.500000112.4L217 H221 K284 S285 L286 S290 S291 V292 F328L217-A288 HydrophobicContact CD2-CB 3.68Å; L217-A288 WeakPolarHBondContact CD2-O 3.06Å; H221-A288 HydrophobicContact CB-CB 4.01Å; K284-A288 WeakPolarHBondContact O-CB 3.42Å; K284-A288 PolarHBondContact O-N 3.48Å; S285-A288 WeakPolarHBondContact O-CB 3.3Å; S285-A288 PolarHBondContact O-N 3.42Å; S285-A288 VanDerWaalsContact O-N 3.12Å; L286-A288 VanDerWaalsContact C-N 3.35Å; L286-A288 PolarHBondContact O-N 3.38Å; A288-S290 VanDerWaalsContact C-N 3.34Å; A288-S290 PolarHBondContact O-N 3.05Å; A288-S291 WeakPolarHBondContact O-CB 3.29Å; A288-S291 PolarHBondContact O-N 3Å; A288-S291 VanDerWaalsContact O-N 3.12Å; A288-S291 PolarHBondContact O-OG 3.42Å; A288-V292 PolarHBondContact O-N 3.18Å; A288-F328 HydrophobicContact CB-CZ 4.43Å
289Y97.8Very high96.9Very high37 Ų3721.2 Ų21.215%0.14510%0.098CC..Hα-helixtrans-65.9-35.2176.1-79-71.9000112.6P218 T273 I276 C277 Q280 S285 L286 S291 V292 S293P218-Y289 HydrophobicContact CB-CE2 3.91Å; P218-Y289 HydrophobicContact CG-CD1 4.19Å; P218-Y289 HydrophobicContact CG-CD2 4.3Å; P218-Y289 HydrophobicContact CG-CE1 3.69Å; P218-Y289 HydrophobicContact CG-CE2 3.79Å; P218-Y289 HydrophobicContact CG-CG 4.48Å; P218-Y289 VanDerWaalsContact CG-CZ 3.46Å; T273-Y289 HydrophobicContact CG2-CD1 4.42Å; I276-Y289 HydrophobicContact CD1-CE1 4.28Å; I276-Y289 HydrophobicContact CG2-CD1 3.98Å; I276-Y289 HydrophobicContact CG2-CD2 3.85Å; I276-Y289 HydrophobicContact CG2-CE1 4.07Å; I276-Y289 HydrophobicContact CG2-CE2 3.96Å; I276-Y289 HydrophobicContact CG2-CG 3.87Å; C277-Y289 WeakPolarHBondContact SG-CB 3.35Å; Q280-Y289 HydrophobicContact CG-CD2 4.1Å; S285-Y289 VanDerWaalsContact O-CD2 3.23Å; S285-Y289 WeakPolarHBondContact O-CD2 3.42Å; S285-Y289 PolarHBondContact O-N 2.61Å; L286-Y289 PolarHBondContact O-N 2.99Å; Y289-S291 PolarHBondContact O-N 3.47Å; Y289-V292 WeakPolarHBondContact O-CB 3.34Å; Y289-V292 PolarHBondContact O-N 3.43Å; Y289-V292 VanDerWaalsContact O-N 3.1Å; Y289-S293 PolarHBondContact O-N 3.01Å
290S97Very high96.9Very high0 Ų011.5 Ų11.50%06%0.061CC..Hα-helixtrans-63.1-32.1172.7770000112.2C277 L286 I287 A288 S293 H294C277-S290 PolarHBondContact SG-N 3.22Å; C277-S290 VanDerWaalsContact SG-N 3.43Å; L286-S290 PolarHBondContact O-N 3.47Å; I287-S290 WeakPolarHBondContact CA-OG 3.39Å; I287-S290 PolarHBondContact O-N 3.22Å; I287-S290 PolarHBondContact O-OG 3.27Å; A288-S290 VanDerWaalsContact C-N 3.34Å; A288-S290 PolarHBondContact O-N 3.05Å; S290-S293 WeakPolarHBondContact CA-OG 3.38Å; S290-S293 PolarHBondContact O-N 3.12Å; S290-S293 PolarHBondContact O-OG 2.87Å; S290-H294 PolarHBondContact O-CD2 3.5Å; S290-H294 PolarHBondContact O-N 3.37Å
291S96.4Very high96.8Very high0 Ų09.8 Ų9.80%05%0.053CC..Hα-helixtrans-69.6-33.8173.574.60000112.6I287 A288 Y289 M295 H320I287-S291 PolarHBondContact O-N 3.29Å; A288-S291 WeakPolarHBondContact O-CB 3.29Å; A288-S291 PolarHBondContact O-N 3Å; A288-S291 VanDerWaalsContact O-N 3.12Å; A288-S291 PolarHBondContact O-OG 3.42Å; Y289-S291 PolarHBondContact O-N 3.47Å; S291-M295 WeakPolarHBondContact O-CB 3.5Å; S291-M295 WeakPolarHBondContact O-CG 3.39Å; S291-M295 PolarHBondContact O-N 3.02Å; S291-H320 WeakPolarHBondContact CA-NE2 3.21Å; S291-H320 VanDerWaalsContact CB-NE2 3.3Å; S291-H320 WeakPolarHBondContact CB-NE2 3.4Å
292V97.6Very high96.8Very high1 Ų16 Ų61%0.0063%0.03CC..Hα-helixtrans-65.4-43.3172.4-175.30000110.5P209 H214 L217 T273 A288 Y289 H294 M295 A296P209-V292 HydrophobicContact CB-CG1 4.48Å; P209-V292 HydrophobicContact CB-CG2 4.32Å; P209-V292 HydrophobicContact CG-CB 4.43Å; P209-V292 HydrophobicContact CG-CG1 4.27Å; P209-V292 HydrophobicContact CG-CG2 4Å; H214-V292 HydrophobicContact CB-CG1 3.8Å; H214-V292 HydrophobicContact CB-CG2 4.16Å; L217-V292 HydrophobicContact CD1-CG2 4.03Å; L217-V292 HydrophobicContact CD2-CG2 4.2Å; T273-V292 HydrophobicContact CG2-CB 4.2Å; T273-V292 HydrophobicContact CG2-CG1 3.77Å; A288-V292 PolarHBondContact O-N 3.18Å; Y289-V292 WeakPolarHBondContact O-CB 3.34Å; Y289-V292 PolarHBondContact O-N 3.43Å; Y289-V292 VanDerWaalsContact O-N 3.1Å; V292-H294 PolarHBondContact O-N 2.88Å; V292-M295 PolarHBondContact O-N 3.31Å; V292-A296 WeakPolarHBondContact O-CB 3.49Å; V292-A296 PolarHBondContact O-N 3.17Å
293S97.1Very high96.8Very high1 Ų14.3 Ų4.31%0.0072%0.021CC..Hα-helixtrans-63.4-42.3178.763.20000112.4T273 Y289 S290 A296T273-S293 WeakPolarHBondContact OG1-CA 3.38Å; T273-S293 WeakPolarHBondContact OG1-CB 3.25Å; Y289-S293 PolarHBondContact O-N 3.01Å; S290-S293 WeakPolarHBondContact CA-OG 3.38Å; S290-S293 PolarHBondContact O-N 3.12Å; S290-S293 PolarHBondContact O-OG 2.87Å; S293-A296 PolarHBondContact O-N 3.47Å
294H97.3Very high96.7Very high2 Ų25 Ų51%0.0092%0.024CC..Hα-helixtrans-70.1-41.1178.6-78-58.8000112.7S290 V292 A296 L297 V298 H320 N367 E379S290-H294 PolarHBondContact O-CD2 3.5Å; S290-H294 PolarHBondContact O-N 3.37Å; V292-H294 PolarHBondContact O-N 2.88Å; H294-A296 VanDerWaalsContact C-N 3.29Å; H294-A296 PolarHBondContact O-N 3.38Å; H294-L297 WeakPolarHBondContact O-CB 3.36Å; H294-L297 PolarHBondContact O-N 2.97Å; H294-V298 PolarHBondContact O-N 3.1Å; H294-H320 WeakPolarHBondContact CB-ND1 3.27Å; H294-H320 AromaticContact CD2-CE1 3.48Å; H294-H320 PolarHBondContact CD2-CE1 3.15Å; H294-H320 VanDerWaalsContact CD2-CE1 3.48Å; H294-H320 AromaticContact CD2-ND1 3.35Å; H294-H320 PolarHBondContact CD2-ND1 3.46Å; H294-H320 VanDerWaalsContact CD2-ND1 3.35Å; H294-H320 AromaticContact CG-CE1 3.82Å; H294-H320 AromaticContact CG-ND1 3.48Å; H294-N367 PolarHBondContact NE2-O 3.46Å; H294-N367 PolarHBondContact NE2-OD1 3.16Å; H294-E379 IonicContact CE1-OE1 3.17Å; H294-E379 PolarHBondContact CE1-OE1 2.81Å; H294-E379 IonicContact ND1-OE1 3.48Å; H294-E379 PolarHBondContact ND1-OE1 2.97Å
295M96.8Very high96.6Very high0 Ų06.2 Ų6.20%03%0.03CC..Hα-helixtrans-70.5-25.4175.9-64.8-609500112.3M208 L237 K238 S291 V292 L297 V298 I299 H320M208-M295 HydrophobicContact CE-CB 3.94Å; M208-M295 HydrophobicContact CE-CG 4.38Å; M208-M295 HydrophobicContact CE-SD 3.96Å; M208-M295 HydrophobicContact SD-CB 4.23Å; M208-M295 HydrophobicContact SD-CG 4.23Å; M208-M295 HydrophobicContact SD-SD 3.85Å; L237-M295 HydrophobicContact CB-CG 4.28Å; L237-M295 HydrophobicContact CB-SD 4.16Å; L237-M295 HydrophobicContact CD1-CG 4.03Å; K238-M295 HydrophobicContact CD-SD 4.31Å; S291-M295 WeakPolarHBondContact O-CB 3.5Å; S291-M295 WeakPolarHBondContact O-CG 3.39Å; S291-M295 PolarHBondContact O-N 3.02Å; V292-M295 PolarHBondContact O-N 3.31Å; M295-L297 VanDerWaalsContact C-N 3.32Å; M295-L297 PolarHBondContact O-N 3.23Å; M295-V298 HydrophobicContact CE-CG2 4.14Å; M295-V298 WeakPolarHBondContact O-CB 3.45Å; M295-V298 PolarHBondContact O-N 2.82Å; M295-V298 VanDerWaalsContact O-N 3.15Å; M295-I299 WeakPolarHBondContact O-CG1 3.42Å; M295-I299 PolarHBondContact O-N 2.94Å; M295-H320 HydrophobicContact CE-CB 3.94Å; M295-H320 VanDerWaalsContact CE-CD2 3.41Å; M295-H320 WeakPolarHBondContact CE-CD2 3.29Å
296A97.4Very high96.4Very high3 Ų37.6 Ų7.63%0.0254%0.038CC..Hα-helixtrans-63-37.5173.400000112.2M270 V292 S293 H294 V298 I299 A300M270-A296 HydrophobicContact CB-CB 4.03Å; V292-A296 WeakPolarHBondContact O-CB 3.49Å; V292-A296 PolarHBondContact O-N 3.17Å; S293-A296 PolarHBondContact O-N 3.47Å; H294-A296 VanDerWaalsContact C-N 3.29Å; H294-A296 PolarHBondContact O-N 3.38Å; A296-V298 VanDerWaalsContact C-N 3.32Å; A296-V298 PolarHBondContact O-N 3.26Å; A296-I299 PolarHBondContact O-N 2.89Å; A296-A300 PolarHBondContact O-N 3.48Å
297L96.9Very high96.2Very high5 Ų510 Ų103%0.0265%0.054CC..Hα-helixtrans-59.7-44.2170.9-65.9164.3000111.2M270 H294 M295 I299 A300 S301 L316 E379 I382 M397M270-L297 HydrophobicContact SD-CD2 3.51Å; M270-L297 VanDerWaalsContact SD-CD2 3.51Å; M270-L297 HydrophobicContact SD-CG 4.22Å; H294-L297 WeakPolarHBondContact O-CB 3.36Å; H294-L297 PolarHBondContact O-N 2.97Å; M295-L297 VanDerWaalsContact C-N 3.32Å; M295-L297 PolarHBondContact O-N 3.23Å; L297-I299 PolarHBondContact O-N 3.13Å; L297-A300 PolarHBondContact O-N 2.87Å; L297-S301 WeakPolarHBondContact O-CB 3.41Å; L297-S301 PolarHBondContact O-N 3.18Å; L297-S301 PolarHBondContact O-OG 3.5Å; L297-L316 HydrophobicContact CB-CD2 3.99Å; L297-L316 HydrophobicContact CD1-CD2 4.19Å; L297-E379 HydrophobicContact CD1-CG 4.32Å; L297-I382 HydrophobicContact CB-CD1 4.35Å; L297-I382 HydrophobicContact CB-CG2 4.45Å; L297-M397 HydrophobicContact CD2-CE 3.27Å; L297-M397 HydrophobicContact CD2-SD 3.57Å; L297-M397 VanDerWaalsContact CD2-SD 3.57Å
298V97.7Very high96Very high0 Ų017.1 Ų17.10%08%0.081CC..Hα-helixtrans-62.3-43.3177.2179.40000110.9M208 H294 M295 A296 S301 I302 A313 L316 M317M208-V298 HydrophobicContact CE-CB 3.64Å; M208-V298 HydrophobicContact CE-CG1 3.45Å; M208-V298 VanDerWaalsContact CE-CG1 3.45Å; H294-V298 PolarHBondContact O-N 3.1Å; M295-V298 HydrophobicContact CE-CG2 4.14Å; M295-V298 WeakPolarHBondContact O-CB 3.45Å; M295-V298 PolarHBondContact O-N 2.82Å; M295-V298 VanDerWaalsContact O-N 3.15Å; A296-V298 VanDerWaalsContact C-N 3.32Å; A296-V298 PolarHBondContact O-N 3.26Å; V298-S301 WeakPolarHBondContact CA-OG 3.49Å; V298-S301 PolarHBondContact O-N 3.02Å; V298-S301 PolarHBondContact O-OG 3.4Å; V298-I302 HydrophobicContact CG1-CD1 3.62Å; V298-I302 HydrophobicContact CG1-CG1 4.29Å; V298-I302 VanDerWaalsContact O-CG1 3.31Å; V298-I302 WeakPolarHBondContact O-CG1 3.36Å; V298-I302 PolarHBondContact O-N 3.38Å; V298-A313 HydrophobicContact CG1-CB 4.15Å; V298-L316 HydrophobicContact CG2-CB 4.26Å; V298-L316 HydrophobicContact CG2-CD2 3.78Å; V298-L316 HydrophobicContact CG2-CG 4.11Å; V298-M317 HydrophobicContact CG1-CG 4.05Å; V298-M317 HydrophobicContact CG2-CG 4.4Å
299I97.3Very high96Very high0 Ų017.1 Ų17.10%08%0.081CC..Hα-helixtrans-58.9-50.1175.8-65.4166.6000110.6L205 M208 L210 M244 M295 A296 L297 S301 I302 M303L205-I299 HydrophobicContact CD2-CG2 3.82Å; M208-I299 HydrophobicContact CB-CD1 3.96Å; M208-I299 HydrophobicContact CB-CG1 3.99Å; M208-I299 HydrophobicContact CE-CG1 4.03Å; L210-I299 HydrophobicContact CB-CD1 4.44Å; L210-I299 HydrophobicContact CD1-CD1 4.32Å; L210-I299 HydrophobicContact CD1-CG2 4.38Å; M244-I299 HydrophobicContact CE-CG2 4.41Å; M295-I299 WeakPolarHBondContact O-CG1 3.42Å; M295-I299 PolarHBondContact O-N 2.94Å; A296-I299 PolarHBondContact O-N 2.89Å; L297-I299 PolarHBondContact O-N 3.13Å; I299-S301 VanDerWaalsContact C-N 3.3Å; I299-S301 PolarHBondContact O-N 2.85Å; I299-I302 PolarHBondContact O-N 3.4Å; I299-M303 HydrophobicContact CG2-CG 4.43Å; I299-M303 VanDerWaalsContact O-CG 3.26Å; I299-M303 WeakPolarHBondContact O-CG 3.01Å; I299-M303 PolarHBondContact O-N 3.46Å; I299-M303 VanDerWaalsContact O-N 3.12Å
300A96.8Very high95.8Very high0 Ų016.6 Ų16.60%08%0.08CC..Hα-helixtrans-57.6-44.417900000111.7S266 L267 A296 L297 M303 I304 L386S266-A300 WeakPolarHBondContact OG-CB 3.34Å; L267-A300 HydrophobicContact CD2-CB 4.26Å; A296-A300 PolarHBondContact O-N 3.48Å; L297-A300 PolarHBondContact O-N 2.87Å; A300-M303 PolarHBondContact O-N 3.39Å; A300-I304 WeakPolarHBondContact O-CG1 3.25Å; A300-I304 PolarHBondContact O-N 2.89Å; A300-L386 HydrophobicContact CB-CD1 4.38Å; A300-L386 HydrophobicContact CB-CD2 4.34Å
301S95.5Very high95.7Very high0 Ų018 Ų180%09%0.086CC..Hα-helixtrans-66.1-41.6-178.869.70000113.5L297 V298 I299 M303 I304 S309 A313L297-S301 WeakPolarHBondContact O-CB 3.41Å; L297-S301 PolarHBondContact O-N 3.18Å; L297-S301 PolarHBondContact O-OG 3.5Å; V298-S301 WeakPolarHBondContact CA-OG 3.49Å; V298-S301 PolarHBondContact O-N 3.02Å; V298-S301 PolarHBondContact O-OG 3.4Å; I299-S301 VanDerWaalsContact C-N 3.3Å; I299-S301 PolarHBondContact O-N 2.85Å; S301-M303 VanDerWaalsContact C-N 3.32Å; S301-M303 PolarHBondContact O-N 3Å; S301-I304 PolarHBondContact O-N 2.92Å; S301-S309 WeakPolarHBondContact O-CB 3.26Å; S301-S309 PolarHBondContact O-OG 3.05Å; S301-A313 WeakPolarHBondContact OG-CB 3.47Å
302I95.8Very high95.7Very high2 Ų218 Ų181%0.019%0.086CC..Hα-helixtrans-67.7-36.6179-68.5169.3000110.4S241 M244 I245 V298 I299 I304 Q305 F310 A313S241-I302 VanDerWaalsContact CB-CD1 3.48Å; M244-I302 HydrophobicContact CB-CG2 3.75Å; M244-I302 HydrophobicContact CE-CB 4.23Å; M244-I302 HydrophobicContact CE-CG2 3.87Å; I245-I302 HydrophobicContact CD1-CD1 4.02Å; I245-I302 HydrophobicContact CD1-CG1 4.19Å; I245-I302 HydrophobicContact CG1-CD1 3.96Å; I245-I302 HydrophobicContact CG1-CG1 3.98Å; I245-I302 HydrophobicContact CG1-CG2 4.07Å; V298-I302 HydrophobicContact CG1-CD1 3.62Å; V298-I302 HydrophobicContact CG1-CG1 4.29Å; V298-I302 VanDerWaalsContact O-CG1 3.31Å; V298-I302 WeakPolarHBondContact O-CG1 3.36Å; V298-I302 PolarHBondContact O-N 3.38Å; I299-I302 PolarHBondContact O-N 3.4Å; I302-I304 VanDerWaalsContact C-N 3.28Å; I302-I304 PolarHBondContact O-N 2.96Å; I302-Q305 WeakPolarHBondContact O-CG 3.43Å; I302-Q305 PolarHBondContact O-N 3.2Å; I302-F310 HydrophobicContact CG2-CE1 4.19Å; I302-A313 HydrophobicContact CG1-CB 4.04Å
303M94.9Very high95.6Very high10 Ų1018 Ų185%0.0499%0.086CC..Hα-helixtrans-69.3-22.4180-71.4-62.5-166.700114W197 M201 L205 M244 A259 F262 I263 I299 A300 S301W197-M303 HydrophobicContact CH2-CE 4.13Å; W197-M303 HydrophobicContact CZ2-CE 4.32Å; W197-M303 HydrophobicContact CZ2-SD 4.21Å; M201-M303 HydrophobicContact CE-CE 3.4Å; M201-M303 HydrophobicContact CE-SD 3.7Å; L205-M303 HydrophobicContact CD1-CE 4.13Å; L205-M303 HydrophobicContact CD2-CE 3.9Å; L205-M303 HydrophobicContact CG-CE 4.37Å; M244-M303 HydrophobicContact CE-CE 3.67Å; M244-M303 HydrophobicContact CE-CG 4.32Å; M244-M303 HydrophobicContact CE-SD 4.16Å; A259-M303 HydrophobicContact CB-CB 4.05Å; A259-M303 HydrophobicContact CB-SD 4.31Å; F262-M303 HydrophobicContact CB-CE 4.07Å; F262-M303 HydrophobicContact CG-CE 4.36Å; I263-M303 HydrophobicContact CD1-CB 4.05Å; I263-M303 HydrophobicContact CG1-CB 3.75Å; I263-M303 HydrophobicContact CG1-CG 4.47Å; I299-M303 HydrophobicContact CG2-CG 4.43Å; I299-M303 VanDerWaalsContact O-CG 3.26Å; I299-M303 WeakPolarHBondContact O-CG 3.01Å; I299-M303 PolarHBondContact O-N 3.46Å; I299-M303 VanDerWaalsContact O-N 3.12Å; A300-M303 PolarHBondContact O-N 3.39Å; S301-M303 VanDerWaalsContact C-N 3.32Å; S301-M303 PolarHBondContact O-N 3Å
304I94.4Very high95.6Very high22 Ų2218.2 Ų18.211%0.1139%0.087CC..Hα-helixtrans-84.1-22176.9-68.6166.1000112.1I263 A300 S301 I302 T306 L386 W389I263-I304 HydrophobicContact CD1-CG1 4.04Å; A300-I304 WeakPolarHBondContact O-CG1 3.25Å; A300-I304 PolarHBondContact O-N 2.89Å; S301-I304 PolarHBondContact O-N 2.92Å; I302-I304 VanDerWaalsContact C-N 3.28Å; I302-I304 PolarHBondContact O-N 2.96Å; I304-T306 VanDerWaalsContact C-N 3.32Å; I304-T306 HydrophobicContact CG2-CG2 3.86Å; I304-T306 PolarHBondContact O-N 3.16Å; I304-L386 HydrophobicContact CD1-CD2 3.19Å; I304-L386 HydrophobicContact CD1-CG 3.82Å; I304-W389 HydrophobicContact CD1-CB 3.86Å; I304-W389 HydrophobicContact CD1-CD2 4.11Å; I304-W389 HydrophobicContact CD1-CE3 4.45Å; I304-W389 HydrophobicContact CD1-CG 3.83Å; I304-W389 HydrophobicContact CG1-CB 4.28Å; I304-W389 HydrophobicContact CG1-CD2 4.3Å; I304-W389 HydrophobicContact CG1-CG 3.91Å; I304-W389 HydrophobicContact CG2-CB 4Å; I304-W389 HydrophobicContact CG2-CG 4.2Å
