A0A077ZGR7_TRITR Loading...

RabGAP-TBC domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZGR7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 459 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
1M72.8Confident85.7Confident98 Ų9876.5 Ų76.548%0.48340%0.398SS..  0830-72.5-135.1-69.300110.6L4 L59 Q60 R63M1-L4 HydrophobicContact CE-CB 4.45Å; M1-L4 HydrophobicContact CE-CD2 3.64Å; M1-L59 HydrophobicContact CE-CB 4.15Å; M1-L59 WeakPolarHBondContact CE-O 3.36Å; M1-Q60 HydrophobicContact CE-CB 4.07Å; M1-Q60 HydrophobicContact SD-CB 4.38Å; M1-Q60 HydrophobicContact SD-CG 4.39Å; M1-R63 PolarHBondContact SD-NH1 3.18Å; M1-R63 VanDerWaalsContact SD-NH1 3.36Å
2P82.1Confident85.8Confident96 Ų9673.2 Ų73.262%0.62340%0.396SS*.Hα-helixtrans-69.5-39.5-175.224.9-31000113.2L4 G5 M6P2-L4 PolarHBondContact O-N 3.23Å; P2-G5 PolarHBondContact O-N 3.23Å; P2-M6 PolarHBondContact O-N 2.7Å
3D86.3Confident86Confident82 Ų8268.1 Ų68.144%0.43937%0.368SS..Hα-helixtrans-65.6-40.7-173.8-36.4-45.1000112.9M6 H7 R63 F67D3-M6 PolarHBondContact O-N 3.17Å; D3-H7 PolarHBondContact O-N 3.32Å; D3-R63 IonicContact OD2-CZ 2.7Å; D3-R63 IonicContact OD2-NH1 3.61Å; D3-R63 IonicContact OD2-NH2 2.99Å; D3-R63 PolarHBondContact OD2-NH2 3.01Å; D3-F67 HydrophobicContact CB-CZ 3.98Å
4L86.4Confident86.2Confident4 Ų470.4 Ų70.42%0.02138%0.38CS..Hα-helixtrans-67.3-40177.1-17368.5000110.9M1 P2 M6 H7 F8 L59 L66 F67M1-L4 HydrophobicContact CE-CB 4.45Å; M1-L4 HydrophobicContact CE-CD2 3.64Å; P2-L4 PolarHBondContact O-N 3.23Å; L4-M6 VanDerWaalsContact C-N 3.31Å; L4-M6 PolarHBondContact O-N 2.97Å; L4-H7 PolarHBondContact O-N 2.95Å; L4-F8 HydrophobicContact CD1-CD1 4.3Å; L4-F8 HydrophobicContact CD1-CE1 3.79Å; L4-F8 HydrophobicContact CD1-CZ 4.16Å; L4-F8 HydrophobicContact CD2-CZ 4.27Å; L4-F8 HydrophobicContact CG-CD1 4.46Å; L4-F8 HydrophobicContact CG-CE1 4.12Å; L4-F8 HydrophobicContact CG-CE2 4.47Å; L4-F8 HydrophobicContact CG-CZ 4.13Å; L4-F8 PolarHBondContact O-N 3.23Å; L4-L59 HydrophobicContact CD2-CB 4.13Å; L4-L59 HydrophobicContact CD2-CD2 4.46Å; L4-L66 HydrophobicContact CD1-CB 4.06Å; L4-L66 HydrophobicContact CD1-CD1 4.49Å; L4-L66 HydrophobicContact CD2-CD1 4.3Å; L4-F67 HydrophobicContact CB-CE2 4.38Å; L4-F67 HydrophobicContact CB-CZ 4.36Å; L4-F67 HydrophobicContact CD1-CD2 4.28Å; L4-F67 HydrophobicContact CD1-CE2 3.98Å; L4-F67 HydrophobicContact CD1-CZ 4.31Å
5G85Confident86.4Confident35 Ų3571.5 Ų71.536%0.36139%0.391SS..Hα-helixtrans-63.8-35.817500000112.8P2 R9P2-G5 PolarHBondContact O-N 3.23Å; G5-R9 WeakPolarHBondContact O-CB 3.46Å; G5-R9 PolarHBondContact O-N 3.37Å; G5-R9 VanDerWaalsContact O-N 3.1Å
6M86.9Confident86.6Confident110 Ų11073 Ų7354%0.54240%0.403SS..Hα-helixtrans-66.3-43.2171.3-75.6-178.760.500111.9P2 D3 L4 R9 N10P2-M6 PolarHBondContact O-N 2.7Å; D3-M6 PolarHBondContact O-N 3.17Å; L4-M6 VanDerWaalsContact C-N 3.31Å; L4-M6 PolarHBondContact O-N 2.97Å; M6-R9 PolarHBondContact O-N 3.32Å; M6-N10 WeakPolarHBondContact O-CB 3.3Å; M6-N10 PolarHBondContact O-N 3.21Å; M6-N10 PolarHBondContact O-ND2 3.39Å; M6-N10 PolarHBondContact O-OD1 3.4Å
7H87.7Confident86.8Confident36 Ų3673 Ų7317%0.16740%0.4CS..Hα-helixtrans-60.6-48.5176.9179.967.5000111.7D3 L4 R9 N10 V11 L66 F67D3-H7 PolarHBondContact O-N 3.32Å; L4-H7 PolarHBondContact O-N 2.95Å; H7-R9 VanDerWaalsContact C-N 3.3Å; H7-R9 PolarHBondContact O-N 3.44Å; H7-N10 PolarHBondContact O-N 3.34Å; H7-N10 VanDerWaalsContact O-N 3.09Å; H7-V11 WeakPolarHBondContact O-CG2 3.33Å; H7-V11 PolarHBondContact O-N 3.26Å; H7-L66 PolarHBondContact NE2-O 3Å; H7-F67 HydrophobicContact CB-CD1 4.09Å; H7-F67 HydrophobicContact CB-CE1 3.65Å; H7-F67 HydrophobicContact CB-CZ 4.41Å; H7-F67 AromaticContact CG-CD1 3.86Å; H7-F67 AromaticContact CG-CE1 3.97Å
8F89.7Confident86.9Confident11 Ų1169.5 Ų69.55%0.04838%0.38CS..Hα-helixtrans-58.9-41.6176.4-75.13.9000112.3L4 N10 V11 G12 I13 Y18 L59 L66 I74 L78L4-F8 HydrophobicContact CD1-CD1 4.3Å; L4-F8 HydrophobicContact CD1-CE1 3.79Å; L4-F8 HydrophobicContact CD1-CZ 4.16Å; L4-F8 HydrophobicContact CD2-CZ 4.27Å; L4-F8 HydrophobicContact CG-CD1 4.46Å; L4-F8 HydrophobicContact CG-CE1 4.12Å; L4-F8 HydrophobicContact CG-CE2 4.47Å; L4-F8 HydrophobicContact CG-CZ 4.13Å; L4-F8 PolarHBondContact O-N 3.23Å; F8-N10 PolarHBondContact O-N 3.31Å; F8-V11 PolarHBondContact O-N 2.67Å; F8-G12 PolarHBondContact O-N 3.42Å; F8-I13 HydrophobicContact CB-CB 4.33Å; F8-I13 PolarHBondContact O-N 3.33Å; F8-Y18 HydrophobicContact CD2-CE1 4.12Å; F8-Y18 AromaticContact CE2-CE1 3.89Å; F8-Y18 HydrophobicContact CE2-CE1 3.89Å; F8-Y18 AromaticContact CE2-CZ 3.89Å; F8-L59 HydrophobicContact CE2-CD2 4.12Å; F8-L59 HydrophobicContact CZ-CD2 4.25Å; F8-L66 HydrophobicContact CE1-CB 4.41Å; F8-L66 HydrophobicContact CE1-CD2 4.48Å; F8-L66 HydrophobicContact CZ-CD1 4.11Å; F8-L66 HydrophobicContact CZ-CD2 4.31Å; F8-I74 HydrophobicContact CD1-CD1 4.19Å; F8-I74 HydrophobicContact CE1-CD1 4Å; F8-I74 HydrophobicContact CE1-CG2 3.97Å; F8-I74 HydrophobicContact CZ-CG2 4.1Å; F8-L78 HydrophobicContact CZ-CD1 4.4Å