305Q93.1Very high95.5Very high40 Ų4018.2 Ų18.219%0.1879%0.088CC..THydrogen-bonded Turntrans55.436171-53.2171.6-4300115.7D252 T255 I302 F310D252-Q305 VanDerWaalsContact OD1-CD 3.3Å; D252-Q305 PolarHBondContact OD1-NE2 3.44Å; D252-Q305 PolarHBondContact OD1-OE1 3.41Å; T255-Q305 PolarHBondContact OG1-OE1 2.92Å; I302-Q305 WeakPolarHBondContact O-CG 3.43Å; I302-Q305 PolarHBondContact O-N 3.2Å; Q305-F310 HydrophobicContact CB-CE2 4.2Å; Q305-F310 HydrophobicContact CB-CZ 3.88Å; Q305-F310 HydrophobicContact CG-CZ 4.05Å
306T93.5Very high95.5Very high37 Ų3718.2 Ų18.223%0.2279%0.088CC..  trans-93.5154.9171610000110.6I304 W308 S309 F310I304-T306 VanDerWaalsContact C-N 3.32Å; I304-T306 HydrophobicContact CG2-CG2 3.86Å; I304-T306 PolarHBondContact O-N 3.16Å; T306-W308 VanDerWaalsContact C-N 3.31Å; T306-W308 PolarHBondContact O-N 3.5Å; T306-S309 PolarHBondContact N-OG 2.85Å; T306-S309 PolarHBondContact O-N 3.34Å; T306-S309 PolarHBondContact O-OG 3.47Å; T306-S309 WeakPolarHBondContact OG1-CB 2.98Å; T306-S309 PolarHBondContact OG1-N 2.91Å; T306-S309 VanDerWaalsContact OG1-N 3.16Å; T306-S309 PolarHBondContact OG1-OG 3.07Å; T306-F310 PolarHBondContact O-N 3.43Å
307P92.9Very high95.4Very high51 Ų5118.2 Ų18.233%0.3319%0.087SC..Hα-helixtrans-55.1-46.2176.1-26.834.8000112.4S309 F310 M311P307-S309 VanDerWaalsContact C-N 3.29Å; P307-S309 PolarHBondContact O-N 3.15Å; P307-F310 PolarHBondContact O-N 2.96Å; P307-M311 HydrophobicContact CB-CE 4.12Å; P307-M311 VanDerWaalsContact O-CG 3.27Å; P307-M311 WeakPolarHBondContact O-CG 3.36Å; P307-M311 PolarHBondContact O-N 2.92Å
308W94.3Very high95.4Very high148 Ų14818.3 Ų18.356%0.5619%0.088SC*.Hα-helixtrans-60.5-37.3176.1-62.992.6000112.7T306 M311 G312 F381T306-W308 VanDerWaalsContact C-N 3.31Å; T306-W308 PolarHBondContact O-N 3.5Å; W308-M311 PolarHBondContact O-N 3.33Å; W308-G312 PolarHBondContact O-N 3.39Å; W308-F381 AromaticContact CE3-CD1 3.59Å; W308-F381 HydrophobicContact CE3-CD1 3.59Å; W308-F381 AromaticContact CE3-CE1 3.79Å; W308-F381 HydrophobicContact CE3-CE1 3.79Å; W308-F381 HydrophobicContact CE3-CG 4.4Å; W308-F381 AromaticContact CZ3-CD1 3.84Å; W308-F381 HydrophobicContact CZ3-CD1 3.84Å; W308-F381 AromaticContact CZ3-CE1 3.53Å; W308-F381 HydrophobicContact CZ3-CE1 3.53Å; W308-F381 HydrophobicContact CZ3-CZ 4.37Å
309S95.1Very high95.4Very high0 Ų018.4 Ų18.40%09%0.088CC..Hα-helixtrans-70.4-38.7178.374.30000112S301 T306 P307 A313 S385S301-S309 WeakPolarHBondContact O-CB 3.26Å; S301-S309 PolarHBondContact O-OG 3.05Å; T306-S309 PolarHBondContact N-OG 2.85Å; T306-S309 PolarHBondContact O-N 3.34Å; T306-S309 PolarHBondContact O-OG 3.47Å; T306-S309 WeakPolarHBondContact OG1-CB 2.98Å; T306-S309 PolarHBondContact OG1-N 2.91Å; T306-S309 VanDerWaalsContact OG1-N 3.16Å; T306-S309 PolarHBondContact OG1-OG 3.07Å; P307-S309 VanDerWaalsContact C-N 3.29Å; P307-S309 PolarHBondContact O-N 3.15Å; S309-A313 WeakPolarHBondContact O-CB 3.49Å; S309-A313 PolarHBondContact O-N 3.25Å; S309-S385 VanDerWaalsContact CB-OG 3.3Å; S309-S385 WeakPolarHBondContact CB-OG 3.41Å
310F94.8Very high95.4Very high27 Ų2718.4 Ų18.412%0.1189%0.088CC..Hα-helixtrans-67.9-39.5172.9-68.8-44.7000112.8I245 I302 Q305 T306 P307 A313 T314I245-F310 HydrophobicContact CD1-CD1 4.41Å; I245-F310 HydrophobicContact CG1-CD1 4.07Å; I245-F310 HydrophobicContact CG1-CE1 4.03Å; I245-F310 HydrophobicContact CG2-CE1 4.49Å; I302-F310 HydrophobicContact CG2-CE1 4.19Å; Q305-F310 HydrophobicContact CB-CE2 4.2Å; Q305-F310 HydrophobicContact CB-CZ 3.88Å; Q305-F310 HydrophobicContact CG-CZ 4.05Å; T306-F310 PolarHBondContact O-N 3.43Å; P307-F310 PolarHBondContact O-N 2.96Å; F310-A313 PolarHBondContact O-N 3.29Å; F310-T314 VanDerWaalsContact O-CG2 3.3Å; F310-T314 WeakPolarHBondContact O-CG2 3.39Å; F310-T314 PolarHBondContact O-N 3.44Å; F310-T314 PolarHBondContact O-OG1 3.15Å
311M94.6Very high95.4Very high29 Ų2918.4 Ų18.414%0.1439%0.088CC..Hα-helixtrans-61.2-47.7173.8-66179.7-153.600111.3P307 W308 T314 M315 T456 T459P307-M311 HydrophobicContact CB-CE 4.12Å; P307-M311 VanDerWaalsContact O-CG 3.27Å; P307-M311 WeakPolarHBondContact O-CG 3.36Å; P307-M311 PolarHBondContact O-N 2.92Å; W308-M311 PolarHBondContact O-N 3.33Å; M311-T314 PolarHBondContact O-N 3.39Å; M311-T314 PolarHBondContact O-OG1 3.44Å; M311-M315 WeakPolarHBondContact O-CG 3.25Å; M311-M315 PolarHBondContact O-N 3.04Å; M311-M315 VanDerWaalsContact O-N 3.09Å; M311-T456 VanDerWaalsContact CA-O 3.31Å; M311-T456 WeakPolarHBondContact CA-O 3.49Å; M311-T456 WeakPolarHBondContact CG-O 3.4Å; M311-T459 HydrophobicContact CE-CG2 3.42Å; M311-T459 VanDerWaalsContact CE-CG2 3.42Å; M311-T459 HydrophobicContact CG-CG2 4.44Å; M311-T459 HydrophobicContact SD-CG2 4.06Å
312G95.6Very high95.5Very high0 Ų018.7 Ų18.70%09%0.09CC..Hα-helixtrans-63.2-43.4177.100000113.1W308 T314 M315 L316W308-G312 PolarHBondContact O-N 3.39Å; G312-T314 VanDerWaalsContact C-N 3.35Å; G312-T314 PolarHBondContact O-N 2.82Å; G312-M315 PolarHBondContact O-N 2.98Å; G312-L316 VanDerWaalsContact O-CB 3.31Å; G312-L316 WeakPolarHBondContact O-CB 3.09Å; G312-L316 PolarHBondContact O-N 3.48Å
313A96.3Very high95.5Very high0 Ų018.6 Ų18.60%09%0.089CC..Hα-helixtrans-56.5-47.7176.500000111.8V298 S301 I302 S309 F310 L316 M317V298-A313 HydrophobicContact CG1-CB 4.15Å; S301-A313 WeakPolarHBondContact OG-CB 3.47Å; I302-A313 HydrophobicContact CG1-CB 4.04Å; S309-A313 WeakPolarHBondContact O-CB 3.49Å; S309-A313 PolarHBondContact O-N 3.25Å; F310-A313 PolarHBondContact O-N 3.29Å; A313-L316 PolarHBondContact O-N 2.9Å; A313-M317 WeakPolarHBondContact O-CB 3.42Å; A313-M317 WeakPolarHBondContact O-CG 2.91Å; A313-M317 PolarHBondContact O-N 2.76Å
314T95.6Very high95.6Very high6 Ų618.1 Ų18.14%0.0379%0.087CC..Hα-helixtrans-69.3-44.1-17752.50000112.7L62 I245 F310 M311 G312 L316 M317 I318 I455 T456L62-T314 HydrophobicContact CD1-CG2 3.36Å; I245-T314 HydrophobicContact CD1-CG2 4.48Å; F310-T314 VanDerWaalsContact O-CG2 3.3Å; F310-T314 WeakPolarHBondContact O-CG2 3.39Å; F310-T314 PolarHBondContact O-N 3.44Å; F310-T314 PolarHBondContact O-OG1 3.15Å; M311-T314 PolarHBondContact O-N 3.39Å; M311-T314 PolarHBondContact O-OG1 3.44Å; G312-T314 VanDerWaalsContact C-N 3.35Å; G312-T314 PolarHBondContact O-N 2.82Å; T314-L316 PolarHBondContact O-N 2.7Å; T314-M317 HydrophobicContact CG2-CE 3.63Å; T314-M317 WeakPolarHBondContact O-CB 3.35Å; T314-M317 PolarHBondContact O-N 3.32Å; T314-I318 WeakPolarHBondContact O-CD1 3.13Å; T314-I318 WeakPolarHBondContact O-CG1 3.4Å; T314-I318 PolarHBondContact O-N 2.98Å; T314-I455 PolarHBondContact OG1-O 3.3Å; T314-T456 PolarHBondContact OG1-O 3.24Å
315M95.7Very high95.8Very high3 Ų317.1 Ų17.12%0.0158%0.082CC..Hα-helixtrans-57.8-49.3172.2-72.6-170.4-175.100112M311 G312 M317 I318 A319 I374 M377 F381 P452 I455 T456M311-M315 WeakPolarHBondContact O-CG 3.25Å; M311-M315 PolarHBondContact O-N 3.04Å; M311-M315 VanDerWaalsContact O-N 3.09Å; G312-M315 PolarHBondContact O-N 2.98Å; M315-M317 VanDerWaalsContact C-N 3.34Å; M315-M317 PolarHBondContact O-N 2.86Å; M315-I318 PolarHBondContact O-N 3.17Å; M315-A319 VanDerWaalsContact O-CB 3.27Å; M315-A319 WeakPolarHBondContact O-CB 3.33Å; M315-A319 PolarHBondContact O-N 3.43Å; M315-I374 HydrophobicContact CB-CG2 4.06Å; M315-I374 HydrophobicContact CG-CG2 4.48Å; M315-M377 HydrophobicContact SD-CB 3.82Å; M315-F381 HydrophobicContact CE-CD2 4.28Å; M315-F381 HydrophobicContact CE-CE2 3.74Å; M315-F381 HydrophobicContact SD-CD2 3.85Å; M315-F381 HydrophobicContact SD-CE2 3.72Å; M315-P452 HydrophobicContact CE-CB 4.25Å; M315-I455 HydrophobicContact CG-CD1 4.4Å; M315-I455 HydrophobicContact CG-CG1 4.26Å; M315-T456 HydrophobicContact CE-CG2 3.09Å
316L96.7Very high96Very high0 Ų015.2 Ų15.20%07%0.073CC..Hα-helixtrans-65.4-37.7-179.1-173.361.5000111.5L297 V298 G312 A313 T314 I318 H320 E379 I382L297-L316 HydrophobicContact CB-CD2 3.99Å; L297-L316 HydrophobicContact CD1-CD2 4.19Å; V298-L316 HydrophobicContact CG2-CB 4.26Å; V298-L316 HydrophobicContact CG2-CD2 3.78Å; V298-L316 HydrophobicContact CG2-CG 4.11Å; G312-L316 VanDerWaalsContact O-CB 3.31Å; G312-L316 WeakPolarHBondContact O-CB 3.09Å; G312-L316 PolarHBondContact O-N 3.48Å; A313-L316 PolarHBondContact O-N 2.9Å; T314-L316 PolarHBondContact O-N 2.7Å; L316-I318 PolarHBondContact O-N 3.11Å; L316-H320 WeakPolarHBondContact O-CA 3.17Å; L316-H320 WeakPolarHBondContact O-CB 3.11Å; L316-H320 PolarHBondContact O-N 3.06Å; L316-E379 HydrophobicContact CD1-CG 3.92Å; L316-E379 HydrophobicContact CD2-CG 4.32Å; L316-I382 HydrophobicContact CB-CD1 4.09Å; L316-I382 HydrophobicContact CD2-CD1 3.55Å; L316-I382 HydrophobicContact CG-CD1 4.46Å
317M96.6Very high96.2Very high2 Ų213.5 Ų13.51%0.016%0.062CC..Hα-helixtrans-55.7-49174.4-83.8-168.8-7300112.1L62 K238 S241 I245 V298 A313 T314 M315 G321L62-M317 HydrophobicContact CD1-CE 4.44Å; K238-M317 HydrophobicContact CB-SD 4.28Å; K238-M317 WeakPolarHBondContact CE-O 3.23Å; K238-M317 HydrophobicContact CG-CB 3.86Å; K238-M317 HydrophobicContact CG-CG 3.97Å; K238-M317 HydrophobicContact CG-SD 4.08Å; S241-M317 WeakPolarHBondContact CB-SD 3.36Å; S241-M317 PolarHBondContact OG-SD 3.48Å; I245-M317 HydrophobicContact CD1-CE 4.08Å; V298-M317 HydrophobicContact CG1-CG 4.05Å; V298-M317 HydrophobicContact CG2-CG 4.4Å; A313-M317 WeakPolarHBondContact O-CB 3.42Å; A313-M317 WeakPolarHBondContact O-CG 2.91Å; A313-M317 PolarHBondContact O-N 2.76Å; T314-M317 HydrophobicContact CG2-CE 3.63Å; T314-M317 WeakPolarHBondContact O-CB 3.35Å; T314-M317 PolarHBondContact O-N 3.32Å; M315-M317 VanDerWaalsContact C-N 3.34Å; M315-M317 PolarHBondContact O-N 2.86Å; M317-G321 PolarHBondContact O-N 3.46Å
318I97.4Very high96.5Very high8 Ų811 Ų114%0.0415%0.046CC..Hα-helixtrans-72.5-48-175.7-64153.3000110.2P65 T314 M315 L316 G321 L322 L448 I455P65-I318 HydrophobicContact CB-CD1 3.3Å; P65-I318 HydrophobicContact CB-CG1 4.02Å; P65-I318 HydrophobicContact CG-CD1 3.98Å; T314-I318 WeakPolarHBondContact O-CD1 3.13Å; T314-I318 WeakPolarHBondContact O-CG1 3.4Å; T314-I318 PolarHBondContact O-N 2.98Å; M315-I318 PolarHBondContact O-N 3.17Å; L316-I318 PolarHBondContact O-N 3.11Å; I318-G321 WeakPolarHBondContact O-CA 3.25Å; I318-G321 PolarHBondContact O-N 3.49Å; I318-G321 VanDerWaalsContact O-N 3.11Å; I318-L322 PolarHBondContact O-N 3.47Å; I318-L322 VanDerWaalsContact O-N 3.08Å; I318-L448 HydrophobicContact CG2-CD1 4.26Å; I318-I455 HydrophobicContact CD1-CB 3.57Å; I318-I455 HydrophobicContact CD1-CG2 3.63Å; I318-I455 HydrophobicContact CG2-CG2 4.37Å
319A96.6Very high96.6Very high1 Ų14.2 Ų4.21%0.0082%0.021CC..Hα-helixtrans-67-43.2-176.900000111.5M315 G321 L322 T323 I374 N375M315-A319 VanDerWaalsContact O-CB 3.27Å; M315-A319 WeakPolarHBondContact O-CB 3.33Å; M315-A319 PolarHBondContact O-N 3.43Å; A319-G321 VanDerWaalsContact C-N 3.27Å; A319-G321 PolarHBondContact O-N 2.9Å; A319-L322 PolarHBondContact O-N 2.9Å; A319-T323 PolarHBondContact O-N 3.15Å; A319-T323 PolarHBondContact O-OG1 2.9Å; A319-I374 HydrophobicContact CB-CB 3.76Å; A319-I374 HydrophobicContact CB-CG2 3.58Å; A319-N375 WeakPolarHBondContact CA-OD1 3.48Å; A319-N375 WeakPolarHBondContact CB-OD1 3.12Å
320H96.9Very high96.7Very high1 Ų14.2 Ų4.21%0.0052%0.021CC..Hα-helixtrans-62.7-35.3171.2-175.278.1000111.7K238 S291 H294 M295 L316 L322 T323 S324 N375K238-H320 PolarHBondContact NZ-CD2 2.91Å; S291-H320 WeakPolarHBondContact CA-NE2 3.21Å; S291-H320 VanDerWaalsContact CB-NE2 3.3Å; S291-H320 WeakPolarHBondContact CB-NE2 3.4Å; H294-H320 WeakPolarHBondContact CB-ND1 3.27Å; H294-H320 AromaticContact CD2-CE1 3.48Å; H294-H320 PolarHBondContact CD2-CE1 3.15Å; H294-H320 VanDerWaalsContact CD2-CE1 3.48Å; H294-H320 AromaticContact CD2-ND1 3.35Å; H294-H320 PolarHBondContact CD2-ND1 3.46Å; H294-H320 VanDerWaalsContact CD2-ND1 3.35Å; H294-H320 AromaticContact CG-CE1 3.82Å; H294-H320 AromaticContact CG-ND1 3.48Å; M295-H320 HydrophobicContact CE-CB 3.94Å; M295-H320 VanDerWaalsContact CE-CD2 3.41Å; M295-H320 WeakPolarHBondContact CE-CD2 3.29Å; L316-H320 WeakPolarHBondContact O-CA 3.17Å; L316-H320 WeakPolarHBondContact O-CB 3.11Å; L316-H320 PolarHBondContact O-N 3.06Å; H320-L322 VanDerWaalsContact C-N 3.33Å; H320-L322 PolarHBondContact O-N 2.93Å; H320-T323 WeakPolarHBondContact CA-OG1 3.19Å; H320-T323 PolarHBondContact O-N 3.34Å; H320-T323 PolarHBondContact O-OG1 3.1Å; H320-S324 VanDerWaalsContact O-CB 3.22Å; H320-S324 WeakPolarHBondContact O-CB 3.38Å; H320-S324 PolarHBondContact O-N 3.05Å; H320-S324 PolarHBondContact O-OG 3.47Å; H320-N375 PolarHBondContact N-OD1 3.23Å
321G96.7Very high96.8Very high0 Ų03.2 Ų3.20%02%0.018CC..Hα-helixtrans-60.3-42176.700000113A234 M317 I318 A319 S324 S325A234-G321 WeakPolarHBondContact CB-O 3.37Å; M317-G321 PolarHBondContact O-N 3.46Å; I318-G321 WeakPolarHBondContact O-CA 3.25Å; I318-G321 PolarHBondContact O-N 3.49Å; I318-G321 VanDerWaalsContact O-N 3.11Å; A319-G321 VanDerWaalsContact C-N 3.27Å; A319-G321 PolarHBondContact O-N 2.9Å; G321-S324 PolarHBondContact O-OG 3.47Å; G321-S325 WeakPolarHBondContact O-CB 3.29Å; G321-S325 PolarHBondContact O-N 2.9Å; G321-S325 PolarHBondContact O-OG 3.39Å
322L97.3Very high96.9Very high5 Ų52.4 Ų2.43%0.0261%0.014CC..Hα-helixtrans-73.7-41.1175.5-70.7172000112.8L69 I318 A319 H320 S325 L326 P444 L445 L448L69-L322 HydrophobicContact CD1-CD2 3.59Å; L69-L322 HydrophobicContact CD1-CG 3.89Å; I318-L322 PolarHBondContact O-N 3.47Å; I318-L322 VanDerWaalsContact O-N 3.08Å; A319-L322 PolarHBondContact O-N 2.9Å; H320-L322 VanDerWaalsContact C-N 3.33Å; H320-L322 PolarHBondContact O-N 2.93Å; L322-S325 PolarHBondContact O-OG 3.2Å; L322-L326 WeakPolarHBondContact O-CB 3.31Å; L322-L326 PolarHBondContact O-N 3.43Å; L322-L326 VanDerWaalsContact O-N 3.12Å; L322-P444 HydrophobicContact CD1-CB 4.34Å; L322-L445 HydrophobicContact CB-CD1 4.02Å; L322-L445 HydrophobicContact CD1-CB 4.25Å; L322-L448 HydrophobicContact CD1-CD1 4.19Å
323T97.5Very high96.9Very high0 Ų02.5 Ų2.50%02%0.015CC..Hα-helixtrans-71-44.5-18054.90000113.2A319 H320 L326 L327 A366 N375 L445A319-T323 PolarHBondContact O-N 3.15Å; A319-T323 PolarHBondContact O-OG1 2.9Å; H320-T323 WeakPolarHBondContact CA-OG1 3.19Å; H320-T323 PolarHBondContact O-N 3.34Å; H320-T323 PolarHBondContact O-OG1 3.1Å; T323-L326 WeakPolarHBondContact O-CB 3.38Å; T323-L326 PolarHBondContact O-N 3.21Å; T323-L327 WeakPolarHBondContact O-CG 3.31Å; T323-L327 PolarHBondContact O-N 3.44Å; T323-A366 HydrophobicContact CG2-CB 3.49Å; T323-A366 VanDerWaalsContact CG2-CB 3.49Å; T323-N375 WeakPolarHBondContact CG2-ND2 3.38Å; T323-L445 HydrophobicContact CG2-CD1 3.37Å
324S96.8Very high96.8Very high1 Ų13.1 Ų3.11%0.0072%0.018CC..Hα-helixtrans-64.8-41.9179.959.20000111.7A233 H320 G321 L327 F328A233-S324 WeakPolarHBondContact CB-OG 3.16Å; H320-S324 VanDerWaalsContact O-CB 3.22Å; H320-S324 WeakPolarHBondContact O-CB 3.38Å; H320-S324 PolarHBondContact O-N 3.05Å; H320-S324 PolarHBondContact O-OG 3.47Å; G321-S324 PolarHBondContact O-OG 3.47Å; S324-L327 PolarHBondContact O-N 3.19Å; S324-F328 WeakPolarHBondContact O-CD2 3.44Å; S324-F328 PolarHBondContact O-N 3.03Å
325S97.5Very high96.7Very high0 Ų04.5 Ų4.50%02%0.023CC..Hα-helixtrans-61.4-44.2174.351.30000111.8G321 L322 L327 F328 C329 H441G321-S325 WeakPolarHBondContact O-CB 3.29Å; G321-S325 PolarHBondContact O-N 2.9Å; G321-S325 PolarHBondContact O-OG 3.39Å; L322-S325 PolarHBondContact O-OG 3.2Å; S325-L327 PolarHBondContact O-N 3.19Å; S325-F328 PolarHBondContact O-N 2.81Å; S325-C329 PolarHBondContact O-N 3.44Å; S325-C329 PolarHBondContact O-SG 3.45Å; S325-H441 PolarHBondContact OG-CD2 3.47Å; S325-H441 VanDerWaalsContact OG-CD2 3.27Å
326L97.9Very high96.6Very high1 Ų15.8 Ų5.81%0.0053%0.029CC..Hα-helixtrans-58.5-47173.6174.762.2000112.4L322 T323 F328 C329 L330 A363 M438 H441 M442L322-L326 WeakPolarHBondContact O-CB 3.31Å; L322-L326 PolarHBondContact O-N 3.43Å; L322-L326 VanDerWaalsContact O-N 3.12Å; T323-L326 WeakPolarHBondContact O-CB 3.38Å; T323-L326 PolarHBondContact O-N 3.21Å; L326-F328 VanDerWaalsContact C-N 3.34Å; L326-F328 PolarHBondContact O-N 3.37Å; L326-C329 WeakPolarHBondContact O-CB 3.43Å; L326-C329 PolarHBondContact O-N 3.19Å; L326-C329 VanDerWaalsContact O-N 3.09Å; L326-L330 HydrophobicContact CD1-CD1 4.35Å; L326-L330 HydrophobicContact CD1-CG 4.29Å; L326-L330 HydrophobicContact CG-CD1 4.17Å; L326-L330 WeakPolarHBondContact O-CG 3.24Å; L326-L330 PolarHBondContact O-N 3.07Å; L326-A363 HydrophobicContact CD2-CB 3.48Å; L326-A363 VanDerWaalsContact CD2-CB 3.48Å; L326-A363 HydrophobicContact CG-CB 3.87Å; L326-M438 HydrophobicContact CD1-CB 4.09Å; L326-M438 HydrophobicContact CD1-CG 4.25Å; L326-M438 HydrophobicContact CD1-SD 3.34Å; L326-M438 WeakPolarHBondContact CD1-SD 3.42Å; L326-H441 HydrophobicContact CB-CB 3.91Å; L326-H441 HydrophobicContact CD1-CB 3.98Å; L326-H441 HydrophobicContact CD2-CB 4.43Å; L326-H441 HydrophobicContact CG-CB 4.33Å; L326-M442 HydrophobicContact CD2-CG 3.57Å; L326-M442 HydrophobicContact CD2-SD 3.22Å; L326-M442 WeakPolarHBondContact CD2-SD 3.3Å
327L97.6Very high96.4Very high0 Ų07.5 Ų7.50%04%0.035CC..Hα-helixtrans-61.6-41.1178.1-73.3173000111.8I287 T323 S324 S325 C329 L330 A331 A363 N367 M411I287-L327 HydrophobicContact CD1-CB 3.91Å; I287-L327 WeakPolarHBondContact CD1-O 3.31Å; I287-L327 HydrophobicContact CG1-CB 4.1Å; I287-L327 HydrophobicContact CG2-CB 3.95Å; I287-L327 HydrophobicContact CG2-CD1 4.49Å; T323-L327 WeakPolarHBondContact O-CG 3.31Å; T323-L327 PolarHBondContact O-N 3.44Å; S324-L327 PolarHBondContact O-N 3.19Å; S325-L327 PolarHBondContact O-N 3.19Å; L327-C329 VanDerWaalsContact C-N 3.29Å; L327-C329 PolarHBondContact O-N 3.21Å; L327-L330 HydrophobicContact CD2-CD1 4.4Å; L327-L330 PolarHBondContact O-N 3.04Å; L327-A331 WeakPolarHBondContact O-CB 3.33Å; L327-A331 PolarHBondContact O-N 3.32Å; L327-A363 HydrophobicContact CD2-CB 3.81Å; L327-A363 HydrophobicContact CG-CB 4.39Å; L327-N367 HydrophobicContact CD1-CB 4.08Å; L327-M411 HydrophobicContact CD1-CE 4.47Å; L327-M411 HydrophobicContact CD2-SD 3.94Å
328F98.1Very high96.1Very high0 Ų08.3 Ų8.30%04%0.04CC..Hα-helixtrans-63.8-34.9173.7-80.3-63.9000112.1H221 I226 A233 K284 I287 A288 S324 S325 L326 A331 N332H221-F328 HydrophobicContact CB-CE1 4.12Å; H221-F328 HydrophobicContact CB-CZ 3.9Å; H221-F328 AromaticContact CE1-CE2 3.94Å; H221-F328 AromaticContact CG-CZ 3.81Å; H221-F328 AromaticContact ND1-CE2 3.39Å; H221-F328 WeakPolarHBondContact ND1-CE2 3.22Å; H221-F328 AromaticContact ND1-CZ 3.24Å; H221-F328 WeakPolarHBondContact ND1-CZ 3.27Å; I226-F328 HydrophobicContact CD1-CB 4.07Å; I226-F328 VanDerWaalsContact CD1-O 3.25Å; I226-F328 WeakPolarHBondContact CD1-O 3.42Å; A233-F328 HydrophobicContact CB-CD2 3.83Å; A233-F328 HydrophobicContact CB-CE2 3.66Å; K284-F328 HydrophobicContact CB-CE1 4.41Å; K284-F328 HydrophobicContact CG-CD1 4.41Å; I287-F328 HydrophobicContact CB-CD1 4.44Å; I287-F328 HydrophobicContact CB-CE1 3.97Å; I287-F328 HydrophobicContact CB-CE2 4.4Å; I287-F328 HydrophobicContact CB-CZ 3.94Å; I287-F328 HydrophobicContact CD1-CD1 4.37Å; I287-F328 HydrophobicContact CG2-CD1 4.21Å; I287-F328 HydrophobicContact CG2-CD2 3.84Å; I287-F328 HydrophobicContact CG2-CE1 3.92Å; I287-F328 HydrophobicContact CG2-CE2 3.5Å; I287-F328 HydrophobicContact CG2-CG 4.17Å; I287-F328 HydrophobicContact CG2-CZ 3.54Å; A288-F328 HydrophobicContact CB-CZ 4.43Å; S324-F328 WeakPolarHBondContact O-CD2 3.44Å; S324-F328 PolarHBondContact O-N 3.03Å; S325-F328 PolarHBondContact O-N 2.81Å; L326-F328 VanDerWaalsContact C-N 3.34Å; L326-F328 PolarHBondContact O-N 3.37Å; F328-A331 WeakPolarHBondContact O-CB 3.38Å; F328-A331 PolarHBondContact O-N 3.42Å; F328-N332 WeakPolarHBondContact O-CB 3.46Å; F328-N332 PolarHBondContact O-N 2.98Å
329C97.3Very high95.8Very high4 Ų414.5 Ų14.53%0.0277%0.068CC..Hα-helixtrans-70.1-39.6175.4-65.10000112.9M230 S325 L326 L327 A331 N332 S333 L437 M438M230-C329 PolarHBondContact SD-SG 3.27Å; S325-C329 PolarHBondContact O-N 3.44Å; S325-C329 PolarHBondContact O-SG 3.45Å; L326-C329 WeakPolarHBondContact O-CB 3.43Å; L326-C329 PolarHBondContact O-N 3.19Å; L326-C329 VanDerWaalsContact O-N 3.09Å; L327-C329 VanDerWaalsContact C-N 3.29Å; L327-C329 PolarHBondContact O-N 3.21Å; C329-A331 VanDerWaalsContact C-N 3.34Å; C329-N332 WeakPolarHBondContact O-CB 3.33Å; C329-N332 PolarHBondContact O-N 3.19Å; C329-S333 PolarHBondContact O-N 2.96Å; C329-L437 HydrophobicContact CB-CD2 3.35Å; C329-M438 HydrophobicContact CB-CE 3.87Å; C329-M438 HydrophobicContact CB-SD 4.19Å
330L97.4Very high95.5Very high0 Ų016 Ų160%08%0.078CC..Hα-helixtrans-64-39171.7-71.1171.1000111.6L326 L327 N332 S333 N334 M356 W359 W360 A363 M438L326-L330 HydrophobicContact CD1-CD1 4.35Å; L326-L330 HydrophobicContact CD1-CG 4.29Å; L326-L330 HydrophobicContact CG-CD1 4.17Å; L326-L330 WeakPolarHBondContact O-CG 3.24Å; L326-L330 PolarHBondContact O-N 3.07Å; L327-L330 HydrophobicContact CD2-CD1 4.4Å; L327-L330 PolarHBondContact O-N 3.04Å; L330-N332 VanDerWaalsContact C-N 3.28Å; L330-N332 PolarHBondContact O-N 3.1Å; L330-S333 PolarHBondContact O-N 3.39Å; L330-S333 PolarHBondContact O-OG 2.84Å; L330-N334 PolarHBondContact O-N 2.91Å; L330-M356 HydrophobicContact CD2-CE 3.89Å; L330-M356 HydrophobicContact CD2-CG 4.48Å; L330-M356 HydrophobicContact CD2-SD 3.94Å; L330-W359 HydrophobicContact CD2-CB 4.08Å; L330-W360 HydrophobicContact CB-CD2 4.12Å; L330-W360 HydrophobicContact CB-CE3 4.49Å; L330-W360 HydrophobicContact CB-CH2 3.95Å; L330-W360 HydrophobicContact CB-CZ2 3.56Å; L330-W360 HydrophobicContact CB-CZ3 4.4Å; L330-W360 HydrophobicContact CD1-CD2 4.02Å; L330-W360 HydrophobicContact CD1-CE3 4.23Å; L330-W360 HydrophobicContact CD1-CG 4.2Å; L330-W360 HydrophobicContact CD2-CD2 4.44Å; L330-W360 HydrophobicContact CD2-CG 4.23Å; L330-W360 HydrophobicContact CG-CD2 4.44Å; L330-W360 WeakPolarHBondContact O-CZ2 3.16Å; L330-A363 HydrophobicContact CD1-CB 3.53Å; L330-M438 HydrophobicContact CD2-CE 3.87Å; L330-M438 HydrophobicContact CD2-CG 4.06Å; L330-M438 HydrophobicContact CD2-SD 3.65Å; L330-M438 HydrophobicContact CG-CE 4.2Å; L330-M438 HydrophobicContact CG-SD 3.84Å
331A96.9Very high95.3Very high6 Ų618.3 Ų18.35%0.059%0.087CC..Hα-helixtrans-59.1-43.3170.700000111.5L283 K284 I287 L327 F328 C329 N334 Y335L283-A331 HydrophobicContact CD2-CB 3.1Å; K284-A331 HydrophobicContact CG-CB 4.15Å; I287-A331 HydrophobicContact CD1-CB 3.85Å; L327-A331 WeakPolarHBondContact O-CB 3.33Å; L327-A331 PolarHBondContact O-N 3.32Å; F328-A331 WeakPolarHBondContact O-CB 3.38Å; F328-A331 PolarHBondContact O-N 3.42Å; C329-A331 VanDerWaalsContact C-N 3.34Å; A331-N334 PolarHBondContact O-N 2.9Å; A331-Y335 WeakPolarHBondContact O-CB 2.91Å; A331-Y335 PolarHBondContact O-N 3.02Å
332N96.1Very high95.1Very high12 Ų1221.2 Ų21.26%0.06411%0.105CC..Hα-helixtrans-68.2-36.8-179.3-173.863.1000112.8I226 F328 C329 L330 N334 Y335 E336I226-N332 HydrophobicContact CB-CB 4.22Å; I226-N332 HydrophobicContact CD1-CB 3.69Å; I226-N332 HydrophobicContact CG1-CB 3.82Å; F328-N332 WeakPolarHBondContact O-CB 3.46Å; F328-N332 PolarHBondContact O-N 2.98Å; C329-N332 WeakPolarHBondContact O-CB 3.33Å; C329-N332 PolarHBondContact O-N 3.19Å; L330-N332 VanDerWaalsContact C-N 3.28Å; L330-N332 PolarHBondContact O-N 3.1Å; N332-N334 VanDerWaalsContact C-N 3.25Å; N332-N334 PolarHBondContact O-N 3.12Å; N332-Y335 CarbonylContact O-C 3.25Å; N332-Y335 PolarHBondContact O-N 3.35Å; N332-Y335 VanDerWaalsContact O-N 3.14Å; N332-E336 PolarHBondContact ND2-OE1 3.27Å; N332-E336 WeakPolarHBondContact O-CG 3.48Å; N332-E336 PolarHBondContact O-N 3.46Å
333S95.4Very high94.9Very high3 Ų321 Ų212%0.02110%0.104CC..Hα-helixtrans-62.7-34.8175.762.20000112.3C329 L330 R337 M356C329-S333 PolarHBondContact O-N 2.96Å; L330-S333 PolarHBondContact O-N 3.39Å; L330-S333 PolarHBondContact O-OG 2.84Å; S333-R337 PolarHBondContact O-NH1 3.38Å; S333-M356 WeakPolarHBondContact OG-CE 3.5Å
334N94.8Very high94.6Very high12 Ų1224.9 Ų24.96%0.06412%0.123CC..Hα-helixtrans-70.2-46172.6-66.8-4000109.9L330 A331 N332 E336 R337 I338 W360L330-N334 PolarHBondContact O-N 2.91Å; A331-N334 PolarHBondContact O-N 2.9Å; N332-N334 VanDerWaalsContact C-N 3.25Å; N332-N334 PolarHBondContact O-N 3.12Å; N334-E336 VanDerWaalsContact C-N 3.35Å; N334-E336 PolarHBondContact O-N 3.46Å; N334-R337 PolarHBondContact O-N 3.27Å; N334-R337 VanDerWaalsContact O-N 3.09Å; N334-I338 WeakPolarHBondContact O-CG1 3.33Å; N334-I338 PolarHBondContact O-N 3.1Å; N334-W360 WeakPolarHBondContact ND2-CZ2 3.42Å
335Y94.3Very high94.3Very high36 Ų3628.6 Ų28.614%0.14114%0.142CC..Hα-helixtrans-61.6-37.1-179.7-177.6-99.6000113.7N139 A331 N332 R337 H339 R341N139-Y335 VanDerWaalsContact ND2-CE1 3.28Å; N139-Y335 WeakPolarHBondContact ND2-CE1 3.32Å; N139-Y335 PolarHBondContact ND2-OH 3.12Å; A331-Y335 WeakPolarHBondContact O-CB 2.91Å; A331-Y335 PolarHBondContact O-N 3.02Å; N332-Y335 CarbonylContact O-C 3.25Å; N332-Y335 PolarHBondContact O-N 3.35Å; N332-Y335 VanDerWaalsContact O-N 3.14Å; Y335-R337 PolarHBondContact O-N 3.22Å; Y335-H339 WeakPolarHBondContact CE2-O 3.47Å; Y335-H339 WeakPolarHBondContact O-CA 3.36Å; Y335-H339 PolarHBondContact O-N 3.14Å; Y335-H339 PolarHBondContact O-ND1 3.22Å; Y335-R341 HydrophobicContact CD2-CG 3.8Å; Y335-R341 HydrophobicContact CE2-CG 3.9Å
336E92.6Very high93.8Very high30 Ų3028.9 Ų28.914%0.1414%0.144CC..Hα-helixtrans-64.4-21.9176.7-76.3-177.5-169.500112.9N83 N332 N334 H339 R433N83-E336 PolarHBondContact ND2-OE2 3.35Å; N332-E336 PolarHBondContact ND2-OE1 3.27Å; N332-E336 WeakPolarHBondContact O-CG 3.48Å; N332-E336 PolarHBondContact O-N 3.46Å; N334-E336 VanDerWaalsContact C-N 3.35Å; N334-E336 PolarHBondContact O-N 3.46Å; E336-H339 PolarHBondContact O-CE1 2.73Å; E336-R433 IonicContact OE1-NH2 3.8Å; E336-R433 PolarHBondContact OE1-NH2 3.44Å; E336-R433 VanDerWaalsContact OE1-NH2 3.13Å; E336-R433 IonicContact OE2-NH2 3.97Å; E336-R433 PolarHBondContact OE2-NH2 2.69Å
337R91.8Very high93.5Very high36 Ų3634.2 Ų34.214%0.13616%0.164CC..Hα-helixtrans-98.7-42.5179.1-64.1178.3177.781.22.6113.2S333 N334 Y335 L427 Q428 P429 E434S333-R337 PolarHBondContact O-NH1 3.38Å; N334-R337 PolarHBondContact O-N 3.27Å; N334-R337 VanDerWaalsContact O-N 3.09Å; Y335-R337 PolarHBondContact O-N 3.22Å; R337-L427 HydrophobicContact CB-CD2 3.67Å; R337-L427 HydrophobicContact CG-CD2 4.4Å; R337-Q428 PolarHBondContact NE-O 3.18Å; R337-P429 PolarHBondContact NH2-O 3.18Å; R337-E434 IonicContact CZ-OE1 3.48Å; R337-E434 IonicContact CZ-OE2 2.87Å; R337-E434 IonicContact NH1-OE1 2.65Å; R337-E434 IonicContact NH1-OE2 2.78Å; R337-E434 PolarHBondContact NH1-OE2 3.41Å; R337-E434 IonicContact NH2-OE1 3.42Å; R337-E434 PolarHBondContact NH2-OE1 2.68Å; R337-E434 IonicContact NH2-OE2 3.79Å; R337-E434 PolarHBondContact NH2-OE2 3.39Å
338I90.9Very high93.2Very high19 Ų1934.2 Ų34.210%0.09716%0.164CC..Hα-helixtrans-95.4-21.5-171.2-47.4-174.8000111.2N334 S340 M345 A346 M424N334-I338 WeakPolarHBondContact O-CG1 3.33Å; N334-I338 PolarHBondContact O-N 3.1Å; I338-S340 VanDerWaalsContact CG2-OG 3.3Å; I338-S340 WeakPolarHBondContact CG2-OG 3.2Å; I338-S340 PolarHBondContact O-N 2.94Å; I338-M345 HydrophobicContact CG2-CB 4.46Å; I338-M345 HydrophobicContact CG2-CE 3.85Å; I338-M345 HydrophobicContact CG2-CG 3.78Å; I338-M345 HydrophobicContact CG2-SD 3.76Å; I338-A346 HydrophobicContact CD1-CB 3.51Å; I338-M424 HydrophobicContact CB-CE 3.99Å; I338-M424 HydrophobicContact CD1-CE 3.91Å; I338-M424 HydrophobicContact CG1-CE 3.46Å; I338-M424 VanDerWaalsContact CG1-CE 3.46Å; I338-M424 HydrophobicContact CG2-CE 3.74Å; I338-M424 HydrophobicContact CG2-SD 4.15Å
339H91.3Very high93Very high138 Ų13834.5 Ų34.564%0.63917%0.166SC*.  trans57.510.7-174.7-61.2-51.2000115.5Y335 E336Y335-H339 WeakPolarHBondContact CE2-O 3.47Å; Y335-H339 WeakPolarHBondContact O-CA 3.36Å; Y335-H339 PolarHBondContact O-N 3.14Å; Y335-H339 PolarHBondContact O-ND1 3.22Å; E336-H339 PolarHBondContact O-CE1 2.73Å
340S90.9Very high92.9Very high32 Ų3238.9 Ų38.922%0.22419%0.186CC..  trans-120.7150.217273.40000110.6I338 T342 M345I338-S340 VanDerWaalsContact CG2-OG 3.3Å; I338-S340 WeakPolarHBondContact CG2-OG 3.2Å; I338-S340 PolarHBondContact O-N 2.94Å; S340-T342 PolarHBondContact OG-OG1 3.18Å; S340-M345 PolarHBondContact OG-SD 3.23Å
341R91.9Very high92.6Very high50 Ų5046.7 Ų46.719%0.18922%0.224CC..  trans-91.6-4.2176.4-60.9-174.5-65.9-150.12112.5V222 E223 L283 Y335 M343V222-R341 PolarHBondContact O-NH1 2.99Å; E223-R341 IonicContact OE1-CZ 3.13Å; E223-R341 IonicContact OE1-NH1 3.34Å; E223-R341 PolarHBondContact OE1-NH1 3.12Å; E223-R341 IonicContact OE1-NH2 2.74Å; E223-R341 PolarHBondContact OE1-NH2 2.9Å; E223-R341 IonicContact OE2-NH1 2.98Å; E223-R341 PolarHBondContact OE2-NH1 2.82Å; L283-R341 PolarHBondContact N-O 3.08Å; Y335-R341 HydrophobicContact CD2-CG 3.8Å; Y335-R341 HydrophobicContact CE2-CG 3.9Å; R341-M343 PolarHBondContact O-N 2.87Å
342T93.7Very high92.3Very high60 Ų6049.4 Ų49.437%0.36824%0.237SC..BIsolated β-bridgetrans-74.1118.2-172.550.70000110.7S340 I344 M345S340-T342 PolarHBondContact OG-OG1 3.18Å; T342-I344 VanDerWaalsContact C-N 3.31Å; T342-I344 PolarHBondContact O-N 3.4Å; T342-M345 WeakPolarHBondContact O-CB 3.39Å; T342-M345 PolarHBondContact O-N 3.43Å; T342-M345 VanDerWaalsContact O-N 3.15Å; T342-M345 WeakPolarHBondContact OG1-CB 3.44Å