9R88.3Confident87.1Confident197 Ų19766.1 Ų66.174%0.74336%0.362SS*.Hα-helixtrans-64.3-38.7175.6-166.7-177.8-60.5159.52.1112.6G5 M6 H7 G12G5-R9 WeakPolarHBondContact O-CB 3.46Å; G5-R9 PolarHBondContact O-N 3.37Å; G5-R9 VanDerWaalsContact O-N 3.1Å; M6-R9 PolarHBondContact O-N 3.32Å; H7-R9 VanDerWaalsContact C-N 3.3Å; H7-R9 PolarHBondContact O-N 3.44Å; R9-G12 PolarHBondContact O-N 3.02Å
10N88.6Confident87.2Confident131 Ų13165.4 Ų65.470%0.70136%0.362SS*.Hα-helixtrans-68.8-35.2177.3-70.1-13.4000112.3M6 H7 F8 G12M6-N10 WeakPolarHBondContact O-CB 3.3Å; M6-N10 PolarHBondContact O-N 3.21Å; M6-N10 PolarHBondContact O-ND2 3.39Å; M6-N10 PolarHBondContact O-OD1 3.4Å; H7-N10 PolarHBondContact O-N 3.34Å; H7-N10 VanDerWaalsContact O-N 3.09Å; F8-N10 PolarHBondContact O-N 3.31Å; N10-G12 VanDerWaalsContact C-N 3.3Å
11V88.7Confident87.4Confident42 Ų4264 Ų6426%0.25536%0.357SS..Hα-helixtrans-78.4-17.2175.9179.60000111.7H7 F8 I13 M71 I74H7-V11 WeakPolarHBondContact O-CG2 3.33Å; H7-V11 PolarHBondContact O-N 3.26Å; F8-V11 PolarHBondContact O-N 2.67Å; V11-I13 HydrophobicContact CB-CG1 4.42Å; V11-I13 HydrophobicContact CG1-CD1 4.03Å; V11-I13 HydrophobicContact CG1-CG1 4.01Å; V11-M71 HydrophobicContact CG1-CB 3.54Å; V11-M71 HydrophobicContact CG1-CG 4.09Å; V11-I74 HydrophobicContact CG1-CD1 4.36Å
12G87.5Confident88.3Confident36 Ų3659.4 Ų59.437%0.37134%0.335SS..THydrogen-bonded Turntrans86.223.5179.200000114.2F8 R9 N10 M71F8-G12 PolarHBondContact O-N 3.42Å; R9-G12 PolarHBondContact O-N 3.02Å; N10-G12 VanDerWaalsContact C-N 3.3Å; G12-M71 VanDerWaalsContact O-CE 3.24Å; G12-M71 WeakPolarHBondContact O-CE 3.47Å
13I88.2Confident88.8Confident7 Ų758.3 Ų58.34%0.03632%0.32CS..  trans-89.8117.6177.7-58.4178.8000109.6F8 V11 M17 Y18 M71 I74 L75F8-I13 HydrophobicContact CB-CB 4.33Å; F8-I13 PolarHBondContact O-N 3.33Å; V11-I13 HydrophobicContact CB-CG1 4.42Å; V11-I13 HydrophobicContact CG1-CD1 4.03Å; V11-I13 HydrophobicContact CG1-CG1 4.01Å; I13-M17 HydrophobicContact CG2-SD 4.5Å; I13-Y18 HydrophobicContact CG2-CD1 3.99Å; I13-Y18 HydrophobicContact CG2-CE1 4.1Å; I13-M71 HydrophobicContact CD1-CG 4.36Å; I13-M71 HydrophobicContact CG1-CG 3.79Å; I13-I74 HydrophobicContact CD1-CB 3.44Å; I13-I74 VanDerWaalsContact CD1-CB 3.44Å; I13-I74 HydrophobicContact CD1-CD1 3.49Å; I13-I74 VanDerWaalsContact CD1-CD1 3.49Å; I13-I74 HydrophobicContact CD1-CG1 4.04Å; I13-I74 HydrophobicContact CD1-CG2 3.34Å; I13-L75 HydrophobicContact CG2-CD2 4.4Å
14D89.2Confident89Confident100 Ų10061.6 Ų61.654%0.53534%0.337SS..  trans-83.3143.3169.9-70.9-34.8000110.9T16 M17D14-T16 PolarHBondContact O-N 3.33Å; D14-T16 VanDerWaalsContact O-N 3.1Å; D14-M17 HydrophobicContact CB-CE 4.08Å; D14-M17 HydrophobicContact CB-CG 4.11Å; D14-M17 HydrophobicContact CB-SD 4.35Å; D14-M17 VanDerWaalsContact O-CB 3.31Å; D14-M17 WeakPolarHBondContact O-CB 3.36Å; D14-M17 WeakPolarHBondContact O-CG 3.5Å; D14-M17 PolarHBondContact O-N 2.88Å
15T88.2Confident89.2Confident88 Ų8863.5 Ų63.554%0.5435%0.349SS..THydrogen-bonded Turntrans-55.1-32.3178.9-50.30000112.6M17 A19T15-M17 PolarHBondContact O-N 2.74Å; T15-A19 HydrophobicContact CG2-CB 3.87Å; T15-A19 WeakPolarHBondContact O-CB 3.19Å; T15-A19 PolarHBondContact O-N 3.38Å
16T90.1Very high89.5Confident95 Ų9563.3 Ų63.358%0.58334%0.339SS*.Hα-helixtrans-65.7-23178.4530000113.1D14 Y18 S20D14-T16 PolarHBondContact O-N 3.33Å; D14-T16 VanDerWaalsContact O-N 3.1Å; T16-Y18 VanDerWaalsContact C-N 3.32Å; T16-Y18 PolarHBondContact O-N 3.01Å; T16-S20 WeakPolarHBondContact O-CB 3.32Å; T16-S20 PolarHBondContact O-OG 3.48Å
17M89.5Confident89.7Confident73 Ų7358.1 Ų58.136%0.3631%0.313SS..Hα-helixtrans-70.3-27.2-176.6-62.3179.817700113.2I13 D14 T15 M71 L75 Q79I13-M17 HydrophobicContact CG2-SD 4.5Å; D14-M17 HydrophobicContact CB-CE 4.08Å; D14-M17 HydrophobicContact CB-CG 4.11Å; D14-M17 HydrophobicContact CB-SD 4.35Å; D14-M17 VanDerWaalsContact O-CB 3.31Å; D14-M17 WeakPolarHBondContact O-CB 3.36Å; D14-M17 WeakPolarHBondContact O-CG 3.5Å; D14-M17 PolarHBondContact O-N 2.88Å; T15-M17 PolarHBondContact O-N 2.74Å; M17-M71 HydrophobicContact SD-CE 4.48Å; M17-L75 HydrophobicContact CB-CD2 3.8Å; M17-Q79 PolarHBondContact O-NE2 2.95Å; M17-Q79 VanDerWaalsContact O-NE2 3.11Å