343M92.9Very high92.3Very high1 Ų149.3 Ų49.31%0.00524%0.236CC..G310 helixtrans-62.2-37.7-172.9-178.9163.345.500112.8Q280 T281 L283 L286 R341 M345 A346 Y410 T414 T415Q280-M343 WeakPolarHBondContact O-CE 3.23Å; T281-M343 WeakPolarHBondContact O-CB 3.5Å; T281-M343 PolarHBondContact O-N 3.02Å; L283-M343 HydrophobicContact CB-CB 4.27Å; L283-M343 HydrophobicContact CD1-CG 4.23Å; L283-M343 HydrophobicContact CD1-SD 4.45Å; L286-M343 HydrophobicContact CD1-CE 3.74Å; L286-M343 HydrophobicContact CD1-SD 4.1Å; R341-M343 PolarHBondContact O-N 2.87Å; M343-M345 PolarHBondContact O-N 3.33Å; M343-A346 PolarHBondContact O-N 3.38Å; M343-A346 VanDerWaalsContact O-N 3.11Å; M343-Y410 HydrophobicContact CE-CD1 4.28Å; M343-Y410 HydrophobicContact CE-CE1 3.49Å; M343-Y410 VanDerWaalsContact CE-CE1 3.49Å; M343-Y410 HydrophobicContact SD-CE1 4.36Å; M343-T414 WeakPolarHBondContact CG-OG1 3.38Å; M343-T414 PolarHBondContact SD-OG1 3Å; M343-T415 HydrophobicContact CG-CG2 3.9Å
344I91.5Very high92.2Very high81 Ų8153.2 Ų53.242%0.41526%0.262SS..G310 helixtrans-66.9-22.1-179-63.5170.8000112.2T342 A346 R347T342-I344 VanDerWaalsContact C-N 3.31Å; T342-I344 PolarHBondContact O-N 3.4Å; I344-A346 VanDerWaalsContact C-N 3.34Å; I344-R347 VanDerWaalsContact CG2-CZ 3.45Å; I344-R347 VanDerWaalsContact CG2-NH2 3.26Å; I344-R347 PolarHBondContact O-NE 2.87Å; I344-R347 PolarHBondContact O-NH2 3.48Å
345M89.7Confident92.2Very high80 Ų8056.9 Ų56.939%0.39428%0.281SS..G310 helixtrans-77.1-25176.6-165.8168.1178.700112I338 S340 T342 M343 R347 T421 M424I338-M345 HydrophobicContact CG2-CB 4.46Å; I338-M345 HydrophobicContact CG2-CE 3.85Å; I338-M345 HydrophobicContact CG2-CG 3.78Å; I338-M345 HydrophobicContact CG2-SD 3.76Å; S340-M345 PolarHBondContact OG-SD 3.23Å; T342-M345 WeakPolarHBondContact O-CB 3.39Å; T342-M345 PolarHBondContact O-N 3.43Å; T342-M345 VanDerWaalsContact O-N 3.15Å; T342-M345 WeakPolarHBondContact OG1-CB 3.44Å; M343-M345 PolarHBondContact O-N 3.33Å; M345-R347 PolarHBondContact O-N 3.29Å; M345-T421 PolarHBondContact O-OG1 2.83Å; M345-M424 HydrophobicContact CE-SD 4.07Å
346A86Confident92.3Very high6 Ų655.2 Ų55.25%0.0527%0.274CS..SBendtrans-96.649.2-176.800000112I338 M343 I344 L349 T415I338-A346 HydrophobicContact CD1-CB 3.51Å; M343-A346 PolarHBondContact O-N 3.38Å; M343-A346 VanDerWaalsContact O-N 3.11Å; I344-A346 VanDerWaalsContact C-N 3.34Å; A346-L349 HydrophobicContact CB-CD1 4.07Å; A346-T415 CarbonylContact O-C 3.55Å; A346-T415 VanDerWaalsContact O-C 3.3Å; A346-T415 WeakPolarHBondContact O-CA 3.28Å
347R92.1Very high92.5Very high113 Ų11354.1 Ų54.143%0.42627%0.27SS..  trans-91.5149-175.4-86.6-179.2-73.9-177.91.5113.6I344 M345 L349 T414 T415 T421I344-R347 VanDerWaalsContact CG2-CZ 3.45Å; I344-R347 VanDerWaalsContact CG2-NH2 3.26Å; I344-R347 PolarHBondContact O-NE 2.87Å; I344-R347 PolarHBondContact O-NH2 3.48Å; M345-R347 PolarHBondContact O-N 3.29Å; R347-L349 VanDerWaalsContact C-N 3.31Å; R347-L349 PolarHBondContact O-N 3.31Å; R347-T414 WeakPolarHBondContact CG-O 3.44Å; R347-T415 CarbonylContact C-O 3.57Å; R347-T421 HydrophobicContact CB-CG2 4.22Å
348G92.1Very high92.7Very high0 Ų055.6 Ų55.60%028%0.283CS..  trans69.921.517100000115.2Q350 M351 T415 Q416 R417 G418G348-Q350 PolarHBondContact O-N 3.46Å; G348-M351 PolarHBondContact O-N 3.41Å; G348-T415 PolarHBondContact N-O 3Å; G348-Q416 CarbonylContact C-O 3.3Å; G348-Q416 VanDerWaalsContact C-O 3.25Å; G348-Q416 WeakPolarHBondContact CA-O 3.29Å; G348-R417 PolarHBondContact N-O 3.16Å; G348-R417 VanDerWaalsContact N-O 3.16Å; G348-G418 WeakPolarHBondContact CA-O 3.34Å
349L93.6Very high93Very high5 Ų556.6 Ų56.63%0.02629%0.286CS..G310 helixtrans-66.2-17.5-173.5-69.2174.1000114.4A346 R347 M351 I352 F353 T415 Q416 L427A346-L349 HydrophobicContact CB-CD1 4.07Å; R347-L349 VanDerWaalsContact C-N 3.31Å; R347-L349 PolarHBondContact O-N 3.31Å; L349-M351 PolarHBondContact O-N 3.44Å; L349-I352 PolarHBondContact O-N 3.23Å; L349-I352 VanDerWaalsContact O-N 3.14Å; L349-F353 HydrophobicContact CD2-CD2 4.37Å; L349-F353 HydrophobicContact CD2-CE2 4.3Å; L349-F353 PolarHBondContact O-N 3.16Å; L349-T415 PolarHBondContact N-O 3.49Å; L349-Q416 PolarHBondContact N-O 3.47Å; L349-L427 HydrophobicContact CD2-CD1 4.05Å
350Q95.4Very high93.3Very high96 Ų9650 Ų5045%0.44926%0.255SS..G310 helixtrans-60.5-33.9176.9-177.7176.5-1.800112.8G348 I352 A357 Q416G348-Q350 PolarHBondContact O-N 3.46Å; Q350-I352 VanDerWaalsContact C-N 3.26Å; Q350-I352 PolarHBondContact O-N 3.28Å; Q350-A357 HydrophobicContact CB-CB 3.83Å; Q350-A357 HydrophobicContact CG-CB 3.77Å; Q350-Q416 HydrophobicContact CB-CB 4.29Å; Q350-Q416 WeakPolarHBondContact CB-O 3.4Å; Q350-Q416 PolarHBondContact N-O 3Å
351M90.9Very high93.6Very high165 Ų16552 Ų5281%0.81326%0.264SS*.G310 helixtrans-67.3-29.4179.3-67.3-102.7-7500112.1G348 L349G348-M351 PolarHBondContact O-N 3.41Å; L349-M351 PolarHBondContact O-N 3.44Å
352I91.4Very high93.9Very high63 Ų6352.7 Ų52.732%0.32327%0.27SS..THydrogen-bonded Turntrans-94.5-44.6-178.4-53.6-177.2000111L349 Q350 P354 L420 L427L349-I352 PolarHBondContact O-N 3.23Å; L349-I352 VanDerWaalsContact O-N 3.14Å; Q350-I352 VanDerWaalsContact C-N 3.26Å; Q350-I352 PolarHBondContact O-N 3.28Å; I352-P354 WeakPolarHBondContact O-CD 3.27Å; I352-L420 HydrophobicContact CD1-CD1 3.27Å; I352-L420 HydrophobicContact CD1-CD2 3.97Å; I352-L420 HydrophobicContact CD1-CG 4.24Å; I352-L420 HydrophobicContact CG1-CD1 3.76Å; I352-L427 HydrophobicContact CD1-CD1 3.69Å
353F94.3Very high94Very high10 Ų1049.9 Ų49.94%0.04425%0.253CS..  trans-122.373.9-173.5-52.1-49.8000111.4L349 L355 M356 A357 L427 Q428L349-F353 HydrophobicContact CD2-CD2 4.37Å; L349-F353 HydrophobicContact CD2-CE2 4.3Å; L349-F353 PolarHBondContact O-N 3.16Å; F353-L355 VanDerWaalsContact C-N 3.35Å; F353-L355 PolarHBondContact O-N 3.36Å; F353-M356 HydrophobicContact CB-CB 3.67Å; F353-M356 PolarHBondContact O-N 3.25Å; F353-M356 VanDerWaalsContact O-N 3.14Å; F353-A357 PolarHBondContact O-N 3.44Å; F353-L427 HydrophobicContact CE2-CB 4.35Å; F353-L427 HydrophobicContact CZ-CB 3.83Å; F353-Q428 WeakPolarHBondContact CE1-O 3.44Å; F353-Q428 WeakPolarHBondContact CZ-O 3.37Å
354P93.8Very high94.2Very high85 Ų8549.8 Ų49.855%0.55225%0.253SS*.Hα-helixtrans-61-43-174.823.5-33.7000112.1I352 M356 A357 T358I352-P354 WeakPolarHBondContact O-CD 3.27Å; P354-M356 PolarHBondContact O-N 3.02Å; P354-A357 WeakPolarHBondContact O-CB 3.21Å; P354-A357 PolarHBondContact O-N 3.37Å; P354-T358 WeakPolarHBondContact O-CG2 3.43Å; P354-T358 PolarHBondContact O-N 3.04Å
355L96Very high94.4Very high88 Ų8847.9 Ų47.946%0.46124%0.243SC..Hα-helixtrans-65.5-39.1177.9-171.764.5000111.5F353 A357 T358 W359 L435F353-L355 VanDerWaalsContact C-N 3.35Å; F353-L355 PolarHBondContact O-N 3.36Å; L355-A357 VanDerWaalsContact C-N 3.32Å; L355-A357 PolarHBondContact O-N 3.15Å; L355-T358 PolarHBondContact O-N 3.38Å; L355-T358 PolarHBondContact O-OG1 3.34Å; L355-W359 VanDerWaalsContact O-CD1 3.25Å; L355-W359 PolarHBondContact O-N 3.21Å; L355-L435 HydrophobicContact CB-CD2 4.37Å; L355-L435 HydrophobicContact CD2-CD1 3.59Å; L355-L435 HydrophobicContact CD2-CD2 3.5Å; L355-L435 HydrophobicContact CD2-CG 4.13Å; L355-L435 HydrophobicContact CG-CD2 3.77Å
356M96.3Very high94.7Very high2 Ų244.2 Ų44.21%0.0123%0.226CC..Hα-helixtrans-65.8-38175.2-160.460.8149.300111.9L330 S333 F353 P354 T358 W359 W360 E434 M438L330-M356 HydrophobicContact CD2-CE 3.89Å; L330-M356 HydrophobicContact CD2-CG 4.48Å; L330-M356 HydrophobicContact CD2-SD 3.94Å; S333-M356 WeakPolarHBondContact OG-CE 3.5Å; F353-M356 HydrophobicContact CB-CB 3.67Å; F353-M356 PolarHBondContact O-N 3.25Å; F353-M356 VanDerWaalsContact O-N 3.14Å; P354-M356 PolarHBondContact O-N 3.02Å; M356-T358 VanDerWaalsContact C-N 3.27Å; M356-T358 PolarHBondContact O-N 2.99Å; M356-W359 WeakPolarHBondContact O-CB 3.24Å; M356-W359 PolarHBondContact O-N 3.44Å; M356-W359 VanDerWaalsContact O-N 3.12Å; M356-W360 VanDerWaalsContact O-CD1 3.31Å; M356-W360 PolarHBondContact O-N 3.14Å; M356-E434 HydrophobicContact CE-CB 4.36Å; M356-M438 HydrophobicContact CE-CE 3.54Å; M356-M438 HydrophobicContact CE-CG 4.3Å; M356-M438 HydrophobicContact SD-CG 4.1Å
357A96.3Very high95.2Very high7 Ų744 Ų446%0.05822%0.224CC..Hα-helixtrans-62.7-33.4174.400000112.4Q350 F353 P354 L355 W360 L361 Q416Q350-A357 HydrophobicContact CB-CB 3.83Å; Q350-A357 HydrophobicContact CG-CB 3.77Å; F353-A357 PolarHBondContact O-N 3.44Å; P354-A357 WeakPolarHBondContact O-CB 3.21Å; P354-A357 PolarHBondContact O-N 3.37Å; L355-A357 VanDerWaalsContact C-N 3.32Å; L355-A357 PolarHBondContact O-N 3.15Å; A357-W360 WeakPolarHBondContact O-CB 3.1Å; A357-W360 PolarHBondContact O-N 2.99Å; A357-L361 WeakPolarHBondContact O-CB 3.47Å; A357-L361 PolarHBondContact O-N 2.89Å; A357-Q416 HydrophobicContact CB-CB 4.49Å; A357-Q416 HydrophobicContact CB-CG 4.39Å
358T96.2Very high95.4Very high67 Ų6740 Ų4041%0.41121%0.211SC..Hα-helixtrans-64.2-39.8171.565.90000112.2P354 L355 M356 L361 L362P354-T358 WeakPolarHBondContact O-CG2 3.43Å; P354-T358 PolarHBondContact O-N 3.04Å; L355-T358 PolarHBondContact O-N 3.38Å; L355-T358 PolarHBondContact O-OG1 3.34Å; M356-T358 VanDerWaalsContact C-N 3.27Å; M356-T358 PolarHBondContact O-N 2.99Å; T358-L361 PolarHBondContact O-N 3.46Å; T358-L362 WeakPolarHBondContact O-CG 3.33Å; T358-L362 PolarHBondContact O-N 2.94Å
359W97.5Very high95.5Very high39 Ų3940.3 Ų40.315%0.14821%0.213CC..Hα-helixtrans-65.3-39.9173.6-65.8120000112.5L330 L355 M356 L361 L362 A363 M438 A439 M442L330-W359 HydrophobicContact CD2-CB 4.08Å; L355-W359 VanDerWaalsContact O-CD1 3.25Å; L355-W359 PolarHBondContact O-N 3.21Å; M356-W359 WeakPolarHBondContact O-CB 3.24Å; M356-W359 PolarHBondContact O-N 3.44Å; M356-W359 VanDerWaalsContact O-N 3.12Å; W359-L361 VanDerWaalsContact C-N 3.34Å; W359-L361 PolarHBondContact O-N 3.31Å; W359-L362 HydrophobicContact CE3-CD1 3.95Å; W359-L362 HydrophobicContact CZ3-CD1 4.01Å; W359-L362 PolarHBondContact O-N 3.04Å; W359-A363 VanDerWaalsContact O-CB 3.26Å; W359-A363 WeakPolarHBondContact O-CB 3.49Å; W359-A363 PolarHBondContact O-N 3.33Å; W359-M438 HydrophobicContact CB-CB 4.07Å; W359-M438 HydrophobicContact CB-CG 4.15Å; W359-M438 HydrophobicContact CD2-CB 3.58Å; W359-M438 HydrophobicContact CE3-CB 4.12Å; W359-M438 HydrophobicContact CG-CB 3.56Å; W359-M438 HydrophobicContact CG-CG 3.99Å; W359-A439 HydrophobicContact CH2-CB 3.88Å; W359-A439 HydrophobicContact CZ2-CB 3.9Å; W359-M442 HydrophobicContact CE3-CB 4.13Å; W359-M442 HydrophobicContact CE3-CG 3.63Å; W359-M442 HydrophobicContact CH2-CB 4.42Å; W359-M442 HydrophobicContact CZ3-CB 3.5Å; W359-M442 HydrophobicContact CZ3-CG 3.55Å
360W97.5Very high95.5Very high0 Ų043.6 Ų43.60%023%0.23CC..Hα-helixtrans-58.6-44.8171.5-87.399.1000112.3L283 L330 N334 M356 A357 S364 M411 Q416L283-W360 HydrophobicContact CD1-CH2 3.74Å; L283-W360 HydrophobicContact CD1-CZ3 4.43Å; L283-W360 HydrophobicContact CD2-CH2 3.99Å; L283-W360 HydrophobicContact CG-CH2 4.42Å; L330-W360 HydrophobicContact CB-CD2 4.12Å; L330-W360 HydrophobicContact CB-CE3 4.49Å; L330-W360 HydrophobicContact CB-CH2 3.95Å; L330-W360 HydrophobicContact CB-CZ2 3.56Å; L330-W360 HydrophobicContact CB-CZ3 4.4Å; L330-W360 HydrophobicContact CD1-CD2 4.02Å; L330-W360 HydrophobicContact CD1-CE3 4.23Å; L330-W360 HydrophobicContact CD1-CG 4.2Å; L330-W360 HydrophobicContact CD2-CD2 4.44Å; L330-W360 HydrophobicContact CD2-CG 4.23Å; L330-W360 HydrophobicContact CG-CD2 4.44Å; L330-W360 WeakPolarHBondContact O-CZ2 3.16Å; N334-W360 WeakPolarHBondContact ND2-CZ2 3.42Å; M356-W360 VanDerWaalsContact O-CD1 3.31Å; M356-W360 PolarHBondContact O-N 3.14Å; A357-W360 WeakPolarHBondContact O-CB 3.1Å; A357-W360 PolarHBondContact O-N 2.99Å; W360-S364 VanDerWaalsContact O-CB 3.3Å; W360-S364 WeakPolarHBondContact O-CB 3.39Å; W360-S364 PolarHBondContact O-N 3.2Å; W360-S364 PolarHBondContact O-OG 3.34Å; W360-M411 HydrophobicContact CE3-SD 4.43Å; W360-M411 HydrophobicContact CZ3-CG 4.02Å; W360-M411 HydrophobicContact CZ3-SD 3.7Å; W360-Q416 HydrophobicContact CB-CG 3.73Å; W360-Q416 VanDerWaalsContact CD1-CD 3.46Å; W360-Q416 HydrophobicContact CD2-CG 4.43Å; W360-Q416 HydrophobicContact CG-CG 3.86Å
361L97.4Very high95.3Very high75 Ų7543.1 Ų43.139%0.39324%0.235SC..Hα-helixtrans-64.1-45.5177.3-179.6139.5000111.3A357 T358 W359 S364 L365A357-L361 WeakPolarHBondContact O-CB 3.47Å; A357-L361 PolarHBondContact O-N 2.89Å; T358-L361 PolarHBondContact O-N 3.46Å; W359-L361 VanDerWaalsContact C-N 3.34Å; W359-L361 PolarHBondContact O-N 3.31Å; L361-S364 WeakPolarHBondContact CA-OG 3.42Å; L361-S364 PolarHBondContact O-N 3.45Å; L361-S364 PolarHBondContact O-OG 3.16Å; L361-L365 HydrophobicContact CD2-CD1 3.49Å; L361-L365 VanDerWaalsContact CD2-CD1 3.49Å; L361-L365 HydrophobicContact CD2-CG 4.34Å; L361-L365 HydrophobicContact CG-CD1 4.1Å; L361-L365 HydrophobicContact CG-CG 4.46Å; L361-L365 WeakPolarHBondContact O-CB 3.41Å; L361-L365 WeakPolarHBondContact O-CG 3.33Å; L361-L365 PolarHBondContact O-N 2.99Å
362L96.7Very high95.2Very high64 Ų6439.8 Ų39.834%0.33523%0.226SC..Hα-helixtrans-64.5-43.2177.4-72172.5000112.6T358 W359 S364 L365 A366 M442T358-L362 WeakPolarHBondContact O-CG 3.33Å; T358-L362 PolarHBondContact O-N 2.94Å; W359-L362 HydrophobicContact CE3-CD1 3.95Å; W359-L362 HydrophobicContact CZ3-CD1 4.01Å; W359-L362 PolarHBondContact O-N 3.04Å; L362-S364 VanDerWaalsContact C-N 3.34Å; L362-S364 PolarHBondContact O-N 3.03Å; L362-L365 PolarHBondContact O-N 3.47Å; L362-A366 WeakPolarHBondContact O-CB 3.41Å; L362-A366 PolarHBondContact O-N 3.5Å; L362-M442 HydrophobicContact CB-CE 3.75Å; L362-M442 HydrophobicContact CB-SD 4.27Å; L362-M442 HydrophobicContact CD1-CE 4.45Å
363A96.9Very high95.3Very high0 Ų037.4 Ų37.40%022%0.215CC..Hα-helixtrans-63.9-40.3179.600000112.3L326 L327 L330 W359 A366 N367L326-A363 HydrophobicContact CD2-CB 3.48Å; L326-A363 VanDerWaalsContact CD2-CB 3.48Å; L326-A363 HydrophobicContact CG-CB 3.87Å; L327-A363 HydrophobicContact CD2-CB 3.81Å; L327-A363 HydrophobicContact CG-CB 4.39Å; L330-A363 HydrophobicContact CD1-CB 3.53Å; W359-A363 VanDerWaalsContact O-CB 3.26Å; W359-A363 WeakPolarHBondContact O-CB 3.49Å; W359-A363 PolarHBondContact O-N 3.33Å; A363-A366 PolarHBondContact O-N 2.94Å; A363-N367 WeakPolarHBondContact O-CB 3.4Å; A363-N367 PolarHBondContact O-N 2.84Å
364S97.1Very high95.3Very high0 Ų037 Ų370%021%0.214CC..Hα-helixtrans-73.8-38.1178.252.10000112.7W360 L361 L362 A366 N367 L368 I412W360-S364 VanDerWaalsContact O-CB 3.3Å; W360-S364 WeakPolarHBondContact O-CB 3.39Å; W360-S364 PolarHBondContact O-N 3.2Å; W360-S364 PolarHBondContact O-OG 3.34Å; L361-S364 WeakPolarHBondContact CA-OG 3.42Å; L361-S364 PolarHBondContact O-N 3.45Å; L361-S364 PolarHBondContact O-OG 3.16Å; L362-S364 VanDerWaalsContact C-N 3.34Å; L362-S364 PolarHBondContact O-N 3.03Å; S364-A366 VanDerWaalsContact C-N 3.3Å; S364-A366 PolarHBondContact O-N 3.3Å; S364-N367 PolarHBondContact O-N 2.82Å; S364-N367 VanDerWaalsContact O-N 3.13Å; S364-L368 WeakPolarHBondContact O-CG 3.2Å; S364-L368 PolarHBondContact O-N 2.89Å; S364-I412 WeakPolarHBondContact OG-CD1 3.37Å; S364-I412 WeakPolarHBondContact OG-CG1 3.35Å
365L96.3Very high95.4Very high40 Ų4033.1 Ų33.121%0.20919%0.188CC..Hα-helixtrans-60.5-40.2169.8-73.1175.3000111.5L361 L362 L368 A369 L370L361-L365 HydrophobicContact CD2-CD1 3.49Å; L361-L365 VanDerWaalsContact CD2-CD1 3.49Å; L361-L365 HydrophobicContact CD2-CG 4.34Å; L361-L365 HydrophobicContact CG-CD1 4.1Å; L361-L365 HydrophobicContact CG-CG 4.46Å; L361-L365 WeakPolarHBondContact O-CB 3.41Å; L361-L365 WeakPolarHBondContact O-CG 3.33Å; L361-L365 PolarHBondContact O-N 2.99Å; L362-L365 PolarHBondContact O-N 3.47Å; L365-L368 HydrophobicContact CD2-CD2 4.26Å; L365-L368 WeakPolarHBondContact O-CG 3.46Å; L365-A369 PolarHBondContact O-N 3.05Å; L365-L370 HydrophobicContact CB-CB 4.32Å; L365-L370 HydrophobicContact CB-CD2 4.35Å; L365-L370 HydrophobicContact CD1-CD2 4.28Å; L365-L370 HydrophobicContact CD2-CD1 4.2Å; L365-L370 HydrophobicContact CD2-CD2 4.25Å; L365-L370 WeakPolarHBondContact O-CB 3.28Å; L365-L370 PolarHBondContact O-N 3.03Å
366A95.4Very high95.4Very high4 Ų431.2 Ų31.23%0.03318%0.178CC..Hα-helixtrans-65.4-42.4172.700000110.7T323 L362 A363 S364 L368 A369 N375 L445T323-A366 HydrophobicContact CG2-CB 3.49Å; T323-A366 VanDerWaalsContact CG2-CB 3.49Å; L362-A366 WeakPolarHBondContact O-CB 3.41Å; L362-A366 PolarHBondContact O-N 3.5Å; A363-A366 PolarHBondContact O-N 2.94Å; S364-A366 VanDerWaalsContact C-N 3.3Å; S364-A366 PolarHBondContact O-N 3.3Å; A366-L368 VanDerWaalsContact C-N 3.35Å; A366-L368 PolarHBondContact O-N 2.92Å; A366-A369 PolarHBondContact O-N 3.25Å; A366-N375 WeakPolarHBondContact O-CB 3.38Å; A366-N375 PolarHBondContact O-ND2 3.41Å; A366-L445 HydrophobicContact CB-CD1 4.41Å; A366-L445 HydrophobicContact CB-CD2 4.17Å
367N96.4Very high95.3Very high1 Ų133.7 Ų33.71%0.00519%0.19CC..Hα-helixtrans-65.9-30.9-179.3-167.433.9000114.4H294 L327 A363 S364 A369H294-N367 PolarHBondContact NE2-O 3.46Å; H294-N367 PolarHBondContact NE2-OD1 3.16Å; L327-N367 HydrophobicContact CD1-CB 4.08Å; A363-N367 WeakPolarHBondContact O-CB 3.4Å; A363-N367 PolarHBondContact O-N 2.84Å; S364-N367 PolarHBondContact O-N 2.82Å; S364-N367 VanDerWaalsContact O-N 3.13Å; N367-A369 PolarHBondContact O-N 3.38Å
368L95.2Very high95.2Very high30 Ų3033.3 Ų33.316%0.15719%0.187CC..THydrogen-bonded Turntrans-84.97.9172.966.382.7000113.9S364 L365 A366 L370 S408 M409S364-L368 WeakPolarHBondContact O-CG 3.2Å; S364-L368 PolarHBondContact O-N 2.89Å; L365-L368 HydrophobicContact CD2-CD2 4.26Å; L365-L368 WeakPolarHBondContact O-CG 3.46Å; A366-L368 VanDerWaalsContact C-N 3.35Å; A366-L368 PolarHBondContact O-N 2.92Å; L368-L370 HydrophobicContact CD1-CB 3.98Å; L368-L370 HydrophobicContact CD1-CD1 4.28Å; L368-S408 WeakPolarHBondContact CB-OG 3.44Å; L368-M409 HydrophobicContact CD2-CE 3.9Å
369A95.1Very high95.2Very high6 Ų630.6 Ų30.65%0.0517%0.17CC..THydrogen-bonded Turntrans58.456-179.300000113.5L365 A366 N367 N375 L376 E379L365-A369 PolarHBondContact O-N 3.05Å; A366-A369 PolarHBondContact O-N 3.25Å; N367-A369 PolarHBondContact O-N 3.38Å; A369-N375 HydrophobicContact CB-CB 4.1Å; A369-L376 HydrophobicContact CB-CB 4.06Å; A369-L376 HydrophobicContact CB-CD1 4.23Å; A369-L376 WeakPolarHBondContact O-CB 3.12Å; A369-L376 VanDerWaalsContact O-CD1 3.29Å; A369-L376 WeakPolarHBondContact O-CD1 3.31Å; A369-E379 VanDerWaalsContact CB-OE2 3.31Å; A369-E379 WeakPolarHBondContact CB-OE2 3.44Å
370L94.1Very high95.2Very high74 Ų7432.6 Ų32.639%0.38718%0.183SC..  trans-66.5136.9175-171.183.8000111.3L365 L368 S373L365-L370 HydrophobicContact CB-CB 4.32Å; L365-L370 HydrophobicContact CB-CD2 4.35Å; L365-L370 HydrophobicContact CD1-CD2 4.28Å; L365-L370 HydrophobicContact CD2-CD1 4.2Å; L365-L370 HydrophobicContact CD2-CD2 4.25Å; L365-L370 WeakPolarHBondContact O-CB 3.28Å; L365-L370 PolarHBondContact O-N 3.03Å; L368-L370 HydrophobicContact CD1-CB 3.98Å; L368-L370 HydrophobicContact CD1-CD1 4.28Å; L370-S373 WeakPolarHBondContact O-CB 3.37Å; L370-S373 PolarHBondContact O-N 3.36Å; L370-S373 PolarHBondContact O-OG 2.84Å
371P90.3Very high95.1Very high85 Ų8535 Ų3555%0.55219%0.193SC*.THydrogen-bonded Turntrans-64.8138.9168.723.5-31.1000111.5L376P371-L376 VanDerWaalsContact CA-CD2 3.49Å; P371-L376 HydrophobicContact CB-CD2 3.48Å; P371-L376 VanDerWaalsContact CB-CD2 3.48Å; P371-L376 HydrophobicContact CG-CD2 4.19Å
372P89.9Confident95.1Very high96 Ų9631.4 Ų31.462%0.62318%0.175SC*.THydrogen-bonded Turncis-99.237.91.739.5-36.1000114.1
373S93.7Very high95.1Very high13 Ų1329.1 Ų29.19%0.09116%0.164CC..SBendtrans-66155.2-178.272.40000113.1L370 N375 L376 M377L370-S373 WeakPolarHBondContact O-CB 3.37Å; L370-S373 PolarHBondContact O-N 3.36Å; L370-S373 PolarHBondContact O-OG 2.84Å; S373-N375 VanDerWaalsContact C-N 3.25Å; S373-N375 PolarHBondContact O-N 3.49Å; S373-L376 WeakPolarHBondContact O-CB 3.28Å; S373-L376 PolarHBondContact O-N 2.88Å; S373-L376 VanDerWaalsContact O-N 3.14Å; S373-M377 PolarHBondContact O-N 2.94Å; S373-M377 VanDerWaalsContact O-N 3.16Å
374I94.1Very high95.1Very high2 Ų234.4 Ų34.41%0.0119%0.19CC..Hα-helixtrans-65.5-30.7177.4-56.8133.3000111.7M315 A319 L376 M377 G378 L445 L448 T449 I455M315-I374 HydrophobicContact CB-CG2 4.06Å; M315-I374 HydrophobicContact CG-CG2 4.48Å; A319-I374 HydrophobicContact CB-CB 3.76Å; A319-I374 HydrophobicContact CB-CG2 3.58Å; I374-L376 PolarHBondContact O-N 3.24Å; I374-M377 PolarHBondContact O-N 2.74Å; I374-M377 VanDerWaalsContact O-N 3.14Å; I374-G378 PolarHBondContact O-N 3.3Å; I374-L445 WeakPolarHBondContact CD1-O 3.47Å; I374-L448 HydrophobicContact CD1-CB 3.22Å; I374-L448 HydrophobicContact CD1-CD1 4.41Å; I374-L448 HydrophobicContact CD1-CG 4.45Å; I374-L448 HydrophobicContact CG1-CB 4.17Å; I374-T449 HydrophobicContact CD1-CG2 4.01Å; I374-T449 HydrophobicContact CG1-CG2 3.97Å; I374-I455 HydrophobicContact CB-CD1 4.31Å; I374-I455 HydrophobicContact CD1-CD1 4.34Å; I374-I455 HydrophobicContact CG1-CD1 4.03Å; I374-I455 HydrophobicContact CG2-CD1 3.3Å
375N95.4Very high95.1Very high2 Ų234.5 Ų34.51%0.01119%0.19CC..Hα-helixtrans-57.4-43.5174.2-78.4-25.8000110.4A319 H320 T323 A366 A369 S373 G378 E379A319-N375 WeakPolarHBondContact CA-OD1 3.48Å; A319-N375 WeakPolarHBondContact CB-OD1 3.12Å; H320-N375 PolarHBondContact N-OD1 3.23Å; T323-N375 WeakPolarHBondContact CG2-ND2 3.38Å; A366-N375 WeakPolarHBondContact O-CB 3.38Å; A366-N375 PolarHBondContact O-ND2 3.41Å; A369-N375 HydrophobicContact CB-CB 4.1Å; S373-N375 VanDerWaalsContact C-N 3.25Å; S373-N375 PolarHBondContact O-N 3.49Å; N375-G378 PolarHBondContact O-N 3.37Å; N375-E379 WeakPolarHBondContact O-CB 3.18Å; N375-E379 WeakPolarHBondContact O-CG 3.39Å; N375-E379 PolarHBondContact O-N 2.91Å
376L95.3Very high95.1Very high49 Ų4932.6 Ų32.626%0.25718%0.18SC..Hα-helixtrans-64.5-45.5173.7-174.572.3000112.2A369 P371 S373 I374 G378 E379 L380A369-L376 HydrophobicContact CB-CB 4.06Å; A369-L376 HydrophobicContact CB-CD1 4.23Å; A369-L376 WeakPolarHBondContact O-CB 3.12Å; A369-L376 VanDerWaalsContact O-CD1 3.29Å; A369-L376 WeakPolarHBondContact O-CD1 3.31Å; P371-L376 VanDerWaalsContact CA-CD2 3.49Å; P371-L376 HydrophobicContact CB-CD2 3.48Å; P371-L376 VanDerWaalsContact CB-CD2 3.48Å; P371-L376 HydrophobicContact CG-CD2 4.19Å; S373-L376 WeakPolarHBondContact O-CB 3.28Å; S373-L376 PolarHBondContact O-N 2.88Å; S373-L376 VanDerWaalsContact O-N 3.14Å; I374-L376 PolarHBondContact O-N 3.24Å; L376-G378 VanDerWaalsContact C-N 3.27Å; L376-G378 PolarHBondContact O-N 3.48Å; L376-E379 PolarHBondContact O-N 3.3Å; L376-L380 WeakPolarHBondContact O-CB 3.3Å; L376-L380 PolarHBondContact O-N 3.42Å
377M94.3Very high95.2Very high53 Ų5336.5 Ų36.526%0.26120%0.197SC..Hα-helixtrans-57.3-44.7179.3-65.4-177.7178.900111.3M315 S373 I374 F381 P452M315-M377 HydrophobicContact SD-CB 3.82Å; S373-M377 PolarHBondContact O-N 2.94Å; S373-M377 VanDerWaalsContact O-N 3.16Å; I374-M377 PolarHBondContact O-N 2.74Å; I374-M377 VanDerWaalsContact O-N 3.14Å; M377-F381 WeakPolarHBondContact O-CD2 3.33Å; M377-F381 WeakPolarHBondContact O-CG 3.4Å; M377-F381 PolarHBondContact O-N 3.38Å; M377-P452 HydrophobicContact CE-CG 4.38Å; M377-P452 HydrophobicContact SD-CB 3.72Å; M377-P452 HydrophobicContact SD-CG 3.94Å
378G95.1Very high95.2Very high0 Ų040.5 Ų40.50%023%0.225CC..Hα-helixtrans-62.9-52175.600000112.6I374 N375 L376 L380 F381 I382I374-G378 PolarHBondContact O-N 3.3Å; N375-G378 PolarHBondContact O-N 3.37Å; L376-G378 VanDerWaalsContact C-N 3.27Å; L376-G378 PolarHBondContact O-N 3.48Å; G378-L380 VanDerWaalsContact C-N 3.31Å; G378-L380 PolarHBondContact O-N 2.71Å; G378-F381 PolarHBondContact O-N 3.37Å; G378-I382 VanDerWaalsContact O-CG1 3.25Å; G378-I382 WeakPolarHBondContact O-CG1 3.23Å; G378-I382 PolarHBondContact O-N 2.98Å
379E96.1Very high95.3Very high10 Ų1043 Ų435%0.04723%0.232CC..Hα-helixtrans-60.3-40.3178.1-75.8-179.8-158.300112.1H294 L297 L316 A369 N375 L376 I382 T383H294-E379 IonicContact CE1-OE1 3.17Å; H294-E379 PolarHBondContact CE1-OE1 2.81Å; H294-E379 IonicContact ND1-OE1 3.48Å; H294-E379 PolarHBondContact ND1-OE1 2.97Å; L297-E379 HydrophobicContact CD1-CG 4.32Å; L316-E379 HydrophobicContact CD1-CG 3.92Å; L316-E379 HydrophobicContact CD2-CG 4.32Å; A369-E379 VanDerWaalsContact CB-OE2 3.31Å; A369-E379 WeakPolarHBondContact CB-OE2 3.44Å; N375-E379 WeakPolarHBondContact O-CB 3.18Å; N375-E379 WeakPolarHBondContact O-CG 3.39Å; N375-E379 PolarHBondContact O-N 2.91Å; L376-E379 PolarHBondContact O-N 3.3Å; E379-I382 PolarHBondContact O-N 3.37Å; E379-T383 VanDerWaalsContact O-CG2 3.29Å; E379-T383 WeakPolarHBondContact O-CG2 3.49Å; E379-T383 PolarHBondContact O-N 2.83Å; E379-T383 PolarHBondContact O-OG1 3.27Å
380L95.9Very high95.3Very high81 Ų8144.6 Ų44.642%0.42424%0.243SC..Hα-helixtrans-68.5-41.8-179.7-169.4149.9000111.8L376 G378 I382 T383 M384L376-L380 WeakPolarHBondContact O-CB 3.3Å; L376-L380 PolarHBondContact O-N 3.42Å; G378-L380 VanDerWaalsContact C-N 3.31Å; G378-L380 PolarHBondContact O-N 2.71Å; L380-I382 VanDerWaalsContact C-N 3.28Å; L380-I382 PolarHBondContact O-N 3.32Å; L380-T383 WeakPolarHBondContact CA-OG1 3.16Å; L380-T383 PolarHBondContact O-N 3.36Å; L380-T383 PolarHBondContact O-OG1 3.12Å; L380-M384 HydrophobicContact CD2-CG 3.98Å; L380-M384 WeakPolarHBondContact O-CB 3.32Å; L380-M384 VanDerWaalsContact O-CG 3.23Å; L380-M384 WeakPolarHBondContact O-CG 3.12Å; L380-M384 PolarHBondContact O-N 3.34Å
381F96Very high95.4Very high49 Ų4946.3 Ų46.322%0.21525%0.252CS..Hα-helixtrans-64.4-37173.4-69.3-37.1000112.1W308 M315 M377 G378 M384 S385W308-F381 AromaticContact CE3-CD1 3.59Å; W308-F381 HydrophobicContact CE3-CD1 3.59Å; W308-F381 AromaticContact CE3-CE1 3.79Å; W308-F381 HydrophobicContact CE3-CE1 3.79Å; W308-F381 HydrophobicContact CE3-CG 4.4Å; W308-F381 AromaticContact CZ3-CD1 3.84Å; W308-F381 HydrophobicContact CZ3-CD1 3.84Å; W308-F381 AromaticContact CZ3-CE1 3.53Å; W308-F381 HydrophobicContact CZ3-CE1 3.53Å; W308-F381 HydrophobicContact CZ3-CZ 4.37Å; M315-F381 HydrophobicContact CE-CD2 4.28Å; M315-F381 HydrophobicContact CE-CE2 3.74Å; M315-F381 HydrophobicContact SD-CD2 3.85Å; M315-F381 HydrophobicContact SD-CE2 3.72Å; M377-F381 WeakPolarHBondContact O-CD2 3.33Å; M377-F381 WeakPolarHBondContact O-CG 3.4Å; M377-F381 PolarHBondContact O-N 3.38Å; G378-F381 PolarHBondContact O-N 3.37Å; F381-M384 PolarHBondContact O-N 3.01Å; F381-S385 WeakPolarHBondContact O-CB 3.37Å; F381-S385 PolarHBondContact O-N 3.3Å; F381-S385 PolarHBondContact O-OG 3.37Å
382I97.1Very high95.7Very high0 Ų048.7 Ų48.70%026%0.26CS..Hα-helixtrans-64.7-45174.2-65.4168.6000110.6L297 L316 G378 E379 L380 M384 S385 L386 M397L297-I382 HydrophobicContact CB-CD1 4.35Å; L297-I382 HydrophobicContact CB-CG2 4.45Å; L316-I382 HydrophobicContact CB-CD1 4.09Å; L316-I382 HydrophobicContact CD2-CD1 3.55Å; L316-I382 HydrophobicContact CG-CD1 4.46Å; G378-I382 VanDerWaalsContact O-CG1 3.25Å; G378-I382 WeakPolarHBondContact O-CG1 3.23Å; G378-I382 PolarHBondContact O-N 2.98Å; E379-I382 PolarHBondContact O-N 3.37Å; L380-I382 VanDerWaalsContact C-N 3.28Å; L380-I382 PolarHBondContact O-N 3.32Å; I382-M384 PolarHBondContact O-N 3.5Å; I382-S385 PolarHBondContact O-N 2.94Å; I382-S385 PolarHBondContact O-OG 2.74Å; I382-L386 HydrophobicContact CG2-CD1 3.68Å; I382-L386 HydrophobicContact CG2-CG 4.49Å; I382-L386 WeakPolarHBondContact O-CB 3.26Å; I382-L386 PolarHBondContact O-N 2.96Å; I382-M397 HydrophobicContact CG2-CE 3.87Å
383T96.9Very high96.1Very high17 Ų1744.4 Ų44.410%0.10423%0.232CC..Hα-helixtrans-63-41.9177.858.40000112.2E379 L380 L386 F387 M397 I401E379-T383 VanDerWaalsContact O-CG2 3.29Å; E379-T383 WeakPolarHBondContact O-CG2 3.49Å; E379-T383 PolarHBondContact O-N 2.83Å; E379-T383 PolarHBondContact O-OG1 3.27Å; L380-T383 WeakPolarHBondContact CA-OG1 3.16Å; L380-T383 PolarHBondContact O-N 3.36Å; L380-T383 PolarHBondContact O-OG1 3.12Å; T383-L386 PolarHBondContact O-N 3.04Å; T383-F387 VanDerWaalsContact O-CB 3.29Å; T383-F387 WeakPolarHBondContact O-CB 3.48Å; T383-F387 PolarHBondContact O-N 2.9Å; T383-M397 HydrophobicContact CG2-CB 4Å; T383-M397 HydrophobicContact CG2-CE 3.4Å; T383-M397 VanDerWaalsContact CG2-CE 3.4Å; T383-M397 HydrophobicContact CG2-CG 4.19Å; T383-I401 HydrophobicContact CG2-CD1 4.35Å
384M96.7Very high96.2Very high111 Ų11147.6 Ų47.655%0.54725%0.247SC..Hα-helixtrans-63.7-43.4177.3-67.7-59.3-7100111.6L380 F381 I382 F387 S388L380-M384 HydrophobicContact CD2-CG 3.98Å; L380-M384 WeakPolarHBondContact O-CB 3.32Å; L380-M384 VanDerWaalsContact O-CG 3.23Å; L380-M384 WeakPolarHBondContact O-CG 3.12Å; L380-M384 PolarHBondContact O-N 3.34Å; F381-M384 PolarHBondContact O-N 3.01Å; I382-M384 PolarHBondContact O-N 3.5Å; M384-F387 PolarHBondContact O-N 3.31Å; M384-S388 PolarHBondContact O-N 3.49Å
385S96.8Very high96.3Very high2 Ų252.3 Ų52.31%0.01427%0.271CS..Hα-helixtrans-66.4-41.6177.366.90000112.8S309 F381 I382 S388 W389S309-S385 VanDerWaalsContact CB-OG 3.3Å; S309-S385 WeakPolarHBondContact CB-OG 3.41Å; F381-S385 WeakPolarHBondContact O-CB 3.37Å; F381-S385 PolarHBondContact O-N 3.3Å; F381-S385 PolarHBondContact O-OG 3.37Å; I382-S385 PolarHBondContact O-N 2.94Å; I382-S385 PolarHBondContact O-OG 2.74Å; S385-S388 PolarHBondContact O-N 3.43Å; S385-S388 PolarHBondContact O-OG 3.46Å; S385-W389 PolarHBondContact O-N 3.14Å
386L96.8Very high96.4Very high0 Ų054.7 Ų54.70%028%0.283CS..Hα-helixtrans-64.9-40.7175.6-85.6163000112.2L267 A300 I304 I382 T383 S388 W389 S390 T393 M397L267-L386 HydrophobicContact CD2-CD1 4.14Å; L267-L386 HydrophobicContact CD2-CD2 4.19Å; A300-L386 HydrophobicContact CB-CD1 4.38Å; A300-L386 HydrophobicContact CB-CD2 4.34Å; I304-L386 HydrophobicContact CD1-CD2 3.19Å; I304-L386 HydrophobicContact CD1-CG 3.82Å; I382-L386 HydrophobicContact CG2-CD1 3.68Å; I382-L386 HydrophobicContact CG2-CG 4.49Å; I382-L386 WeakPolarHBondContact O-CB 3.26Å; I382-L386 PolarHBondContact O-N 2.96Å; T383-L386 PolarHBondContact O-N 3.04Å; L386-S388 VanDerWaalsContact C-N 3.3Å; L386-S388 PolarHBondContact O-N 3.22Å; L386-W389 WeakPolarHBondContact O-CB 3.41Å; L386-W389 PolarHBondContact O-N 3.46Å; L386-W389 VanDerWaalsContact O-N 3.12Å; L386-S390 PolarHBondContact O-N 2.9Å; L386-T393 HydrophobicContact CD2-CG2 4.27Å; L386-T393 PolarHBondContact O-OG1 3.3Å; L386-M397 HydrophobicContact CD1-CE 3.42Å; L386-M397 VanDerWaalsContact CD1-CE 3.42Å; L386-M397 HydrophobicContact CD1-CG 4.33Å; L386-M397 HydrophobicContact CD1-SD 3.67Å