18Y88.8Confident89.8Confident10 Ų1059.5 Ų59.54%0.03933%0.327CS..Hα-helixtrans-120.5-35.3177.765.7-91.3000112.9F8 I13 T16 S20 S21 W22 L59 L78F8-Y18 HydrophobicContact CD2-CE1 4.12Å; F8-Y18 AromaticContact CE2-CE1 3.89Å; F8-Y18 HydrophobicContact CE2-CE1 3.89Å; F8-Y18 AromaticContact CE2-CZ 3.89Å; I13-Y18 HydrophobicContact CG2-CD1 3.99Å; I13-Y18 HydrophobicContact CG2-CE1 4.1Å; T16-Y18 VanDerWaalsContact C-N 3.32Å; T16-Y18 PolarHBondContact O-N 3.01Å; Y18-S20 VanDerWaalsContact C-N 3.34Å; Y18-S20 PolarHBondContact O-N 2.88Å; Y18-S21 PolarHBondContact O-OG 3.34Å; Y18-W22 HydrophobicContact CD2-CD2 4.25Å; Y18-W22 HydrophobicContact CD2-CE3 4.04Å; Y18-W22 AromaticContact CD2-CH2 3.53Å; Y18-W22 HydrophobicContact CD2-CH2 3.53Å; Y18-W22 AromaticContact CD2-CZ2 3.74Å; Y18-W22 HydrophobicContact CD2-CZ2 3.74Å; Y18-W22 AromaticContact CD2-CZ3 3.69Å; Y18-W22 HydrophobicContact CD2-CZ3 3.69Å; Y18-W22 HydrophobicContact CE2-CE3 4.22Å; Y18-W22 AromaticContact CE2-CH2 3.72Å; Y18-W22 HydrophobicContact CE2-CH2 3.72Å; Y18-W22 HydrophobicContact CE2-CZ2 4.4Å; Y18-W22 AromaticContact CE2-CZ3 3.62Å; Y18-W22 HydrophobicContact CE2-CZ3 3.62Å; Y18-L59 HydrophobicContact CE2-CD1 4.36Å; Y18-L59 HydrophobicContact CE2-CD2 4.16Å; Y18-L78 HydrophobicContact CD1-CD1 4.02Å; Y18-L78 HydrophobicContact CD2-CD1 3.84Å; Y18-L78 HydrophobicContact CE1-CD1 4.46Å; Y18-L78 HydrophobicContact CE2-CD1 4.32Å; Y18-L78 HydrophobicContact CG-CD1 3.68Å
19A90.5Very high89.7Confident4 Ų462.3 Ų62.33%0.03335%0.348CS..Hα-helixtrans-76.4-23-172.600000113.1T15 S21 W22 F23T15-A19 HydrophobicContact CG2-CB 3.87Å; T15-A19 WeakPolarHBondContact O-CB 3.19Å; T15-A19 PolarHBondContact O-N 3.38Å; A19-S21 VanDerWaalsContact C-N 3.33Å; A19-S21 PolarHBondContact O-N 3.23Å; A19-W22 WeakPolarHBondContact O-CB 3.49Å; A19-W22 PolarHBondContact O-N 2.91Å; A19-F23 HydrophobicContact CB-CD2 4.04Å; A19-F23 HydrophobicContact CB-CE2 3.57Å; A19-F23 HydrophobicContact CB-CZ 4.35Å; A19-F23 WeakPolarHBondContact O-CD2 3.25Å; A19-F23 WeakPolarHBondContact O-CG 3.26Å; A19-F23 PolarHBondContact O-N 3.44Å
20S90.2Very high89.6Confident52 Ų5253.2 Ų53.236%0.36432%0.315SS..Hα-helixtrans-60.5-42.5179.6-54.60000111.9T16 Y18 L24T16-S20 WeakPolarHBondContact O-CB 3.32Å; T16-S20 PolarHBondContact O-OG 3.48Å; Y18-S20 VanDerWaalsContact C-N 3.34Å; Y18-S20 PolarHBondContact O-N 2.88Å; S20-L24 VanDerWaalsContact O-CB 3.25Å; S20-L24 WeakPolarHBondContact O-CB 3.39Å; S20-L24 VanDerWaalsContact O-CG 3.22Å; S20-L24 WeakPolarHBondContact O-CG 3.27Å; S20-L24 PolarHBondContact O-N 3.49Å
21S89.8Confident89.7Confident38 Ų3847.4 Ų47.427%0.26628%0.283SS..Hα-helixtrans-67.8-39.8177.159.60000111.3Y18 A19 F23 T25Y18-S21 PolarHBondContact O-OG 3.34Å; A19-S21 VanDerWaalsContact C-N 3.33Å; A19-S21 PolarHBondContact O-N 3.23Å; S21-F23 PolarHBondContact O-N 2.86Å; S21-T25 WeakPolarHBondContact O-CB 3.09Å; S21-T25 WeakPolarHBondContact O-CG2 3.2Å; S21-T25 PolarHBondContact O-N 2.85Å; S21-T25 PolarHBondContact O-OG1 3.4Å
22W93Very high89.7Confident1 Ų146.3 Ų46.30%0.00428%0.277CS..Hα-helixtrans-58.3-49.9177.8-63.7-2.9000111.9Y18 A19 M26 F27 A55 I58 L59 L78 L82Y18-W22 HydrophobicContact CD2-CD2 4.25Å; Y18-W22 HydrophobicContact CD2-CE3 4.04Å; Y18-W22 AromaticContact CD2-CH2 3.53Å; Y18-W22 HydrophobicContact CD2-CH2 3.53Å; Y18-W22 AromaticContact CD2-CZ2 3.74Å; Y18-W22 HydrophobicContact CD2-CZ2 3.74Å; Y18-W22 AromaticContact CD2-CZ3 3.69Å; Y18-W22 HydrophobicContact CD2-CZ3 3.69Å; Y18-W22 HydrophobicContact CE2-CE3 4.22Å; Y18-W22 AromaticContact CE2-CH2 3.72Å; Y18-W22 HydrophobicContact CE2-CH2 3.72Å; Y18-W22 HydrophobicContact CE2-CZ2 4.4Å; Y18-W22 AromaticContact CE2-CZ3 3.62Å; Y18-W22 HydrophobicContact CE2-CZ3 3.62Å; A19-W22 WeakPolarHBondContact O-CB 3.49Å; A19-W22 PolarHBondContact O-N 2.91Å; W22-M26 CarbonylContact O-C 3.47Å; W22-M26 WeakPolarHBondContact O-CA 3.42Å; W22-M26 PolarHBondContact O-N 3.39Å; W22-F27 HydrophobicContact CB-CD1 3.76Å; W22-F27 HydrophobicContact CB-CE1 3.58Å; W22-F27 HydrophobicContact CB-CZ 4.35Å; W22-F27 HydrophobicContact CD2-CD1 4.41Å; W22-F27 HydrophobicContact CD2-CE1 4.04Å; W22-F27 HydrophobicContact CE3-CE1 4.06Å; W22-F27 AromaticContact CG-CD1 3.95Å; W22-F27 HydrophobicContact CG-CD1 3.95Å; W22-F27 AromaticContact CG-CE1 3.88Å; W22-F27 HydrophobicContact CG-CE1 3.88Å; W22-F27 PolarHBondContact O-N 3.14Å; W22-A55 HydrophobicContact CE3-CB 4.01Å; W22-A55 HydrophobicContact CZ3-CB 4.23Å; W22-I58 HydrophobicContact CH2-CG2 3.95Å; W22-I58 HydrophobicContact CZ2-CG2 4.3Å; W22-L59 HydrophobicContact CH2-CD2 3.93Å; W22-L59 HydrophobicContact CH2-CG 4.18Å; W22-L59 HydrophobicContact CZ3-CD2 4.35Å; W22-L59 HydrophobicContact CZ3-CG 4.19Å; W22-L78 HydrophobicContact CH2-CD1 4.47Å; W22-L78 HydrophobicContact CH2-CD2 3.98Å; W22-L78 HydrophobicContact CZ2-CB 3.98Å; W22-L78 HydrophobicContact CZ2-CD1 4.41Å; W22-L78 HydrophobicContact CZ2-CD2 3.84Å; W22-L78 HydrophobicContact CZ2-CG 4.28Å; W22-L78 PolarHBondContact NE1-O 3.43Å; W22-L82 HydrophobicContact CZ2-CD2 4.3Å