387F97.4Very high96.5Very high85 Ų8552.5 Ų52.537%0.37327%0.272SS..Hα-helixtrans-60.7-42.6174.5-179.9-108.5000111.1T383 M384 W389 S390 N391 I394T383-F387 VanDerWaalsContact O-CB 3.29Å; T383-F387 WeakPolarHBondContact O-CB 3.48Å; T383-F387 PolarHBondContact O-N 2.9Å; M384-F387 PolarHBondContact O-N 3.31Å; F387-W389 VanDerWaalsContact C-N 3.27Å; F387-W389 PolarHBondContact O-N 3.18Å; F387-S390 CarbonylContact O-C 3.25Å; F387-S390 VanDerWaalsContact O-C 3.25Å; F387-S390 PolarHBondContact O-N 3.07Å; F387-N391 HydrophobicContact CD2-CB 4.35Å; F387-N391 HydrophobicContact CE2-CB 3.87Å; F387-N391 PolarHBondContact O-N 3Å; F387-N391 PolarHBondContact O-OD1 3.13Å; F387-I394 HydrophobicContact CD2-CB 3.97Å; F387-I394 HydrophobicContact CD2-CG1 4.48Å; F387-I394 HydrophobicContact CD2-CG2 4.4Å
388S97.1Very high96.5Very high85 Ų8551.4 Ų51.459%0.59427%0.274SS*.Hα-helixtrans-64.6-30.617578.70000113.2M384 S385 L386M384-S388 PolarHBondContact O-N 3.49Å; S385-S388 PolarHBondContact O-N 3.43Å; S385-S388 PolarHBondContact O-OG 3.46Å; L386-S388 VanDerWaalsContact C-N 3.3Å; L386-S388 PolarHBondContact O-N 3.22Å
389W96.1Very high96.6Very high84 Ų8454.8 Ų54.832%0.31829%0.292SS..Hα-helixtrans-73.9-47.5176.217780.4000112.2Y260 I263 I304 S385 L386 F387 T393Y260-W389 HydrophobicContact CD1-CH2 4.19Å; Y260-W389 AromaticContact CD1-CZ2 3.76Å; Y260-W389 HydrophobicContact CD1-CZ2 3.76Å; Y260-W389 HydrophobicContact CE1-CH2 4.18Å; Y260-W389 AromaticContact CE1-CZ2 3.5Å; Y260-W389 HydrophobicContact CE1-CZ2 3.5Å; I263-W389 HydrophobicContact CD1-CZ2 4Å; I263-W389 HydrophobicContact CG2-CH2 3.97Å; I263-W389 HydrophobicContact CG2-CZ2 4.5Å; I263-W389 HydrophobicContact CG2-CZ3 4.1Å; I304-W389 HydrophobicContact CD1-CB 3.86Å; I304-W389 HydrophobicContact CD1-CD2 4.11Å; I304-W389 HydrophobicContact CD1-CE3 4.45Å; I304-W389 HydrophobicContact CD1-CG 3.83Å; I304-W389 HydrophobicContact CG1-CB 4.28Å; I304-W389 HydrophobicContact CG1-CD2 4.3Å; I304-W389 HydrophobicContact CG1-CG 3.91Å; I304-W389 HydrophobicContact CG2-CB 4Å; I304-W389 HydrophobicContact CG2-CG 4.2Å; S385-W389 PolarHBondContact O-N 3.14Å; L386-W389 WeakPolarHBondContact O-CB 3.41Å; L386-W389 PolarHBondContact O-N 3.46Å; L386-W389 VanDerWaalsContact O-N 3.12Å; F387-W389 VanDerWaalsContact C-N 3.27Å; F387-W389 PolarHBondContact O-N 3.18Å; W389-T393 HydrophobicContact CE3-CG2 3.88Å; W389-T393 HydrophobicContact CZ3-CG2 3.9Å
390S96.4Very high96.7Very high39 Ų3954.5 Ų54.527%0.27329%0.29SS..  trans-155.2130.6164.962.20000112.1L386 F387 L392 T393L386-S390 PolarHBondContact O-N 2.9Å; F387-S390 CarbonylContact O-C 3.25Å; F387-S390 VanDerWaalsContact O-C 3.25Å; F387-S390 PolarHBondContact O-N 3.07Å; S390-L392 PolarHBondContact O-N 3.4Å; S390-L392 VanDerWaalsContact O-N 3.07Å; S390-T393 WeakPolarHBondContact O-CB 3.49Å; S390-T393 PolarHBondContact O-N 3.26Å; S390-T393 PolarHBondContact O-OG1 3Å; S390-T393 VanDerWaalsContact OG-CG2 3.28Å; S390-T393 WeakPolarHBondContact OG-CG2 3.45Å
391N96.8Very high96.7Very high109 Ų10954.5 Ų54.558%0.58329%0.29SS*.THydrogen-bonded Turntrans-57.2-30.9-174.1-65.7-2.2000113.5F387 T393 I394F387-N391 HydrophobicContact CD2-CB 4.35Å; F387-N391 HydrophobicContact CE2-CB 3.87Å; F387-N391 PolarHBondContact O-N 3Å; F387-N391 PolarHBondContact O-OD1 3.13Å; N391-T393 PolarHBondContact O-N 2.69Å; N391-I394 WeakPolarHBondContact O-CG2 3.18Å; N391-I394 PolarHBondContact O-N 2.93Å
392L96.6Very high96.7Very high136 Ų13657.4 Ų57.471%0.71231%0.307SS*.THydrogen-bonded Turntrans-65.9-24.2-179.3-73.7169.7000113.4S390 I394 I395S390-L392 PolarHBondContact O-N 3.4Å; S390-L392 VanDerWaalsContact O-N 3.07Å; L392-I394 PolarHBondContact O-N 2.96Å; L392-I394 VanDerWaalsContact O-N 3.16Å; L392-I395 HydrophobicContact CD2-CD1 4.28Å; L392-I395 PolarHBondContact O-N 3.42Å
393T96.5Very high96.8Very high5 Ų558.4 Ų58.43%0.03131%0.312CS..Hα-helixtrans-61.8-24.3-179.857.70000112.8L267 L386 W389 S390 N391 I395 L396 M397L267-T393 HydrophobicContact CD1-CG2 3.92Å; L386-T393 HydrophobicContact CD2-CG2 4.27Å; L386-T393 PolarHBondContact O-OG1 3.3Å; W389-T393 HydrophobicContact CE3-CG2 3.88Å; W389-T393 HydrophobicContact CZ3-CG2 3.9Å; S390-T393 WeakPolarHBondContact O-CB 3.49Å; S390-T393 PolarHBondContact O-N 3.26Å; S390-T393 PolarHBondContact O-OG1 3Å; S390-T393 VanDerWaalsContact OG-CG2 3.28Å; S390-T393 WeakPolarHBondContact OG-CG2 3.45Å; N391-T393 PolarHBondContact O-N 2.69Å; T393-I395 PolarHBondContact O-N 2.86Å; T393-L396 PolarHBondContact O-N 3.11Å; T393-L396 VanDerWaalsContact O-N 3.08Å; T393-M397 WeakPolarHBondContact O-CG 3.43Å; T393-M397 PolarHBondContact O-N 3.3Å
394I96.5Very high96.8Very high80 Ų8057.7 Ų57.741%0.4131%0.308SS..Hα-helixtrans-59.4-31.5178.7-161.461.2000112.5F387 N391 L392 M397 G398F387-I394 HydrophobicContact CD2-CB 3.97Å; F387-I394 HydrophobicContact CD2-CG1 4.48Å; F387-I394 HydrophobicContact CD2-CG2 4.4Å; N391-I394 WeakPolarHBondContact O-CG2 3.18Å; N391-I394 PolarHBondContact O-N 2.93Å; L392-I394 PolarHBondContact O-N 2.96Å; L392-I394 VanDerWaalsContact O-N 3.16Å; I394-M397 PolarHBondContact O-N 3.32Å; I394-G398 PolarHBondContact O-N 3.04Å
395I97.3Very high96.8Very high101 Ų10153.5 Ų53.552%0.51829%0.293SS..Hα-helixtrans-65.5-48177.5-60.7171.7000109.4L392 T393 M397 G398 I399L392-I395 HydrophobicContact CD2-CD1 4.28Å; L392-I395 PolarHBondContact O-N 3.42Å; T393-I395 PolarHBondContact O-N 2.86Å; I395-M397 VanDerWaalsContact C-N 3.35Å; I395-M397 PolarHBondContact O-N 3.38Å; I395-G398 PolarHBondContact O-N 3.18Å; I395-I399 HydrophobicContact CG2-CD1 3.97Å; I395-I399 VanDerWaalsContact O-CG1 3.27Å; I395-I399 WeakPolarHBondContact O-CG1 3.16Å; I395-I399 PolarHBondContact O-N 2.93Å
396L96.7Very high96.8Very high52 Ų5258.5 Ų58.527%0.27232%0.317SS..Hα-helixtrans-64.7-40.7179.2-61.3174.9000111.3L267 M270 I271 T393 N400L267-L396 HydrophobicContact CB-CD1 4.03Å; L267-L396 HydrophobicContact CD1-CD1 4.28Å; M270-L396 HydrophobicContact CE-CB 3.84Å; I271-L396 HydrophobicContact CD1-CB 4.1Å; I271-L396 HydrophobicContact CD1-CD2 3.53Å; I271-L396 HydrophobicContact CD1-CG 4.41Å; T393-L396 PolarHBondContact O-N 3.11Å; T393-L396 VanDerWaalsContact O-N 3.08Å; L396-N400 WeakPolarHBondContact O-CB 3.26Å; L396-N400 PolarHBondContact O-N 3.34Å
397M96.4Very high96.9Very high4 Ų458.5 Ų58.52%0.0232%0.317CS..Hα-helixtrans-66.1-44.6176.6-63.6-59.9-9100112L267 M270 L297 I382 T383 L386 T393 I394 I395 I399 N400 I401L267-M397 HydrophobicContact CD2-SD 4.29Å; M270-M397 HydrophobicContact CE-SD 3.64Å; M270-M397 HydrophobicContact SD-SD 3.9Å; L297-M397 HydrophobicContact CD2-CE 3.27Å; L297-M397 HydrophobicContact CD2-SD 3.57Å; L297-M397 VanDerWaalsContact CD2-SD 3.57Å; I382-M397 HydrophobicContact CG2-CE 3.87Å; T383-M397 HydrophobicContact CG2-CB 4Å; T383-M397 HydrophobicContact CG2-CE 3.4Å; T383-M397 VanDerWaalsContact CG2-CE 3.4Å; T383-M397 HydrophobicContact CG2-CG 4.19Å; L386-M397 HydrophobicContact CD1-CE 3.42Å; L386-M397 VanDerWaalsContact CD1-CE 3.42Å; L386-M397 HydrophobicContact CD1-CG 4.33Å; L386-M397 HydrophobicContact CD1-SD 3.67Å; T393-M397 WeakPolarHBondContact O-CG 3.43Å; T393-M397 PolarHBondContact O-N 3.3Å; I394-M397 PolarHBondContact O-N 3.32Å; I395-M397 VanDerWaalsContact C-N 3.35Å; I395-M397 PolarHBondContact O-N 3.38Å; M397-I399 VanDerWaalsContact C-N 3.35Å; M397-I399 PolarHBondContact O-N 2.98Å; M397-N400 PolarHBondContact O-N 2.94Å; M397-N400 VanDerWaalsContact O-N 3.16Å; M397-I401 WeakPolarHBondContact O-CG1 3.35Å; M397-I401 PolarHBondContact O-N 3.49Å
398G96.2Very high96.8Very high30 Ų3054.4 Ų54.431%0.30930%0.299SS..Hα-helixtrans-60.5-43.3176.900000112.2I394 I395 N400 I401 I402I394-G398 PolarHBondContact O-N 3.04Å; I395-G398 PolarHBondContact O-N 3.18Å; G398-N400 VanDerWaalsContact C-N 3.35Å; G398-N400 PolarHBondContact O-N 2.89Å; G398-I401 PolarHBondContact O-N 3.38Å; G398-I402 VanDerWaalsContact O-CG1 3.3Å; G398-I402 WeakPolarHBondContact O-CG1 3.21Å; G398-I402 PolarHBondContact O-N 3.1Å
399I97Very high96.8Very high70 Ų7054.4 Ų54.436%0.35929%0.291SS..Hα-helixtrans-60.7-44.8173.6-68.3165.4000110.7I271 I395 M397 I401 I402 I403I271-I399 HydrophobicContact CD1-CG2 4.29Å; I271-I399 HydrophobicContact CG1-CG2 4.43Å; I271-I399 HydrophobicContact CG2-CG2 4.25Å; I395-I399 HydrophobicContact CG2-CD1 3.97Å; I395-I399 VanDerWaalsContact O-CG1 3.27Å; I395-I399 WeakPolarHBondContact O-CG1 3.16Å; I395-I399 PolarHBondContact O-N 2.93Å; M397-I399 VanDerWaalsContact C-N 3.35Å; M397-I399 PolarHBondContact O-N 2.98Å; I399-I401 PolarHBondContact O-N 3.47Å; I399-I402 PolarHBondContact O-N 3.01Å; I399-I403 HydrophobicContact CG2-CD1 3.62Å; I399-I403 HydrophobicContact CG2-CG1 4.32Å; I399-I403 VanDerWaalsContact O-CG1 3.31Å; I399-I403 WeakPolarHBondContact O-CG1 3.01Å; I399-I403 PolarHBondContact O-N 3.35Å
400N96.9Very high96.8Very high4 Ų454.1 Ų54.12%0.02129%0.29CS..Hα-helixtrans-62.7-43178.4-172.139.9000112.1M270 L396 M397 G398 I402 I403 T404M270-N400 HydrophobicContact CE-CB 4.24Å; M270-N400 HydrophobicContact CG-CB 4.36Å; M270-N400 HydrophobicContact SD-CB 4.05Å; L396-N400 WeakPolarHBondContact O-CB 3.26Å; L396-N400 PolarHBondContact O-N 3.34Å; M397-N400 PolarHBondContact O-N 2.94Å; M397-N400 VanDerWaalsContact O-N 3.16Å; G398-N400 VanDerWaalsContact C-N 3.35Å; G398-N400 PolarHBondContact O-N 2.89Å; N400-I402 VanDerWaalsContact C-N 3.29Å; N400-I402 PolarHBondContact O-N 3.01Å; N400-I403 PolarHBondContact O-N 2.9Å; N400-T404 WeakPolarHBondContact O-CB 3.32Å; N400-T404 WeakPolarHBondContact O-CG2 3.36Å; N400-T404 PolarHBondContact O-N 3.45Å; N400-T404 PolarHBondContact O-OG1 2.98Å
401I95.9Very high96.8Very high81 Ų8152.3 Ų52.342%0.41528%0.277SS..Hα-helixtrans-60.9-39.2176.3-66.2163.9000110.9T383 M397 G398 I399 T404 G405T383-I401 HydrophobicContact CG2-CD1 4.35Å; M397-I401 WeakPolarHBondContact O-CG1 3.35Å; M397-I401 PolarHBondContact O-N 3.49Å; G398-I401 PolarHBondContact O-N 3.38Å; I399-I401 PolarHBondContact O-N 3.47Å; I401-T404 VanDerWaalsContact C-OG1 3.31Å; I401-T404 VanDerWaalsContact CA-OG1 3.26Å; I401-T404 WeakPolarHBondContact CA-OG1 3.36Å; I401-T404 PolarHBondContact O-OG1 3.41Å; I401-G405 PolarHBondContact O-N 2.92Å
402I97.4Very high96.8Very high110 Ų11047.7 Ų47.756%0.56425%0.253SS*.Hα-helixtrans-64.7-50.3175.8-66.5163.3000110.6G398 I399 N400 T404 G405 M406G398-I402 VanDerWaalsContact O-CG1 3.3Å; G398-I402 WeakPolarHBondContact O-CG1 3.21Å; G398-I402 PolarHBondContact O-N 3.1Å; I399-I402 PolarHBondContact O-N 3.01Å; N400-I402 VanDerWaalsContact C-N 3.29Å; N400-I402 PolarHBondContact O-N 3.01Å; I402-T404 VanDerWaalsContact C-N 3.32Å; I402-T404 PolarHBondContact O-N 2.95Å; I402-G405 PolarHBondContact O-N 2.85Å; I402-M406 HydrophobicContact CG2-CG 4.45Å; I402-M406 HydrophobicContact CG2-SD 4.13Å; I402-M406 WeakPolarHBondContact O-CG 3.42Å; I402-M406 PolarHBondContact O-N 3.5Å
403I97.9Very high96.8Very high22 Ų2245.5 Ų45.511%0.11324%0.241CC..Hα-helixtrans-65.9-36.8-177.4-59.7166.7000110.9I271 S274 L278 I399 N400 M406 Y407I271-I403 HydrophobicContact CG2-CD1 3.98Å; S274-I403 WeakPolarHBondContact OG-CG2 3.25Å; L278-I403 HydrophobicContact CD1-CG2 4Å; L278-I403 HydrophobicContact CG-CG2 4.33Å; I399-I403 HydrophobicContact CG2-CD1 3.62Å; I399-I403 HydrophobicContact CG2-CG1 4.32Å; I399-I403 VanDerWaalsContact O-CG1 3.31Å; I399-I403 WeakPolarHBondContact O-CG1 3.01Å; I399-I403 PolarHBondContact O-N 3.35Å; N400-I403 PolarHBondContact O-N 2.9Å; I403-M406 WeakPolarHBondContact O-CB 3.29Å; I403-M406 PolarHBondContact O-N 3.12Å; I403-M406 VanDerWaalsContact O-N 3.15Å; I403-Y407 HydrophobicContact CG2-CD1 4.37Å; I403-Y407 WeakPolarHBondContact O-CD1 3.41Å; I403-Y407 PolarHBondContact O-N 3.26Å
404T97.4Very high96.8Very high2 Ų246.2 Ų46.21%0.01225%0.245CC..Hα-helixtrans-63.2-42.1174.355.30000112.4N400 I401 I402 M406 Y407 S408N400-T404 WeakPolarHBondContact O-CB 3.32Å; N400-T404 WeakPolarHBondContact O-CG2 3.36Å; N400-T404 PolarHBondContact O-N 3.45Å; N400-T404 PolarHBondContact O-OG1 2.98Å; I401-T404 VanDerWaalsContact C-OG1 3.31Å; I401-T404 VanDerWaalsContact CA-OG1 3.26Å; I401-T404 WeakPolarHBondContact CA-OG1 3.36Å; I401-T404 PolarHBondContact O-OG1 3.41Å; I402-T404 VanDerWaalsContact C-N 3.32Å; I402-T404 PolarHBondContact O-N 2.95Å; T404-M406 VanDerWaalsContact C-N 3.34Å; T404-M406 PolarHBondContact O-N 3.41Å; T404-Y407 HydrophobicContact CG2-CE1 3.64Å; T404-S408 VanDerWaalsContact O-CB 3.25Å; T404-S408 WeakPolarHBondContact O-CB 3.36Å; T404-S408 PolarHBondContact O-N 3.17Å; T404-S408 VanDerWaalsContact O-N 3.11Å; T404-S408 PolarHBondContact O-OG 2.98Å
405G96.9Very high96.7Very high23 Ų2342.4 Ų42.424%0.23723%0.225CC..Hα-helixtrans-59.3-42.3168.500000112.8I401 I402 S408 M409I401-G405 PolarHBondContact O-N 2.92Å; I402-G405 PolarHBondContact O-N 2.85Å; G405-S408 PolarHBondContact O-OG 3Å; G405-M409 WeakPolarHBondContact O-CB 3.42Å; G405-M409 VanDerWaalsContact O-CG 3.31Å; G405-M409 WeakPolarHBondContact O-CG 3.21Å; G405-M409 PolarHBondContact O-N 3.39Å; G405-M409 VanDerWaalsContact O-N 3.15Å
406M97.4Very high96.7Very high106 Ų10637.8 Ų37.852%0.52220%0.202SC..Hα-helixtrans-65.7-50.7179.9-68.9177.978.300112.8L278 I402 I403 T404 Y410L278-M406 HydrophobicContact CD2-CB 3.79Å; I402-M406 HydrophobicContact CG2-CG 4.45Å; I402-M406 HydrophobicContact CG2-SD 4.13Å; I402-M406 WeakPolarHBondContact O-CG 3.42Å; I402-M406 PolarHBondContact O-N 3.5Å; I403-M406 WeakPolarHBondContact O-CB 3.29Å; I403-M406 PolarHBondContact O-N 3.12Å; I403-M406 VanDerWaalsContact O-N 3.15Å; T404-M406 VanDerWaalsContact C-N 3.34Å; T404-M406 PolarHBondContact O-N 3.41Å; M406-Y410 VanDerWaalsContact O-CB 3.24Å; M406-Y410 WeakPolarHBondContact O-CB 3.47Å; M406-Y410 PolarHBondContact O-N 2.66Å
407Y97.3Very high96.6Very high0 Ų041.9 Ų41.90%021%0.213CC..Hα-helixtrans-72.6-31.9-176.375.8-116000112.5C277 L286 I403 T404 Y410 M411C277-Y407 HydrophobicContact CB-CD1 3.78Å; C277-Y407 HydrophobicContact CB-CD2 4.13Å; C277-Y407 HydrophobicContact CB-CE1 4.39Å; C277-Y407 HydrophobicContact CB-CG 3.67Å; L286-Y407 HydrophobicContact CD2-CD2 4.18Å; I403-Y407 HydrophobicContact CG2-CD1 4.37Å; I403-Y407 WeakPolarHBondContact O-CD1 3.41Å; I403-Y407 PolarHBondContact O-N 3.26Å; T404-Y407 HydrophobicContact CG2-CE1 3.64Å; Y407-Y410 PolarHBondContact O-N 3.46Å; Y407-M411 WeakPolarHBondContact O-CB 3.41Å; Y407-M411 PolarHBondContact O-N 2.94Å
408S97.1Very high96.4Very high0 Ų044.6 Ų44.60%024%0.243CC..Hα-helixtrans-67.6-44.6177.156.90000110.9L368 T404 G405 M411 I412L368-S408 WeakPolarHBondContact CB-OG 3.44Å; T404-S408 VanDerWaalsContact O-CB 3.25Å; T404-S408 WeakPolarHBondContact O-CB 3.36Å; T404-S408 PolarHBondContact O-N 3.17Å; T404-S408 VanDerWaalsContact O-N 3.11Å; T404-S408 PolarHBondContact O-OG 2.98Å; G405-S408 PolarHBondContact O-OG 3Å; S408-M411 WeakPolarHBondContact O-CB 3.43Å; S408-M411 PolarHBondContact O-N 3.01Å; S408-I412 WeakPolarHBondContact O-CG1 3.48Å; S408-I412 PolarHBondContact O-N 3.45Å