23F91.9Very high89.7Confident73 Ų7349.5 Ų49.532%0.3229%0.285SS..Hα-helixtrans-74.1-43.5-177.7-60.5-49.8000112.8A19 S21 T25 M26 V51 F52 A55A19-F23 HydrophobicContact CB-CD2 4.04Å; A19-F23 HydrophobicContact CB-CE2 3.57Å; A19-F23 HydrophobicContact CB-CZ 4.35Å; A19-F23 WeakPolarHBondContact O-CD2 3.25Å; A19-F23 WeakPolarHBondContact O-CG 3.26Å; A19-F23 PolarHBondContact O-N 3.44Å; S21-F23 PolarHBondContact O-N 2.86Å; F23-T25 VanDerWaalsContact C-N 3.32Å; F23-T25 PolarHBondContact O-N 3.28Å; F23-M26 PolarHBondContact O-N 3.48Å; F23-V51 HydrophobicContact CD1-CG1 3.65Å; F23-V51 HydrophobicContact CE1-CG1 4.06Å; F23-F52 AromaticContact CE1-CD1 3.81Å; F23-F52 HydrophobicContact CE1-CD1 3.81Å; F23-F52 AromaticContact CE1-CE1 3.96Å; F23-F52 HydrophobicContact CE1-CE1 3.96Å; F23-F52 HydrophobicContact CE2-CE1 4.37Å; F23-F52 AromaticContact CZ-CD1 3.77Å; F23-F52 HydrophobicContact CZ-CD1 3.77Å; F23-F52 AromaticContact CZ-CE1 3.83Å; F23-F52 HydrophobicContact CZ-CE1 3.83Å; F23-A55 HydrophobicContact CE1-CB 4.04Å; F23-A55 HydrophobicContact CZ-CB 4.17Å
24L90.4Very high89.7Confident150 Ų15054.6 Ų54.679%0.78531%0.312SS*.Hα-helixtrans-67.2-33.9-179-72.2173.7000112.8S20S20-L24 VanDerWaalsContact O-CB 3.25Å; S20-L24 WeakPolarHBondContact O-CB 3.39Å; S20-L24 VanDerWaalsContact O-CG 3.22Å; S20-L24 WeakPolarHBondContact O-CG 3.27Å; S20-L24 PolarHBondContact O-N 3.49Å
25T91.2Very high89.7Confident45 Ų4549.9 Ų49.928%0.27629%0.287SS..THydrogen-bonded Turntrans-101.65.9-178.170.90000113.2S21 F23 F27 S28 S29S21-T25 WeakPolarHBondContact O-CB 3.09Å; S21-T25 WeakPolarHBondContact O-CG2 3.2Å; S21-T25 PolarHBondContact O-N 2.85Å; S21-T25 PolarHBondContact O-OG1 3.4Å; F23-T25 VanDerWaalsContact C-N 3.32Å; F23-T25 PolarHBondContact O-N 3.28Å; T25-F27 PolarHBondContact O-N 3.16Å; T25-S28 VanDerWaalsContact O-CB 3.28Å; T25-S28 WeakPolarHBondContact O-CB 3.41Å; T25-S28 PolarHBondContact O-N 2.79Å; T25-S28 PolarHBondContact O-OG 3.02Å; T25-S29 PolarHBondContact OG1-N 3.08Å; T25-S29 PolarHBondContact OG1-OG 3.16Å
26M90.6Very high89.8Confident31 Ų3145.9 Ų45.915%0.15326%0.263CS..THydrogen-bonded Turntrans48.743.6-174.5-67.1-68.7-65.900111.8W22 F23 S28 F43 V51W22-M26 CarbonylContact O-C 3.47Å; W22-M26 WeakPolarHBondContact O-CA 3.42Å; W22-M26 PolarHBondContact O-N 3.39Å; F23-M26 PolarHBondContact O-N 3.48Å; M26-S28 PolarHBondContact O-N 3.47Å; M26-F43 HydrophobicContact CE-CB 3.68Å; M26-F43 HydrophobicContact CE-CD1 3.68Å; M26-F43 HydrophobicContact CE-CD2 3.82Å; M26-F43 HydrophobicContact CE-CE1 4.25Å; M26-F43 HydrophobicContact CE-CE2 4.36Å; M26-F43 HydrophobicContact CE-CG 3.43Å; M26-F43 VanDerWaalsContact CE-CG 3.43Å; M26-V51 HydrophobicContact CE-CG2 3.58Å; M26-V51 HydrophobicContact SD-CG1 4.28Å; M26-V51 HydrophobicContact SD-CG2 3.91Å
27F90.9Very high89.8Confident0 Ų046.4 Ų46.40%026%0.258CS..THydrogen-bonded Turntrans61.62.5-175.3-51-85.7000117W22 T25 S29 T30 L31 T39 V51 I54 A55 I58W22-F27 HydrophobicContact CB-CD1 3.76Å; W22-F27 HydrophobicContact CB-CE1 3.58Å; W22-F27 HydrophobicContact CB-CZ 4.35Å; W22-F27 HydrophobicContact CD2-CD1 4.41Å; W22-F27 HydrophobicContact CD2-CE1 4.04Å; W22-F27 HydrophobicContact CE3-CE1 4.06Å; W22-F27 AromaticContact CG-CD1 3.95Å; W22-F27 HydrophobicContact CG-CD1 3.95Å; W22-F27 AromaticContact CG-CE1 3.88Å; W22-F27 HydrophobicContact CG-CE1 3.88Å; W22-F27 PolarHBondContact O-N 3.14Å; T25-F27 PolarHBondContact O-N 3.16Å; F27-S29 PolarHBondContact O-N 3.35Å; F27-S29 VanDerWaalsContact O-N 3.15Å; F27-T30 PolarHBondContact O-N 2.88Å; F27-L31 HydrophobicContact CB-CB 4.25Å; F27-L31 HydrophobicContact CB-CD1 3.59Å; F27-L31 HydrophobicContact CB-CG 3.95Å; F27-L31 HydrophobicContact CD1-CD1 4.03Å; F27-L31 HydrophobicContact CG-CD1 3.92Å; F27-L31 PolarHBondContact O-N 3.26Å; F27-T39 HydrophobicContact CD2-CG2 3.78Å; F27-T39 HydrophobicContact CE2-CG2 4.1Å; F27-V51 HydrophobicContact CE2-CG1 3.62Å; F27-V51 HydrophobicContact CZ-CG1 4.14Å; F27-V51 WeakPolarHBondContact CZ-O 3.33Å; F27-I54 HydrophobicContact CD2-CG2 4.32Å; F27-I54 HydrophobicContact CE1-CG2 4.31Å; F27-I54 HydrophobicContact CE2-CB 4.16Å; F27-I54 HydrophobicContact CE2-CG2 3.85Å; F27-I54 HydrophobicContact CZ-CB 4.21Å; F27-I54 HydrophobicContact CZ-CG2 3.85Å; F27-A55 HydrophobicContact CE1-CB 4.26Å; F27-A55 HydrophobicContact CZ-CB 3.94Å; F27-I58 HydrophobicContact CD1-CD1 3.8Å; F27-I58 HydrophobicContact CE1-CD1 3.57Å; F27-I58 HydrophobicContact CZ-CD1 4.41Å
28S89.9Confident89.8Confident65 Ų6547.7 Ų47.746%0.45526%0.258SS..THydrogen-bonded Turntrans-64.1-20.1-178.963.20000114.5T25 M26T25-S28 VanDerWaalsContact O-CB 3.28Å; T25-S28 WeakPolarHBondContact O-CB 3.41Å; T25-S28 PolarHBondContact O-N 2.79Å; T25-S28 PolarHBondContact O-OG 3.02Å; M26-S28 PolarHBondContact O-N 3.47Å
29S88.7Confident89.9Confident70 Ų7047.2 Ų47.249%0.4926%0.256SS..THydrogen-bonded Turntrans-87.9-21.9177.359.90000114.5T25 F27T25-S29 PolarHBondContact OG1-N 3.08Å; T25-S29 PolarHBondContact OG1-OG 3.16Å; F27-S29 PolarHBondContact O-N 3.35Å; F27-S29 VanDerWaalsContact O-N 3.15Å
30T86.7Confident89.9Confident7 Ų751.1 Ų51.14%0.04328%0.275CS..THydrogen-bonded Turntrans-119.4-22.4-170.354.60000114.1F27 A83F27-T30 PolarHBondContact O-N 2.88Å; T30-A83 PolarHBondContact O-N 3.09Å