409M95.8Very high96.1Very high84 Ų8452.3 Ų52.341%0.41427%0.268SS..Hα-helixtrans-65.3-40.3172.9-72.4-64.5-172.100111.7L368 G405 M411 I412 I413L368-M409 HydrophobicContact CD2-CE 3.9Å; G405-M409 WeakPolarHBondContact O-CB 3.42Å; G405-M409 VanDerWaalsContact O-CG 3.31Å; G405-M409 WeakPolarHBondContact O-CG 3.21Å; G405-M409 PolarHBondContact O-N 3.39Å; G405-M409 VanDerWaalsContact O-N 3.15Å; M409-M411 VanDerWaalsContact C-N 3.31Å; M409-M411 PolarHBondContact O-N 3.43Å; M409-I412 PolarHBondContact O-N 2.71Å; M409-I412 HydrophobicContact SD-CD1 3.84Å; M409-I413 HydrophobicContact CB-CD1 4.47Å; M409-I413 WeakPolarHBondContact O-CB 3.47Å; M409-I413 VanDerWaalsContact O-CG1 3.23Å; M409-I413 WeakPolarHBondContact O-CG1 3.29Å; M409-I413 PolarHBondContact O-N 2.83Å
410Y96.7Very high95.7Very high78 Ų7851.5 Ų51.531%0.30626%0.264SS..Hα-helixtrans-56.7-44.8173.9175-108.4000111.8L286 M343 M406 Y407 I412 I413 T414L286-Y410 HydrophobicContact CD1-CD1 4.39Å; M343-Y410 HydrophobicContact CE-CD1 4.28Å; M343-Y410 HydrophobicContact CE-CE1 3.49Å; M343-Y410 VanDerWaalsContact CE-CE1 3.49Å; M343-Y410 HydrophobicContact SD-CE1 4.36Å; M406-Y410 VanDerWaalsContact O-CB 3.24Å; M406-Y410 WeakPolarHBondContact O-CB 3.47Å; M406-Y410 PolarHBondContact O-N 2.66Å; Y407-Y410 PolarHBondContact O-N 3.46Å; Y410-I412 PolarHBondContact O-N 3.19Å; Y410-I413 PolarHBondContact O-N 3.49Å; Y410-T414 HydrophobicContact CD2-CG2 3.76Å; Y410-T414 HydrophobicContact CE1-CG2 4.2Å; Y410-T414 HydrophobicContact CE2-CG2 3.37Å; Y410-T414 HydrophobicContact CG-CG2 4.31Å; Y410-T414 WeakPolarHBondContact O-CB 3.49Å; Y410-T414 VanDerWaalsContact O-CG2 3.32Å; Y410-T414 WeakPolarHBondContact O-CG2 3.37Å; Y410-T414 PolarHBondContact O-N 2.88Å; Y410-T414 PolarHBondContact O-OG1 2.91Å
411M96.7Very high95.2Very high1 Ų152.6 Ų52.61%0.00527%0.271CS..Hα-helixtrans-58.9-43.6176.2-173.4-157.9-67.500112.1L286 I287 L327 W360 Y407 S408 M409 T414 T415L286-M411 HydrophobicContact CD2-CE 3.27Å; I287-M411 HydrophobicContact CG1-CE 4.06Å; L327-M411 HydrophobicContact CD1-CE 4.47Å; L327-M411 HydrophobicContact CD2-SD 3.94Å; W360-M411 HydrophobicContact CE3-SD 4.43Å; W360-M411 HydrophobicContact CZ3-CG 4.02Å; W360-M411 HydrophobicContact CZ3-SD 3.7Å; Y407-M411 WeakPolarHBondContact O-CB 3.41Å; Y407-M411 PolarHBondContact O-N 2.94Å; S408-M411 WeakPolarHBondContact O-CB 3.43Å; S408-M411 PolarHBondContact O-N 3.01Å; M409-M411 VanDerWaalsContact C-N 3.31Å; M409-M411 PolarHBondContact O-N 3.43Å; M411-T414 PolarHBondContact O-OG1 3.48Å; M411-T415 WeakPolarHBondContact O-CB 3.39Å; M411-T415 VanDerWaalsContact O-CG2 3.28Å; M411-T415 WeakPolarHBondContact O-CG2 3.07Å; M411-T415 PolarHBondContact O-N 3.48Å; M411-T415 PolarHBondContact O-OG1 3Å
412I96.7Very high94.5Very high13 Ų1355.8 Ų55.87%0.06729%0.289CS..Hα-helixtrans-67.9-46.9176.5-54162.1000111.1S364 S408 M409 Y410 T414 T415 Q416S364-I412 WeakPolarHBondContact OG-CD1 3.37Å; S364-I412 WeakPolarHBondContact OG-CG1 3.35Å; S408-I412 WeakPolarHBondContact O-CG1 3.48Å; S408-I412 PolarHBondContact O-N 3.45Å; M409-I412 PolarHBondContact O-N 2.71Å; M409-I412 HydrophobicContact SD-CD1 3.84Å; Y410-I412 PolarHBondContact O-N 3.19Å; I412-T414 VanDerWaalsContact C-N 3.34Å; I412-T414 PolarHBondContact O-N 3.08Å; I412-T415 PolarHBondContact O-N 2.95Å; I412-Q416 HydrophobicContact CG2-CB 4.23Å; I412-Q416 HydrophobicContact CG2-CG 4.24Å; I412-Q416 WeakPolarHBondContact O-CA 3.19Å; I412-Q416 WeakPolarHBondContact O-CB 3.47Å; I412-Q416 PolarHBondContact O-N 3.39Å
413I96.7Very high93.7Very high89 Ų8959 Ų5946%0.45630%0.301SS..Hα-helixtrans-64.1-44.6-173.6-70165.3000109.9M409 Y410 R417M409-I413 HydrophobicContact CB-CD1 4.47Å; M409-I413 WeakPolarHBondContact O-CB 3.47Å; M409-I413 VanDerWaalsContact O-CG1 3.23Å; M409-I413 WeakPolarHBondContact O-CG1 3.29Å; M409-I413 PolarHBondContact O-N 2.83Å; Y410-I413 PolarHBondContact O-N 3.49Å; I413-R417 CarbonylContact O-C 3.21Å; I413-R417 WeakPolarHBondContact O-CB 3.46Å; I413-R417 PolarHBondContact O-N 2.63Å
414T95.9Very high92.8Very high20 Ų2059.3 Ų59.312%0.12330%0.303CS..Hα-helixtrans-68.6-35.3179.451.80000113M343 R347 Y410 M411 I412M343-T414 WeakPolarHBondContact CG-OG1 3.38Å; M343-T414 PolarHBondContact SD-OG1 3Å; R347-T414 WeakPolarHBondContact CG-O 3.44Å; Y410-T414 HydrophobicContact CD2-CG2 3.76Å; Y410-T414 HydrophobicContact CE1-CG2 4.2Å; Y410-T414 HydrophobicContact CE2-CG2 3.37Å; Y410-T414 HydrophobicContact CG-CG2 4.31Å; Y410-T414 WeakPolarHBondContact O-CB 3.49Å; Y410-T414 VanDerWaalsContact O-CG2 3.32Å; Y410-T414 WeakPolarHBondContact O-CG2 3.37Å; Y410-T414 PolarHBondContact O-N 2.88Å; Y410-T414 PolarHBondContact O-OG1 2.91Å; M411-T414 PolarHBondContact O-OG1 3.48Å; I412-T414 VanDerWaalsContact C-N 3.34Å; I412-T414 PolarHBondContact O-N 3.08Å
415T95.3Very high91.6Very high0 Ų065.6 Ų65.60%033%0.334CS..Hα-helixtrans-88.6-48.3-177.758.50000113L283 M343 A346 R347 G348 L349 M411 I412L283-T415 HydrophobicContact CD1-CG2 3.35Å; M343-T415 HydrophobicContact CG-CG2 3.9Å; A346-T415 CarbonylContact O-C 3.55Å; A346-T415 VanDerWaalsContact O-C 3.3Å; A346-T415 WeakPolarHBondContact O-CA 3.28Å; R347-T415 CarbonylContact C-O 3.57Å; G348-T415 PolarHBondContact N-O 3Å; L349-T415 PolarHBondContact N-O 3.49Å; M411-T415 WeakPolarHBondContact O-CB 3.39Å; M411-T415 VanDerWaalsContact O-CG2 3.28Å; M411-T415 WeakPolarHBondContact O-CG2 3.07Å; M411-T415 PolarHBondContact O-N 3.48Å; M411-T415 PolarHBondContact O-OG1 3Å; I412-T415 PolarHBondContact O-N 2.95Å
416Q96.1Very high90.5Very high4 Ų471.8 Ų71.82%0.01936%0.362CS..Hα-helixtrans-93.6-38.2-169.6-56.8-48.6-55.200112.7G348 L349 Q350 A357 W360 I412G348-Q416 CarbonylContact C-O 3.3Å; G348-Q416 VanDerWaalsContact C-O 3.25Å; G348-Q416 WeakPolarHBondContact CA-O 3.29Å; L349-Q416 PolarHBondContact N-O 3.47Å; Q350-Q416 HydrophobicContact CB-CB 4.29Å; Q350-Q416 WeakPolarHBondContact CB-O 3.4Å; Q350-Q416 PolarHBondContact N-O 3Å; A357-Q416 HydrophobicContact CB-CB 4.49Å; A357-Q416 HydrophobicContact CB-CG 4.39Å; W360-Q416 HydrophobicContact CB-CG 3.73Å; W360-Q416 VanDerWaalsContact CD1-CD 3.46Å; W360-Q416 HydrophobicContact CD2-CG 4.43Å; W360-Q416 HydrophobicContact CG-CG 3.86Å; I412-Q416 HydrophobicContact CG2-CB 4.23Å; I412-Q416 HydrophobicContact CG2-CG 4.24Å; I412-Q416 WeakPolarHBondContact O-CA 3.19Å; I412-Q416 WeakPolarHBondContact O-CB 3.47Å; I412-Q416 PolarHBondContact O-N 3.39Å
417R94.7Very high89.9Confident138 Ų13868.2 Ų68.252%0.52135%0.345SS..SBendtrans-95.8172.3-173.1-64.2-171.8172.6-175.60112.4G348 I413G348-R417 PolarHBondContact N-O 3.16Å; G348-R417 VanDerWaalsContact N-O 3.16Å; I413-R417 CarbonylContact O-C 3.21Å; I413-R417 WeakPolarHBondContact O-CB 3.46Å; I413-R417 PolarHBondContact O-N 2.63Å
418G92.4Very high89.4Confident62 Ų6273.8 Ų73.864%0.63937%0.371SS*.SBendtrans86.9-171.917900000113.4G348G348-G418 WeakPolarHBondContact CA-O 3.34Å
419K89.9Confident89.2Confident191 Ų19178.3 Ų78.383%0.8340%0.4SS*.PPolyproline II helixtrans-74.2139.2179.2-64.3-179.3-178.5179.50109.9
420L88.3Confident89.1Confident54 Ų5475.9 Ų75.928%0.28339%0.392SS..PPolyproline II helixtrans-60.7142171-161.491.1000109.9I352 N422I352-L420 HydrophobicContact CD1-CD1 3.27Å; I352-L420 HydrophobicContact CD1-CD2 3.97Å; I352-L420 HydrophobicContact CD1-CG 4.24Å; I352-L420 HydrophobicContact CG1-CD1 3.76Å; L420-N422 PolarHBondContact O-N 2.89Å; L420-N422 PolarHBondContact O-OD1 3.4Å
421T87.2Confident89Confident27 Ų2775.6 Ų75.617%0.16639%0.393CS..PPolyproline II helixtrans-67.4120.2169.144.20000110.8M345 R347 H423 M424M345-T421 PolarHBondContact O-OG1 2.83Å; R347-T421 HydrophobicContact CB-CG2 4.22Å; T421-H423 PolarHBondContact O-N 2.72Å; T421-H423 VanDerWaalsContact O-N 3.11Å; T421-M424 WeakPolarHBondContact O-CB 3.27Å; T421-M424 PolarHBondContact O-N 3.17Å; T421-M424 WeakPolarHBondContact OG1-CG 3.3Å
422N79.9Confident89Confident147 Ų14781.2 Ų81.279%0.78643%0.428SS*.THydrogen-bonded Turntrans-57.6-29.1-172.6-64.9-2.8000114.9L420 M424L420-N422 PolarHBondContact O-N 2.89Å; L420-N422 PolarHBondContact O-OD1 3.4Å; N422-M424 VanDerWaalsContact C-N 3.29Å; N422-M424 PolarHBondContact O-N 3.28Å
423H81.5Confident88.9Confident177 Ų17782.3 Ų82.382%0.81943%0.431SS*.THydrogen-bonded Turntrans-79-9.3-178.9-56.6-59.7000113.9T421 I425T421-H423 PolarHBondContact O-N 2.72Å; T421-H423 VanDerWaalsContact O-N 3.11Å; H423-I425 PolarHBondContact O-N 2.86Å; H423-I425 VanDerWaalsContact O-N 3.13Å
424M78.6Confident88.9Confident30 Ų3078.4 Ų78.415%0.14841%0.411CS..  trans-87.878.8-177.5-66-61.4-65.800110.8I338 M345 T421 N422 L427I338-M424 HydrophobicContact CB-CE 3.99Å; I338-M424 HydrophobicContact CD1-CE 3.91Å; I338-M424 HydrophobicContact CG1-CE 3.46Å; I338-M424 VanDerWaalsContact CG1-CE 3.46Å; I338-M424 HydrophobicContact CG2-CE 3.74Å; I338-M424 HydrophobicContact CG2-SD 4.15Å; M345-M424 HydrophobicContact CE-SD 4.07Å; T421-M424 WeakPolarHBondContact O-CB 3.27Å; T421-M424 PolarHBondContact O-N 3.17Å; T421-M424 WeakPolarHBondContact OG1-CG 3.3Å; N422-M424 VanDerWaalsContact C-N 3.29Å; N422-M424 PolarHBondContact O-N 3.28Å; M424-L427 HydrophobicContact CB-CD1 4.28Å; M424-L427 HydrophobicContact CE-CD1 4.21Å; M424-L427 HydrophobicContact CE-CD2 3.69Å; M424-L427 HydrophobicContact CE-CG 4.22Å
425I72.7Confident89Confident133 Ų13379.1 Ų79.168%0.68241%0.413SS*.  trans-97141-179.9-54.9169.5000108.8H423H423-I425 PolarHBondContact O-N 2.86Å; H423-I425 VanDerWaalsContact O-N 3.13Å
426N73Confident89Confident153 Ų15382.1 Ų82.182%0.81843%0.432SS*.  trans65.344.2174.4-61.6-13.8000116.6Q428N426-Q428 PolarHBondContact O-N 3.39Å
427L85.4Confident89.1Confident31 Ų3182.2 Ų82.216%0.16243%0.433CS..PPolyproline II helixtrans-67.3125.2168.6-72.6169.7000111R337 L349 I352 F353 M424R337-L427 HydrophobicContact CB-CD2 3.67Å; R337-L427 HydrophobicContact CG-CD2 4.4Å; L349-L427 HydrophobicContact CD2-CD1 4.05Å; I352-L427 HydrophobicContact CD1-CD1 3.69Å; F353-L427 HydrophobicContact CE2-CB 4.35Å; F353-L427 HydrophobicContact CZ-CB 3.83Å; M424-L427 HydrophobicContact CB-CD1 4.28Å; M424-L427 HydrophobicContact CE-CD1 4.21Å; M424-L427 HydrophobicContact CE-CD2 3.69Å; M424-L427 HydrophobicContact CE-CG 4.22Å
428Q88Confident89.2Confident118 Ų11875.8 Ų75.855%0.55141%0.408SS*.PPolyproline II helixtrans-64.7141.3177.5-67.2-176.9-6.700111.6R337 F353 N426 H431R337-Q428 PolarHBondContact NE-O 3.18Å; F353-Q428 WeakPolarHBondContact CE1-O 3.44Å; F353-Q428 WeakPolarHBondContact CZ-O 3.37Å; N426-Q428 PolarHBondContact O-N 3.39Å; Q428-H431 PolarHBondContact OE1-NE2 3.38Å; Q428-H431 VanDerWaalsContact OE1-NE2 3.14Å
429P92Very high89.5Confident94 Ų9473.8 Ų73.861%0.6139%0.386SS*.PPolyproline II helixtrans-54.8163.6175.623.9-33000113.2R337 H431R337-P429 PolarHBondContact NH2-O 3.18Å; P429-H431 PolarHBondContact O-N 3.45Å
430S93.5Very high89.9Confident34 Ų3466.5 Ų66.524%0.23836%0.356CS..PPolyproline II helixtrans-61.9116.7173.7540000110.4
431H94.8Very high90.3Very high72 Ų7264 Ų6433%0.33334%0.343SS..PPolyproline II helixtrans-68.4147.4176.6-68.5-66.8000110.7Q428 P429 R433 E434 L435Q428-H431 PolarHBondContact OE1-NE2 3.38Å; Q428-H431 VanDerWaalsContact OE1-NE2 3.14Å; P429-H431 PolarHBondContact O-N 3.45Å; H431-R433 PolarHBondContact O-N 2.99Å; H431-E434 HydrophobicContact CB-CG 4.32Å; H431-E434 IonicContact CD2-OE1 3.14Å; H431-E434 PolarHBondContact CD2-OE1 3.14Å; H431-E434 WeakPolarHBondContact O-CB 3.03Å; H431-E434 PolarHBondContact O-N 3.47Å; H431-L435 PolarHBondContact O-N 2.94Å
432T96.1Very high90.7Very high119 Ų11963 Ų6373%0.7334%0.336SS*.Hα-helixtrans-55.2-40.6176.852.20000111.8E434 L435 T436T432-E434 VanDerWaalsContact C-N 3.31Å; T432-E434 PolarHBondContact O-N 3.46Å; T432-L435 PolarHBondContact O-N 3.37Å; T432-T436 WeakPolarHBondContact O-CG2 3.49Å; T432-T436 PolarHBondContact O-N 2.83Å; T432-T436 PolarHBondContact O-OG1 3.36Å; T432-T436 VanDerWaalsContact O-OG1 3.09Å
433R95.6Very high91.4Very high36 Ų3660.1 Ų60.114%0.13632%0.32CS..Hα-helixtrans-51.5-45.5172.5-179.4-165.174.1109.6-6.6113.3M79 A80 E336 H431 T436 L437M79-R433 WeakPolarHBondContact O-CD 3.45Å; M79-R433 PolarHBondContact O-NH1 2.92Å; A80-R433 PolarHBondContact O-NH1 3.39Å; E336-R433 IonicContact OE1-NH2 3.8Å; E336-R433 PolarHBondContact OE1-NH2 3.44Å; E336-R433 VanDerWaalsContact OE1-NH2 3.13Å; E336-R433 IonicContact OE2-NH2 3.97Å; E336-R433 PolarHBondContact OE2-NH2 2.69Å; H431-R433 PolarHBondContact O-N 2.99Å; R433-T436 VanDerWaalsContact C-OG1 3.32Å; R433-T436 WeakPolarHBondContact CA-OG1 3.37Å; R433-T436 PolarHBondContact O-OG1 2.84Å; R433-L437 VanDerWaalsContact O-CB 3.28Å; R433-L437 WeakPolarHBondContact O-CB 3.31Å; R433-L437 PolarHBondContact O-N 3.06Å
434E96.4Very high92.1Very high7 Ų753 Ų533%0.03329%0.29CS..Hα-helixtrans-67.7-46.1-178.1-69.6172-153.700110R337 M356 H431 T432 L437 M438R337-E434 IonicContact CZ-OE1 3.48Å; R337-E434 IonicContact CZ-OE2 2.87Å; R337-E434 IonicContact NH1-OE1 2.65Å; R337-E434 IonicContact NH1-OE2 2.78Å; R337-E434 PolarHBondContact NH1-OE2 3.41Å; R337-E434 IonicContact NH2-OE1 3.42Å; R337-E434 PolarHBondContact NH2-OE1 2.68Å; R337-E434 IonicContact NH2-OE2 3.79Å; R337-E434 PolarHBondContact NH2-OE2 3.39Å; M356-E434 HydrophobicContact CE-CB 4.36Å; H431-E434 HydrophobicContact CB-CG 4.32Å; H431-E434 IonicContact CD2-OE1 3.14Å; H431-E434 PolarHBondContact CD2-OE1 3.14Å; H431-E434 WeakPolarHBondContact O-CB 3.03Å; H431-E434 PolarHBondContact O-N 3.47Å; T432-E434 VanDerWaalsContact C-N 3.31Å; T432-E434 PolarHBondContact O-N 3.46Å; E434-L437 WeakPolarHBondContact O-CB 3.32Å; E434-L437 PolarHBondContact O-N 3.41Å; E434-M438 WeakPolarHBondContact O-CG 3.14Å; E434-M438 PolarHBondContact O-N 3.28Å
435L96.9Very high92.8Very high34 Ų3451.9 Ų51.918%0.17828%0.284CS..Hα-helixtrans-64-42.5178.7-63.7172000112.1L355 H431 T432 L437 M438 A439L355-L435 HydrophobicContact CB-CD2 4.37Å; L355-L435 HydrophobicContact CD2-CD1 3.59Å; L355-L435 HydrophobicContact CD2-CD2 3.5Å; L355-L435 HydrophobicContact CD2-CG 4.13Å; L355-L435 HydrophobicContact CG-CD2 3.77Å; H431-L435 PolarHBondContact O-N 2.94Å; T432-L435 PolarHBondContact O-N 3.37Å; L435-L437 VanDerWaalsContact C-N 3.28Å; L435-L437 PolarHBondContact O-N 2.91Å; L435-M438 PolarHBondContact O-N 3.44Å; L435-A439 WeakPolarHBondContact O-CB 3.36Å; L435-A439 PolarHBondContact O-N 2.9Å
436T96.9Very high93.8Very high64 Ų6449.7 Ų49.739%0.39327%0.273SS..Hα-helixtrans-62.2-38.7174.552.80000111.2T432 R433 A439 L440T432-T436 WeakPolarHBondContact O-CG2 3.49Å; T432-T436 PolarHBondContact O-N 2.83Å; T432-T436 PolarHBondContact O-OG1 3.36Å; T432-T436 VanDerWaalsContact O-OG1 3.09Å; R433-T436 VanDerWaalsContact C-OG1 3.32Å; R433-T436 WeakPolarHBondContact CA-OG1 3.37Å; R433-T436 PolarHBondContact O-OG1 2.84Å; T436-A439 PolarHBondContact O-N 3.33Å; T436-L440 WeakPolarHBondContact O-CB 3.42Å; T436-L440 WeakPolarHBondContact O-CG 3.49Å; T436-L440 PolarHBondContact O-N 3.28Å