31L89Confident90Very high8 Ų853.8 Ų53.84%0.04229%0.285CS..SBendtrans-108.4157.8176.9-66.7-179.6000111.4F27 I35 I58 L82 F86 L93F27-L31 HydrophobicContact CB-CB 4.25Å; F27-L31 HydrophobicContact CB-CD1 3.59Å; F27-L31 HydrophobicContact CB-CG 3.95Å; F27-L31 HydrophobicContact CD1-CD1 4.03Å; F27-L31 HydrophobicContact CG-CD1 3.92Å; F27-L31 PolarHBondContact O-N 3.26Å; L31-I35 HydrophobicContact CB-CB 4.37Å; L31-I35 HydrophobicContact CD1-CB 4.5Å; L31-I35 HydrophobicContact CD1-CG2 3.78Å; L31-I58 HydrophobicContact CD1-CD1 3.97Å; L31-I58 HydrophobicContact CD2-CD1 4.43Å; L31-L82 HydrophobicContact CD2-CD2 3.58Å; L31-L82 HydrophobicContact CD2-CG 3.87Å; L31-L82 HydrophobicContact CG-CD2 4.34Å; L31-F86 HydrophobicContact CD2-CD2 3.63Å; L31-F86 HydrophobicContact CD2-CE2 4.18Å; L31-F86 HydrophobicContact CD2-CG 4.34Å; L31-L93 HydrophobicContact CD1-CD2 4.23Å
32P89.2Confident90Very high19 Ų1952.9 Ų52.912%0.12328%0.278CS..  trans-54.8145.2170.2-23.135.4000111.4D34 I35 A36 A83P32-D34 PolarHBondContact O-N 2.93Å; P32-D34 VanDerWaalsContact O-N 3.16Å; P32-I35 HydrophobicContact CG-CD1 4.11Å; P32-I35 PolarHBondContact O-N 2.93Å; P32-A36 PolarHBondContact O-N 3.15Å; P32-A83 WeakPolarHBondContact CG-O 3.49Å
33L87.5Confident89.8Confident103 Ų10355.4 Ų55.454%0.53929%0.289SS..Hα-helixtrans-59.2-34.2-171.3-15873.1000112.6I35 A36 F37L33-I35 PolarHBondContact O-N 3.19Å; L33-A36 PolarHBondContact O-N 3.24Å; L33-F37 HydrophobicContact CD1-CE2 4.38Å; L33-F37 HydrophobicContact CD1-CZ 4.14Å; L33-F37 HydrophobicContact CD2-CD2 4.41Å; L33-F37 HydrophobicContact CD2-CE2 3.46Å; L33-F37 VanDerWaalsContact CD2-CE2 3.46Å; L33-F37 HydrophobicContact CD2-CZ 3.71Å; L33-F37 HydrophobicContact CG-CD2 4.02Å; L33-F37 HydrophobicContact CG-CE1 4.46Å; L33-F37 HydrophobicContact CG-CE2 3.46Å; L33-F37 VanDerWaalsContact CG-CE2 3.46Å; L33-F37 HydrophobicContact CG-CZ 3.71Å; L33-F37 WeakPolarHBondContact O-CD2 3.28Å; L33-F37 WeakPolarHBondContact O-CG 3.49Å; L33-F37 PolarHBondContact O-N 3.06Å
34D87.8Confident89.7Confident114 Ų11458.2 Ų58.261%0.6131%0.307SS*.Hα-helixtrans-63.2-39.7177.4-64.8-23.7000112.4P32 R38P32-D34 PolarHBondContact O-N 2.93Å; P32-D34 VanDerWaalsContact O-N 3.16Å; D34-R38 WeakPolarHBondContact O-CB 3.19Å; D34-R38 PolarHBondContact O-N 3.27Å; D34-R38 VanDerWaalsContact O-N 3.08Å
35I89.3Confident89.6Confident2 Ų255 Ų551%0.0130%0.297CS..Hα-helixtrans-71.2-41.8174.9-54.8177.2000110.3L31 P32 L33 F37 R38 T39 F86 H90 L93 F94L31-I35 HydrophobicContact CB-CB 4.37Å; L31-I35 HydrophobicContact CD1-CB 4.5Å; L31-I35 HydrophobicContact CD1-CG2 3.78Å; P32-I35 HydrophobicContact CG-CD1 4.11Å; P32-I35 PolarHBondContact O-N 2.93Å; L33-I35 PolarHBondContact O-N 3.19Å; I35-F37 VanDerWaalsContact C-N 3.34Å; I35-F37 PolarHBondContact O-N 2.63Å; I35-R38 PolarHBondContact O-N 2.93Å; I35-T39 VanDerWaalsContact O-CB 3.31Å; I35-T39 WeakPolarHBondContact O-CB 3.42Å; I35-T39 PolarHBondContact O-N 3.37Å; I35-T39 PolarHBondContact O-OG1 3.45Å; I35-F86 HydrophobicContact CD1-CB 3.51Å; I35-F86 HydrophobicContact CD1-CG 4.23Å; I35-H90 HydrophobicContact CD1-CB 4.47Å; I35-H90 WeakPolarHBondContact CD1-CD2 3.42Å; I35-H90 HydrophobicContact CG1-CB 4.16Å; I35-H90 WeakPolarHBondContact CG1-CD2 3.01Å; I35-L93 HydrophobicContact CG2-CD2 3.86Å; I35-F94 HydrophobicContact CG2-CE2 3.85Å; I35-F94 HydrophobicContact CG2-CZ 3.97Å
36A90.6Very high89.3Confident4 Ų459.1 Ų59.13%0.03331%0.313CS..Hα-helixtrans-61.6-42.9179.800000111.1P32 L33 T39 M40P32-A36 PolarHBondContact O-N 3.15Å; L33-A36 PolarHBondContact O-N 3.24Å; A36-T39 WeakPolarHBondContact O-CB 3.18Å; A36-T39 PolarHBondContact O-N 3.31Å; A36-M40 PolarHBondContact O-N 3.47Å
37F90.8Very high89.1Confident106 Ų10659 Ų5947%0.46532%0.32SS..Hα-helixtrans-65-45.9173.9-69.9-37.5000112.3L33 I35 T39 M40 D41L33-F37 HydrophobicContact CD1-CE2 4.38Å; L33-F37 HydrophobicContact CD1-CZ 4.14Å; L33-F37 HydrophobicContact CD2-CD2 4.41Å; L33-F37 HydrophobicContact CD2-CE2 3.46Å; L33-F37 VanDerWaalsContact CD2-CE2 3.46Å; L33-F37 HydrophobicContact CD2-CZ 3.71Å; L33-F37 HydrophobicContact CG-CD2 4.02Å; L33-F37 HydrophobicContact CG-CE1 4.46Å; L33-F37 HydrophobicContact CG-CE2 3.46Å; L33-F37 VanDerWaalsContact CG-CE2 3.46Å; L33-F37 HydrophobicContact CG-CZ 3.71Å; L33-F37 WeakPolarHBondContact O-CD2 3.28Å; L33-F37 WeakPolarHBondContact O-CG 3.49Å; L33-F37 PolarHBondContact O-N 3.06Å; I35-F37 VanDerWaalsContact C-N 3.34Å; I35-F37 PolarHBondContact O-N 2.63Å; F37-T39 PolarHBondContact O-N 2.93Å; F37-M40 CarbonylContact O-C 3.57Å; F37-M40 WeakPolarHBondContact O-CA 3.22Å; F37-M40 WeakPolarHBondContact O-CB 3.19Å; F37-M40 PolarHBondContact O-N 2.94Å; F37-D41 PolarHBondContact O-N 3.07Å
38R89.3Confident89Confident99 Ų9963.9 Ų63.937%0.37434%0.344SS..Hα-helixtrans-61.8-34.6175.7-172.6171.9176.8-162.44.6112.3D34 I35 M40 D41 V42 F94D34-R38 WeakPolarHBondContact O-CB 3.19Å; D34-R38 PolarHBondContact O-N 3.27Å; D34-R38 VanDerWaalsContact O-N 3.08Å; I35-R38 PolarHBondContact O-N 2.93Å; R38-M40 VanDerWaalsContact C-N 3.35Å; R38-D41 PolarHBondContact O-N 3.23Å; R38-V42 VanDerWaalsContact O-CG2 3.3Å; R38-V42 WeakPolarHBondContact O-CG2 3.39Å; R38-V42 PolarHBondContact O-N 3.14Å; R38-F94 HydrophobicContact CB-CE1 4.49Å; R38-F94 HydrophobicContact CB-CE2 4.09Å; R38-F94 HydrophobicContact CB-CZ 3.7Å; R38-F94 VanDerWaalsContact CD-CE2 3.49Å; R38-F94 HydrophobicContact CG-CE1 3.96Å; R38-F94 HydrophobicContact CG-CE2 3.86Å; R38-F94 HydrophobicContact CG-CZ 3.53Å; R38-F94 VanDerWaalsContact NH1-CD2 3.34Å
39T90.5Very high88.9Confident0 Ų066.8 Ų66.80%035%0.35CS..Hα-helixtrans-64.6-41.9173.5-590000110.9F27 I35 A36 F37 F43 I54F27-T39 HydrophobicContact CD2-CG2 3.78Å; F27-T39 HydrophobicContact CE2-CG2 4.1Å; I35-T39 VanDerWaalsContact O-CB 3.31Å; I35-T39 WeakPolarHBondContact O-CB 3.42Å; I35-T39 PolarHBondContact O-N 3.37Å; I35-T39 PolarHBondContact O-OG1 3.45Å; A36-T39 WeakPolarHBondContact O-CB 3.18Å; A36-T39 PolarHBondContact O-N 3.31Å; F37-T39 PolarHBondContact O-N 2.93Å; T39-F43 WeakPolarHBondContact O-CB 3.32Å; T39-F43 PolarHBondContact O-N 2.98Å; T39-I54 HydrophobicContact CG2-CD1 3.39Å
40M90.6Very high88.9Confident86 Ų8663.5 Ų63.542%0.42433%0.327SS..Hα-helixtrans-64.5-42.1175-168.8175.5-69.600111.8A36 F37 R38 V42 F43 L44A36-M40 PolarHBondContact O-N 3.47Å; F37-M40 CarbonylContact O-C 3.57Å; F37-M40 WeakPolarHBondContact O-CA 3.22Å; F37-M40 WeakPolarHBondContact O-CB 3.19Å; F37-M40 PolarHBondContact O-N 2.94Å; R38-M40 VanDerWaalsContact C-N 3.35Å; M40-V42 PolarHBondContact O-N 3.01Å; M40-F43 WeakPolarHBondContact O-CB 3.42Å; M40-F43 PolarHBondContact O-N 3.45Å; M40-L44 WeakPolarHBondContact O-CG 3.43Å; M40-L44 PolarHBondContact O-N 3.18Å
41D91.4Very high89.1Confident109 Ų10963.2 Ų63.258%0.58333%0.325SS*.Hα-helixtrans-59.9-47.9176.8-68.2-24.1000111.4F37 R38 F43 L44 S45F37-D41 PolarHBondContact O-N 3.07Å; R38-D41 PolarHBondContact O-N 3.23Å; D41-F43 VanDerWaalsContact C-N 3.35Å; D41-L44 PolarHBondContact O-N 3.28Å; D41-S45 PolarHBondContact O-N 3.5Å
42V89.7Confident89.2Confident18 Ų1868 Ų6811%0.10935%0.346CS..Hα-helixtrans-70-33.7178.1-175.60000111.3R38 M40 L44 S45 E46 I50 F98R38-V42 VanDerWaalsContact O-CG2 3.3Å; R38-V42 WeakPolarHBondContact O-CG2 3.39Å; R38-V42 PolarHBondContact O-N 3.14Å; M40-V42 PolarHBondContact O-N 3.01Å; V42-L44 VanDerWaalsContact C-N 3.31Å; V42-L44 PolarHBondContact O-N 3.42Å; V42-S45 WeakPolarHBondContact CA-OG 3.45Å; V42-S45 PolarHBondContact O-N 3.02Å; V42-S45 PolarHBondContact O-OG 3.49Å; V42-E46 HydrophobicContact CG1-CB 4.45Å; V42-E46 HydrophobicContact CG1-CG 4Å; V42-E46 PolarHBondContact O-N 2.91Å; V42-I50 HydrophobicContact CB-CG1 4.21Å; V42-I50 HydrophobicContact CG1-CB 4.15Å; V42-I50 HydrophobicContact CG1-CD1 3.77Å; V42-I50 HydrophobicContact CG1-CG1 3.52Å; V42-I50 HydrophobicContact CG1-CG2 4.31Å; V42-F98 HydrophobicContact CG1-CE1 4.13Å; V42-F98 HydrophobicContact CG1-CZ 3.78Å; V42-F98 HydrophobicContact CG2-CZ 4.1Å
43F90.7Very high89.2Confident55 Ų5569.6 Ų69.624%0.24135%0.35CS..Hα-helixtrans-62.2-39.8174165-103000111.8M26 T39 M40 D41 S45 G47 M48 I50 V51M26-F43 HydrophobicContact CE-CB 3.68Å; M26-F43 HydrophobicContact CE-CD1 3.68Å; M26-F43 HydrophobicContact CE-CD2 3.82Å; M26-F43 HydrophobicContact CE-CE1 4.25Å; M26-F43 HydrophobicContact CE-CE2 4.36Å; M26-F43 HydrophobicContact CE-CG 3.43Å; M26-F43 VanDerWaalsContact CE-CG 3.43Å; T39-F43 WeakPolarHBondContact O-CB 3.32Å; T39-F43 PolarHBondContact O-N 2.98Å; M40-F43 WeakPolarHBondContact O-CB 3.42Å; M40-F43 PolarHBondContact O-N 3.45Å; D41-F43 VanDerWaalsContact C-N 3.35Å; F43-S45 VanDerWaalsContact C-N 3.29Å; F43-S45 PolarHBondContact O-N 2.75Å; F43-G47 WeakPolarHBondContact CD2-O 3.45Å; F43-G47 WeakPolarHBondContact O-CA 3.24Å; F43-G47 PolarHBondContact O-N 2.81Å; F43-M48 HydrophobicContact CE2-CB 4.24Å; F43-M48 HydrophobicContact CE2-CE 4.14Å; F43-M48 HydrophobicContact CE2-SD 3.98Å; F43-I50 HydrophobicContact CB-CG2 3.9Å; F43-V51 HydrophobicContact CB-CG2 4.46Å; F43-V51 HydrophobicContact CD2-CG2 3.65Å; F43-V51 HydrophobicContact CE2-CG2 4.29Å; F43-V51 HydrophobicContact CG-CG2 4.34Å
44L89.6Confident89.4Confident131 Ų13164.7 Ų64.769%0.68632%0.324SS*.Hα-helixtrans-67.6-29.3175.5-69.7173.3000112.5M40 D41 V42M40-L44 WeakPolarHBondContact O-CG 3.43Å; M40-L44 PolarHBondContact O-N 3.18Å; D41-L44 PolarHBondContact O-N 3.28Å; V42-L44 VanDerWaalsContact C-N 3.31Å; V42-L44 PolarHBondContact O-N 3.42Å
45S87.5Confident89.6Confident84 Ų8459.6 Ų59.659%0.58730%0.297SS*.Hα-helixtrans-85.4-42.4179.164.70000114.2D41 V42 F43D41-S45 PolarHBondContact O-N 3.5Å; V42-S45 WeakPolarHBondContact CA-OG 3.45Å; V42-S45 PolarHBondContact O-N 3.02Å; V42-S45 PolarHBondContact O-OG 3.49Å; F43-S45 VanDerWaalsContact C-N 3.29Å; F43-S45 PolarHBondContact O-N 2.75Å