437L97.3Very high94.8Very high5 Ų547 Ų473%0.02626%0.258CS..Hα-helixtrans-64.9-46177.4-177.5155.9000110.7M79 A80 C329 R433 E434 L435 A439 L440 H441M79-L437 HydrophobicContact CB-CD1 4.39Å; A80-L437 HydrophobicContact CB-CD1 3.56Å; C329-L437 HydrophobicContact CB-CD2 3.35Å; R433-L437 VanDerWaalsContact O-CB 3.28Å; R433-L437 WeakPolarHBondContact O-CB 3.31Å; R433-L437 PolarHBondContact O-N 3.06Å; E434-L437 WeakPolarHBondContact O-CB 3.32Å; E434-L437 PolarHBondContact O-N 3.41Å; L435-L437 VanDerWaalsContact C-N 3.28Å; L435-L437 PolarHBondContact O-N 2.91Å; L437-A439 VanDerWaalsContact C-N 3.33Å; L437-A439 PolarHBondContact O-N 3.5Å; L437-L440 PolarHBondContact O-N 2.86Å; L437-H441 VanDerWaalsContact CD2-CE1 3.46Å; L437-H441 WeakPolarHBondContact CD2-CE1 3.27Å; L437-H441 PolarHBondContact O-N 3.39Å; L437-H441 PolarHBondContact O-ND1 3.16Å
438M97.7Very high95.1Very high3 Ų347.1 Ų47.12%0.01526%0.259CS..Hα-helixtrans-62.7-42.7178.2-57.6-42.4157.200111.3L326 C329 L330 M356 W359 E434 L435 L440 H441 M442L326-M438 HydrophobicContact CD1-CB 4.09Å; L326-M438 HydrophobicContact CD1-CG 4.25Å; L326-M438 HydrophobicContact CD1-SD 3.34Å; L326-M438 WeakPolarHBondContact CD1-SD 3.42Å; C329-M438 HydrophobicContact CB-CE 3.87Å; C329-M438 HydrophobicContact CB-SD 4.19Å; L330-M438 HydrophobicContact CD2-CE 3.87Å; L330-M438 HydrophobicContact CD2-CG 4.06Å; L330-M438 HydrophobicContact CD2-SD 3.65Å; L330-M438 HydrophobicContact CG-CE 4.2Å; L330-M438 HydrophobicContact CG-SD 3.84Å; M356-M438 HydrophobicContact CE-CE 3.54Å; M356-M438 HydrophobicContact CE-CG 4.3Å; M356-M438 HydrophobicContact SD-CG 4.1Å; W359-M438 HydrophobicContact CB-CB 4.07Å; W359-M438 HydrophobicContact CB-CG 4.15Å; W359-M438 HydrophobicContact CD2-CB 3.58Å; W359-M438 HydrophobicContact CE3-CB 4.12Å; W359-M438 HydrophobicContact CG-CB 3.56Å; W359-M438 HydrophobicContact CG-CG 3.99Å; E434-M438 WeakPolarHBondContact O-CG 3.14Å; E434-M438 PolarHBondContact O-N 3.28Å; L435-M438 PolarHBondContact O-N 3.44Å; M438-L440 PolarHBondContact O-N 2.89Å; M438-H441 PolarHBondContact O-N 3.04Å; M438-M442 PolarHBondContact O-N 3.4Å
439A97.6Very high95.3Very high21 Ų2143.1 Ų43.117%0.17424%0.242CC..Hα-helixtrans-60.4-44.3176.100000112.2W359 L435 T436 L437 H441 M442 I443W359-A439 HydrophobicContact CH2-CB 3.88Å; W359-A439 HydrophobicContact CZ2-CB 3.9Å; L435-A439 WeakPolarHBondContact O-CB 3.36Å; L435-A439 PolarHBondContact O-N 2.9Å; T436-A439 PolarHBondContact O-N 3.33Å; L437-A439 VanDerWaalsContact C-N 3.33Å; L437-A439 PolarHBondContact O-N 3.5Å; A439-H441 PolarHBondContact O-N 3.07Å; A439-M442 PolarHBondContact O-N 3.31Å; A439-I443 HydrophobicContact CB-CD1 4.06Å; A439-I443 WeakPolarHBondContact O-CB 3.34Å; A439-I443 WeakPolarHBondContact O-CD1 3.5Å; A439-I443 WeakPolarHBondContact O-CG1 3.12Å; A439-I443 PolarHBondContact O-N 3.21Å
440L97.5Very high95.3Very high38 Ų3844.9 Ų44.920%0.19925%0.245CC..Hα-helixtrans-67.2-18.8179.5-73.2170.3000114.1F32 W72 L76 M79 T436 L437 M438 P444F32-L440 HydrophobicContact CE1-CD1 4.24Å; F32-L440 HydrophobicContact CE1-CD2 4.47Å; F32-L440 HydrophobicContact CZ-CD1 3.77Å; W72-L440 HydrophobicContact CH2-CD2 3.77Å; W72-L440 HydrophobicContact CZ2-CB 4.12Å; W72-L440 HydrophobicContact CZ2-CD2 3.74Å; W72-L440 WeakPolarHBondContact CZ2-O 3.29Å; W72-L440 PolarHBondContact NE1-O 3.26Å; W72-L440 VanDerWaalsContact NE1-O 3.16Å; L76-L440 HydrophobicContact CD1-CB 4.04Å; L76-L440 HydrophobicContact CD1-CD1 4.2Å; L76-L440 HydrophobicContact CD2-CB 4.49Å; L76-L440 HydrophobicContact CG-CB 4.24Å; M79-L440 HydrophobicContact CE-CD1 4.34Å; M79-L440 HydrophobicContact SD-CD1 3.81Å; T436-L440 WeakPolarHBondContact O-CB 3.42Å; T436-L440 WeakPolarHBondContact O-CG 3.49Å; T436-L440 PolarHBondContact O-N 3.28Å; L437-L440 PolarHBondContact O-N 2.86Å; M438-L440 PolarHBondContact O-N 2.89Å; L440-P444 WeakPolarHBondContact O-CD 3.49Å; L440-P444 VanDerWaalsContact O-CG 3.28Å; L440-P444 WeakPolarHBondContact O-CG 3.16Å
441H97.1Very high95.1Very high1 Ų145.6 Ų45.61%0.00525%0.25CS..Hα-helixtrans-85.2-43.6169.6-70.678.2000111.6L76 S325 L326 L437 M438 A439L76-H441 VanDerWaalsContact CD2-CE1 3.41Å; L76-H441 WeakPolarHBondContact CD2-CE1 3.45Å; S325-H441 PolarHBondContact OG-CD2 3.47Å; S325-H441 VanDerWaalsContact OG-CD2 3.27Å; L326-H441 HydrophobicContact CB-CB 3.91Å; L326-H441 HydrophobicContact CD1-CB 3.98Å; L326-H441 HydrophobicContact CD2-CB 4.43Å; L326-H441 HydrophobicContact CG-CB 4.33Å; L437-H441 VanDerWaalsContact CD2-CE1 3.46Å; L437-H441 WeakPolarHBondContact CD2-CE1 3.27Å; L437-H441 PolarHBondContact O-N 3.39Å; L437-H441 PolarHBondContact O-ND1 3.16Å; M438-H441 PolarHBondContact O-N 3.04Å; A439-H441 PolarHBondContact O-N 3.07Å
442M95.5Very high94.8Very high5 Ų543.8 Ų43.83%0.02525%0.245CC..Hα-helixtrans-75.8-37.2-174.1-76.4-58.8-52.700113.9L326 W359 L362 M438 A439 L445 I446L326-M442 HydrophobicContact CD2-CG 3.57Å; L326-M442 HydrophobicContact CD2-SD 3.22Å; L326-M442 WeakPolarHBondContact CD2-SD 3.3Å; W359-M442 HydrophobicContact CE3-CB 4.13Å; W359-M442 HydrophobicContact CE3-CG 3.63Å; W359-M442 HydrophobicContact CH2-CB 4.42Å; W359-M442 HydrophobicContact CZ3-CB 3.5Å; W359-M442 HydrophobicContact CZ3-CG 3.55Å; L362-M442 HydrophobicContact CB-CE 3.75Å; L362-M442 HydrophobicContact CB-SD 4.27Å; L362-M442 HydrophobicContact CD1-CE 4.45Å; M438-M442 PolarHBondContact O-N 3.4Å; A439-M442 PolarHBondContact O-N 3.31Å; M442-L445 HydrophobicContact CE-CD2 4.14Å; M442-L445 WeakPolarHBondContact O-CB 3.49Å; M442-L445 PolarHBondContact O-N 3.19Å; M442-I446 HydrophobicContact CE-CD1 4.19Å; M442-I446 HydrophobicContact CE-CG1 4.29Å; M442-I446 WeakPolarHBondContact O-CG1 3.19Å; M442-I446 PolarHBondContact O-N 3.16Å
443I95.9Very high94.4Very high88 Ų8846 Ų4645%0.45124%0.244SC..Hα-helixtrans-60.3-50.5-178.5-68.1163.2000110.9A439 L445 I446 L447A439-I443 HydrophobicContact CB-CD1 4.06Å; A439-I443 WeakPolarHBondContact O-CB 3.34Å; A439-I443 WeakPolarHBondContact O-CD1 3.5Å; A439-I443 WeakPolarHBondContact O-CG1 3.12Å; A439-I443 PolarHBondContact O-N 3.21Å; I443-L445 VanDerWaalsContact C-N 3.29Å; I443-L445 PolarHBondContact O-N 3.1Å; I443-I446 PolarHBondContact O-N 3.05Å; I443-L447 HydrophobicContact CG2-CD1 3.67Å; I443-L447 HydrophobicContact CG2-CG 4.19Å; I443-L447 WeakPolarHBondContact O-CB 3.28Å; I443-L447 VanDerWaalsContact O-CG 3.32Å; I443-L447 WeakPolarHBondContact O-CG 3.41Å; I443-L447 PolarHBondContact O-N 3.17Å
444P94.8Very high93.9Very high27 Ų2747.8 Ų47.818%0.17526%0.256CS..Hα-helixtrans-59.4-39174.4-24.534.4000113W72 L322 L440 I446 L447 L448W72-P444 HydrophobicContact CZ2-CG 3.82Å; L322-P444 HydrophobicContact CD1-CB 4.34Å; L440-P444 WeakPolarHBondContact O-CD 3.49Å; L440-P444 VanDerWaalsContact O-CG 3.28Å; L440-P444 WeakPolarHBondContact O-CG 3.16Å; P444-I446 VanDerWaalsContact C-N 3.31Å; P444-I446 PolarHBondContact O-N 3.49Å; P444-L447 PolarHBondContact O-N 3.42Å; P444-L448 WeakPolarHBondContact O-CB 3.09Å; P444-L448 VanDerWaalsContact O-CG 3.29Å; P444-L448 WeakPolarHBondContact O-CG 3.31Å; P444-L448 PolarHBondContact O-N 3.06Å
445L93.8Very high93.6Very high7 Ų747.7 Ų47.74%0.03726%0.256CS..Hα-helixtrans-63.2-37.8178.8-173141.1000112L322 T323 A366 I374 M442 I443 T449L322-L445 HydrophobicContact CB-CD1 4.02Å; L322-L445 HydrophobicContact CD1-CB 4.25Å; T323-L445 HydrophobicContact CG2-CD1 3.37Å; A366-L445 HydrophobicContact CB-CD1 4.41Å; A366-L445 HydrophobicContact CB-CD2 4.17Å; I374-L445 WeakPolarHBondContact CD1-O 3.47Å; M442-L445 HydrophobicContact CE-CD2 4.14Å; M442-L445 WeakPolarHBondContact O-CB 3.49Å; M442-L445 PolarHBondContact O-N 3.19Å; I443-L445 VanDerWaalsContact C-N 3.29Å; I443-L445 PolarHBondContact O-N 3.1Å; L445-T449 WeakPolarHBondContact O-CG2 3.37Å
446I93.6Very high93Very high86 Ų8647.2 Ų47.244%0.44125%0.254SS..Hα-helixtrans-75.5-42175.2-64.1164.4000110.8M442 I443 P444 L448 T449M442-I446 HydrophobicContact CE-CD1 4.19Å; M442-I446 HydrophobicContact CE-CG1 4.29Å; M442-I446 WeakPolarHBondContact O-CG1 3.19Å; M442-I446 PolarHBondContact O-N 3.16Å; I443-I446 PolarHBondContact O-N 3.05Å; P444-I446 VanDerWaalsContact C-N 3.31Å; P444-I446 PolarHBondContact O-N 3.49Å; I446-L448 VanDerWaalsContact C-N 3.3Å; I446-L448 PolarHBondContact O-N 3.01Å; I446-T449 PolarHBondContact O-N 3.35Å; I446-T449 VanDerWaalsContact O-N 3.13Å; I446-T449 PolarHBondContact O-OG1 3.35Å
447L93.5Very high92.2Very high98 Ų9844.2 Ų44.251%0.51324%0.237SC..Hα-helixtrans-64.2-35.6-179.6-72.3173.3000112.6I443 P444 T449 I450I443-L447 HydrophobicContact CG2-CD1 3.67Å; I443-L447 HydrophobicContact CG2-CG 4.19Å; I443-L447 WeakPolarHBondContact O-CB 3.28Å; I443-L447 VanDerWaalsContact O-CG 3.32Å; I443-L447 WeakPolarHBondContact O-CG 3.41Å; I443-L447 PolarHBondContact O-N 3.17Å; P444-L447 PolarHBondContact O-N 3.42Å; L447-T449 PolarHBondContact O-N 2.96Å; L447-I450 HydrophobicContact CD2-CD1 4.31Å; L447-I450 WeakPolarHBondContact O-CB 3.35Å; L447-I450 PolarHBondContact O-N 3.47Å
448L93.6Very high90.7Very high33 Ų3345.8 Ų45.817%0.17325%0.245CC..Hα-helixtrans-67.5-19.9176.8-77.1172.3000112.9I318 L322 I374 P444 I446 I450 S451 I455I318-L448 HydrophobicContact CG2-CD1 4.26Å; L322-L448 HydrophobicContact CD1-CD1 4.19Å; I374-L448 HydrophobicContact CD1-CB 3.22Å; I374-L448 HydrophobicContact CD1-CD1 4.41Å; I374-L448 HydrophobicContact CD1-CG 4.45Å; I374-L448 HydrophobicContact CG1-CB 4.17Å; P444-L448 WeakPolarHBondContact O-CB 3.09Å; P444-L448 VanDerWaalsContact O-CG 3.29Å; P444-L448 WeakPolarHBondContact O-CG 3.31Å; P444-L448 PolarHBondContact O-N 3.06Å; I446-L448 VanDerWaalsContact C-N 3.3Å; I446-L448 PolarHBondContact O-N 3.01Å; L448-I450 VanDerWaalsContact C-N 3.27Å; L448-I450 PolarHBondContact O-N 2.95Å; L448-S451 CarbonylContact O-C 3.57Å; L448-S451 PolarHBondContact O-N 3.44Å; L448-I455 HydrophobicContact CB-CD1 4.42Å; L448-I455 HydrophobicContact CD2-CG2 3.87Å
449T92Very high88.7Confident34 Ų3448.1 Ų48.121%0.20926%0.259CS..Hα-helixtrans-70.1-27.1174.169.10000112I374 L445 I446 L447I374-T449 HydrophobicContact CD1-CG2 4.01Å; I374-T449 HydrophobicContact CG1-CG2 3.97Å; L445-T449 WeakPolarHBondContact O-CG2 3.37Å; I446-T449 PolarHBondContact O-N 3.35Å; I446-T449 VanDerWaalsContact O-N 3.13Å; I446-T449 PolarHBondContact O-OG1 3.35Å; L447-T449 PolarHBondContact O-N 2.96Å
450I90.9Very high85.9Confident131 Ų13156.9 Ų56.967%0.67230%0.299SS*.Hα-helixtrans-72.9-33178.8-56.6172.2000110.5L447 L448L447-I450 HydrophobicContact CD2-CD1 4.31Å; L447-I450 WeakPolarHBondContact O-CB 3.35Å; L447-I450 PolarHBondContact O-N 3.47Å; L448-I450 VanDerWaalsContact C-N 3.27Å; L448-I450 PolarHBondContact O-N 2.95Å
451S89.1Confident85.4Confident49 Ų4957.9 Ų57.934%0.34330%0.304SS..  trans-13465.2-176.754.90000112.5L448 K453 L454L448-S451 CarbonylContact O-C 3.57Å; L448-S451 PolarHBondContact O-N 3.44Å; S451-K453 PolarHBondContact O-N 2.8Å; S451-K453 VanDerWaalsContact O-N 3.09Å; S451-L454 PolarHBondContact O-N 3.29Å
452P88.1Confident84.7Confident34 Ų3460.8 Ų60.822%0.22132%0.32CS..G310 helixtrans-66-16.9-176.128.5-35.6000112.9M315 M377 L454 I455 T456M315-P452 HydrophobicContact CE-CB 4.25Å; M377-P452 HydrophobicContact CE-CG 4.38Å; M377-P452 HydrophobicContact SD-CB 3.72Å; M377-P452 HydrophobicContact SD-CG 3.94Å; P452-L454 PolarHBondContact O-N 2.91Å; P452-L454 VanDerWaalsContact O-N 3.13Å; P452-I455 WeakPolarHBondContact O-CG1 3.35Å; P452-I455 PolarHBondContact O-N 3.44Å; P452-T456 PolarHBondContact O-N 2.92Å
453K87.5Confident84.1Confident165 Ų16563.9 Ų63.972%0.71734%0.336SS*.G310 helixtrans-56.8-26.5175.4-171.9175.7179.6-179.40113.3S451 I455 T456S451-K453 PolarHBondContact O-N 2.8Å; S451-K453 VanDerWaalsContact O-N 3.09Å; K453-I455 PolarHBondContact O-N 3.14Å; K453-T456 PolarHBondContact O-OG1 3.31Å
454L86.8Confident83.4Confident73 Ų7362.5 Ų62.538%0.38233%0.33SS..G310 helixtrans-67.9-15.2178.7-62.6176.1000113.2L42 P65 S451 P452L42-L454 HydrophobicContact CD1-CD1 4.4Å; L42-L454 HydrophobicContact CD2-CD2 4.34Å; P65-L454 WeakPolarHBondContact CG-O 3.44Å; S451-L454 PolarHBondContact O-N 3.29Å; P452-L454 PolarHBondContact O-N 2.91Å; P452-L454 VanDerWaalsContact O-N 3.13Å
455I88.8Confident82.7Confident5 Ų564.8 Ų64.83%0.02634%0.339CS..G310 helixtrans-1309-170.457.7168.5000113P65 T314 M315 I318 I374 L448 P452 K453 G457P65-I455 HydrophobicContact CB-CG2 4.11Å; P65-I455 HydrophobicContact CG-CG2 4.35Å; T314-I455 PolarHBondContact OG1-O 3.3Å; M315-I455 HydrophobicContact CG-CD1 4.4Å; M315-I455 HydrophobicContact CG-CG1 4.26Å; I318-I455 HydrophobicContact CD1-CB 3.57Å; I318-I455 HydrophobicContact CD1-CG2 3.63Å; I318-I455 HydrophobicContact CG2-CG2 4.37Å; I374-I455 HydrophobicContact CB-CD1 4.31Å; I374-I455 HydrophobicContact CD1-CD1 4.34Å; I374-I455 HydrophobicContact CG1-CD1 4.03Å; I374-I455 HydrophobicContact CG2-CD1 3.3Å; L448-I455 HydrophobicContact CB-CD1 4.42Å; L448-I455 HydrophobicContact CD2-CG2 3.87Å; P452-I455 WeakPolarHBondContact O-CG1 3.35Å; P452-I455 PolarHBondContact O-N 3.44Å; K453-I455 PolarHBondContact O-N 3.14Å; I455-G457 PolarHBondContact O-N 2.97Å
456T84.5Confident82Confident24 Ų2468.6 Ų68.615%0.14736%0.359CS..  trans-70-9.7175.746.20000113.2M311 T314 M315 P452 K453M311-T456 VanDerWaalsContact CA-O 3.31Å; M311-T456 WeakPolarHBondContact CA-O 3.49Å; M311-T456 WeakPolarHBondContact CG-O 3.4Å; T314-T456 PolarHBondContact OG1-O 3.24Å; M315-T456 HydrophobicContact CE-CG2 3.09Å; P452-T456 PolarHBondContact O-N 2.92Å; K453-T456 PolarHBondContact O-OG1 3.31Å
457G80.4Confident81.2Confident2 Ų267.4 Ų67.42%0.02135%0.354CS..  trans64.5-144.5-179.500000112.9T61 I455 T459T61-G457 WeakPolarHBondContact CB-O 3.21Å; T61-G457 PolarHBondContact OG1-O 3.24Å; I455-G457 PolarHBondContact O-N 2.97Å; G457-T459 PolarHBondContact O-N 3Å
458L66.2Low80.2Confident38 Ų3865 Ų6520%0.19934%0.341CS..  trans-74.8115.4-178.1-72.2155.5000110T61 I245 M460T61-L458 PolarHBondContact OG1-N 2.91Å; I245-L458 HydrophobicContact CG2-CD1 4.26Å; L458-M460 HydrophobicContact CB-CG 4.41Å
459T54.9Low79.1Confident51 Ų5167.7 Ų67.731%0.31336%0.355SS..  trans-94.286.4159.780.60000107.4E47 M311 G457E47-T459 PolarHBondContact OE1-OG1 3.33Å; E47-T459 PolarHBondContact OE2-OG1 2.97Å; M311-T459 HydrophobicContact CE-CG2 3.42Å; M311-T459 VanDerWaalsContact CE-CG2 3.42Å; M311-T459 HydrophobicContact CG-CG2 4.44Å; M311-T459 HydrophobicContact SD-CG2 4.06Å; G457-T459 PolarHBondContact O-N 3Å
460M40.1Very low77.9Confident206 Ų20670.7 Ų70.7100%1.01537%0.369SS*.  trans-73.50172.9-74.7-78.1-93.900109.9L458L458-M460 HydrophobicContact CB-CG 4.41Å

Retrieved 460 of 460 residues in 893.4 ms (Link to these results)

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