46E84.7Confident89.6Confident131 Ų13164.6 Ų64.661%0.61232%0.324SS*.Hα-helixtrans-108.3-12.8-171-60.7-69.116200113.3V42V42-E46 HydrophobicContact CG1-CB 4.45Å; V42-E46 HydrophobicContact CG1-CG 4Å; V42-E46 PolarHBondContact O-N 2.91Å
47G87.7Confident89.6Confident28 Ų2864.5 Ų64.529%0.28932%0.323SS..  trans85.8-166.2-178.600000114.7F43 E49 I50F43-G47 WeakPolarHBondContact CD2-O 3.45Å; F43-G47 WeakPolarHBondContact O-CA 3.24Å; F43-G47 PolarHBondContact O-N 2.81Å; G47-E49 VanDerWaalsContact C-N 3.27Å; G47-E49 PolarHBondContact O-N 3.39Å; G47-I50 WeakPolarHBondContact O-CG2 3.41Å; G47-I50 PolarHBondContact O-N 3.45Å
48M88.3Confident89.6Confident103 Ų10359.5 Ų59.551%0.50730%0.301SS..THydrogen-bonded Turntrans-64.3-25.2-169.6-172.363.983.300114.2F43 I50 V51 F52F43-M48 HydrophobicContact CE2-CB 4.24Å; F43-M48 HydrophobicContact CE2-CE 4.14Å; F43-M48 HydrophobicContact CE2-SD 3.98Å; M48-I50 PolarHBondContact O-N 3.34Å; M48-I50 VanDerWaalsContact O-N 3.16Å; M48-V51 WeakPolarHBondContact O-CB 3.46Å; M48-V51 PolarHBondContact O-N 2.79Å; M48-V51 HydrophobicContact SD-CB 4.14Å; M48-V51 HydrophobicContact SD-CG2 3.9Å; M48-F52 HydrophobicContact CG-CD2 4.21Å; M48-F52 HydrophobicContact CG-CE2 3.66Å; M48-F52 WeakPolarHBondContact O-CD2 3.39Å
49E87.6Confident89.6Confident125 Ų12555.6 Ų55.658%0.58429%0.288SS*.Hα-helixtrans-56.3-34.5-179-70.1-168.2-165.900113.1G47 V51 F52 R53G47-E49 VanDerWaalsContact C-N 3.27Å; G47-E49 PolarHBondContact O-N 3.39Å; E49-V51 VanDerWaalsContact C-N 3.26Å; E49-V51 PolarHBondContact O-N 2.93Å; E49-F52 PolarHBondContact O-N 3.32Å; E49-R53 WeakPolarHBondContact O-CG 3.27Å; E49-R53 PolarHBondContact O-N 3.4Å; E49-R53 IonicContact OE2-CZ 2.81Å; E49-R53 IonicContact OE2-NE 2.73Å; E49-R53 IonicContact OE2-NH2 3.42Å; E49-R53 PolarHBondContact OE2-NH2 3.29Å; E49-R53 VanDerWaalsContact OE2-NH2 3.1Å
50I88.7Confident89.5Confident2 Ų260.9 Ų60.91%0.0131%0.312CS..Hα-helixtrans-64.5-33.8-179.5-164.571.9000112V42 F43 G47 M48 F52 R53 I54 F98 I101V42-I50 HydrophobicContact CB-CG1 4.21Å; V42-I50 HydrophobicContact CG1-CB 4.15Å; V42-I50 HydrophobicContact CG1-CD1 3.77Å; V42-I50 HydrophobicContact CG1-CG1 3.52Å; V42-I50 HydrophobicContact CG1-CG2 4.31Å; F43-I50 HydrophobicContact CB-CG2 3.9Å; G47-I50 WeakPolarHBondContact O-CG2 3.41Å; G47-I50 PolarHBondContact O-N 3.45Å; M48-I50 PolarHBondContact O-N 3.34Å; M48-I50 VanDerWaalsContact O-N 3.16Å; I50-F52 VanDerWaalsContact C-N 3.33Å; I50-F52 PolarHBondContact O-N 2.94Å; I50-R53 PolarHBondContact O-N 3.11Å; I50-R53 VanDerWaalsContact O-N 3.16Å; I50-I54 HydrophobicContact CG1-CD1 3.75Å; I50-I54 HydrophobicContact CG1-CG1 4.16Å; I50-I54 WeakPolarHBondContact O-CB 3.35Å; I50-I54 VanDerWaalsContact O-CG1 3.32Å; I50-I54 WeakPolarHBondContact O-CG1 3.35Å; I50-I54 PolarHBondContact O-N 3.22Å; I50-F98 HydrophobicContact CD1-CE1 3.95Å; I50-F98 HydrophobicContact CD1-CZ 4.25Å; I50-I101 HydrophobicContact CD1-CD1 4.49Å
51V91.5Very high89.5Confident1 Ų159.9 Ų59.91%0.00631%0.308CS..Hα-helixtrans-63.5-44.6-178.5-173.70000109.7F23 M26 F27 F43 M48 E49 I54 A55F23-V51 HydrophobicContact CD1-CG1 3.65Å; F23-V51 HydrophobicContact CE1-CG1 4.06Å; M26-V51 HydrophobicContact CE-CG2 3.58Å; M26-V51 HydrophobicContact SD-CG1 4.28Å; M26-V51 HydrophobicContact SD-CG2 3.91Å; F27-V51 HydrophobicContact CE2-CG1 3.62Å; F27-V51 HydrophobicContact CZ-CG1 4.14Å; F27-V51 WeakPolarHBondContact CZ-O 3.33Å; F43-V51 HydrophobicContact CB-CG2 4.46Å; F43-V51 HydrophobicContact CD2-CG2 3.65Å; F43-V51 HydrophobicContact CE2-CG2 4.29Å; F43-V51 HydrophobicContact CG-CG2 4.34Å; M48-V51 WeakPolarHBondContact O-CB 3.46Å; M48-V51 PolarHBondContact O-N 2.79Å; M48-V51 HydrophobicContact SD-CB 4.14Å; M48-V51 HydrophobicContact SD-CG2 3.9Å; E49-V51 VanDerWaalsContact C-N 3.26Å; E49-V51 PolarHBondContact O-N 2.93Å; V51-I54 PolarHBondContact O-N 2.78Å; V51-A55 WeakPolarHBondContact O-CB 3.42Å; V51-A55 PolarHBondContact O-N 3.03Å
52F91.2Very high89.3Confident107 Ų10754.9 Ų54.947%0.46928%0.282SS..Hα-helixtrans-64.7-40.6174.3-66.7-72.2000112.2F23 M48 E49 I50 A55 L56F23-F52 AromaticContact CE1-CD1 3.81Å; F23-F52 HydrophobicContact CE1-CD1 3.81Å; F23-F52 AromaticContact CE1-CE1 3.96Å; F23-F52 HydrophobicContact CE1-CE1 3.96Å; F23-F52 HydrophobicContact CE2-CE1 4.37Å; F23-F52 AromaticContact CZ-CD1 3.77Å; F23-F52 HydrophobicContact CZ-CD1 3.77Å; F23-F52 AromaticContact CZ-CE1 3.83Å; F23-F52 HydrophobicContact CZ-CE1 3.83Å; M48-F52 HydrophobicContact CG-CD2 4.21Å; M48-F52 HydrophobicContact CG-CE2 3.66Å; M48-F52 WeakPolarHBondContact O-CD2 3.39Å; E49-F52 PolarHBondContact O-N 3.32Å; I50-F52 VanDerWaalsContact C-N 3.33Å; I50-F52 PolarHBondContact O-N 2.94Å; F52-A55 PolarHBondContact O-N 3.48Å; F52-L56 WeakPolarHBondContact O-CG 3.31Å; F52-L56 PolarHBondContact O-N 3.01Å
53R89Confident89.2Confident54 Ų5457.2 Ų57.220%0.20429%0.288CS..Hα-helixtrans-65.1-40.6178.5-68.9175.3-167.9-81.90.6111.8E49 I50 L56 A57 E104E49-R53 WeakPolarHBondContact O-CG 3.27Å; E49-R53 PolarHBondContact O-N 3.4Å; E49-R53 IonicContact OE2-CZ 2.81Å; E49-R53 IonicContact OE2-NE 2.73Å; E49-R53 IonicContact OE2-NH2 3.42Å; E49-R53 PolarHBondContact OE2-NH2 3.29Å; E49-R53 VanDerWaalsContact OE2-NH2 3.1Å; I50-R53 PolarHBondContact O-N 3.11Å; I50-R53 VanDerWaalsContact O-N 3.16Å; R53-L56 PolarHBondContact O-N 3.04Å; R53-A57 VanDerWaalsContact O-CB 3.29Å; R53-A57 WeakPolarHBondContact O-CB 3.29Å; R53-A57 PolarHBondContact O-N 2.94Å; R53-E104 IonicContact CZ-OE2 3.66Å; R53-E104 IonicContact NH1-OE2 3.65Å; R53-E104 PolarHBondContact NH1-OE2 3.42Å; R53-E104 IonicContact NH2-OE2 3.88Å; R53-E104 PolarHBondContact NH2-OE2 3.33Å; R53-E104 VanDerWaalsContact NH2-OE2 3.08Å
54I90.8Very high89Confident0 Ų060.1 Ų60.10%031%0.311CS..Hα-helixtrans-65-45.4174.5-69.7166.9000110.1F27 T39 I50 V51 L56 A57 I58 L93 F94 A97F27-I54 HydrophobicContact CD2-CG2 4.32Å; F27-I54 HydrophobicContact CE1-CG2 4.31Å; F27-I54 HydrophobicContact CE2-CB 4.16Å; F27-I54 HydrophobicContact CE2-CG2 3.85Å; F27-I54 HydrophobicContact CZ-CB 4.21Å; F27-I54 HydrophobicContact CZ-CG2 3.85Å; T39-I54 HydrophobicContact CG2-CD1 3.39Å; I50-I54 HydrophobicContact CG1-CD1 3.75Å; I50-I54 HydrophobicContact CG1-CG1 4.16Å; I50-I54 WeakPolarHBondContact O-CB 3.35Å; I50-I54 VanDerWaalsContact O-CG1 3.32Å; I50-I54 WeakPolarHBondContact O-CG1 3.35Å; I50-I54 PolarHBondContact O-N 3.22Å; V51-I54 PolarHBondContact O-N 2.78Å; I54-L56 VanDerWaalsContact C-N 3.29Å; I54-L56 PolarHBondContact O-N 3.31Å; I54-A57 PolarHBondContact O-N 2.84Å; I54-A57 VanDerWaalsContact O-N 3.12Å; I54-I58 HydrophobicContact CG2-CD1 4.02Å; I54-I58 HydrophobicContact CG2-CG1 4.41Å; I54-I58 VanDerWaalsContact O-CG1 3.29Å; I54-I58 WeakPolarHBondContact O-CG1 3.33Å; I54-I58 PolarHBondContact O-N 2.92Å; I54-L93 HydrophobicContact CG2-CD2 4.2Å; I54-F94 HydrophobicContact CD1-CE1 3.98Å; I54-A97 HydrophobicContact CG1-CB 4.27Å
55A91.5Very high88.9Confident6 Ų656.9 Ų56.95%0.0529%0.294CS..Hα-helixtrans-56.2-43.6175.100000112.2W22 F23 F27 V51 F52 L59W22-A55 HydrophobicContact CE3-CB 4.01Å; W22-A55 HydrophobicContact CZ3-CB 4.23Å; F23-A55 HydrophobicContact CE1-CB 4.04Å; F23-A55 HydrophobicContact CZ-CB 4.17Å; F27-A55 HydrophobicContact CE1-CB 4.26Å; F27-A55 HydrophobicContact CZ-CB 3.94Å; V51-A55 WeakPolarHBondContact O-CB 3.42Å; V51-A55 PolarHBondContact O-N 3.03Å; F52-A55 PolarHBondContact O-N 3.48Å; A55-L59 WeakPolarHBondContact O-CG 3.17Å; A55-L59 PolarHBondContact O-N 2.87Å
56L90.1Very high88.9Confident108 Ų10852.9 Ų52.957%0.56527%0.266SS*.Hα-helixtrans-68.9-38.4176.5-70.8175.1000112.5F52 R53 I54 L59 Q60F52-L56 WeakPolarHBondContact O-CG 3.31Å; F52-L56 PolarHBondContact O-N 3.01Å; R53-L56 PolarHBondContact O-N 3.04Å; I54-L56 VanDerWaalsContact C-N 3.29Å; I54-L56 PolarHBondContact O-N 3.31Å; L56-L59 PolarHBondContact O-N 3.46Å; L56-Q60 WeakPolarHBondContact O-CB 3.44Å; L56-Q60 PolarHBondContact O-N 2.73Å
57A90Very high89.1Confident2 Ų250.4 Ų50.42%0.01725%0.253CS..Hα-helixtrans-64.8-39.7177.100000111.6R53 I54 Q60 L61 L93 V96 A97R53-A57 VanDerWaalsContact O-CB 3.29Å; R53-A57 WeakPolarHBondContact O-CB 3.29Å; R53-A57 PolarHBondContact O-N 2.94Å; I54-A57 PolarHBondContact O-N 2.84Å; I54-A57 VanDerWaalsContact O-N 3.12Å; A57-Q60 PolarHBondContact O-N 3.25Å; A57-L61 WeakPolarHBondContact O-CB 3.43Å; A57-L61 WeakPolarHBondContact O-CG 3.43Å; A57-L61 PolarHBondContact O-N 3.25Å; A57-L93 HydrophobicContact CB-CD1 3.73Å; A57-V96 HydrophobicContact CB-CB 4.31Å; A57-V96 HydrophobicContact CB-CG1 3.99Å; A57-A97 HydrophobicContact CB-CB 3.96Å
58I90.4Very high89Confident0 Ų053.7 Ų53.70%027%0.272CS..Hα-helixtrans-56.9-53.7171.6-69.2166.5000110W22 F27 L31 I54 Q60 L61 C62 L82 F86 L93W22-I58 HydrophobicContact CH2-CG2 3.95Å; W22-I58 HydrophobicContact CZ2-CG2 4.3Å; F27-I58 HydrophobicContact CD1-CD1 3.8Å; F27-I58 HydrophobicContact CE1-CD1 3.57Å; F27-I58 HydrophobicContact CZ-CD1 4.41Å; L31-I58 HydrophobicContact CD1-CD1 3.97Å; L31-I58 HydrophobicContact CD2-CD1 4.43Å; I54-I58 HydrophobicContact CG2-CD1 4.02Å; I54-I58 HydrophobicContact CG2-CG1 4.41Å; I54-I58 VanDerWaalsContact O-CG1 3.29Å; I54-I58 WeakPolarHBondContact O-CG1 3.33Å; I54-I58 PolarHBondContact O-N 2.92Å; I58-Q60 PolarHBondContact O-N 3.4Å; I58-L61 PolarHBondContact O-N 3.12Å; I58-C62 WeakPolarHBondContact O-CB 3.44Å; I58-C62 PolarHBondContact O-N 2.88Å; I58-C62 PolarHBondContact O-SG 3.26Å; I58-C62 VanDerWaalsContact O-SG 3.4Å; I58-L82 HydrophobicContact CD1-CD2 4.37Å; I58-L82 HydrophobicContact CG2-CD1 3.76Å; I58-L82 HydrophobicContact CG2-CD2 3.92Å; I58-L82 HydrophobicContact CG2-CG 4.38Å; I58-F86 HydrophobicContact CG1-CE2 4.35Å; I58-F86 HydrophobicContact CG1-CZ 4.33Å; I58-F86 HydrophobicContact CG2-CE2 4.3Å; I58-L93 HydrophobicContact CG1-CD1 3.65Å; I58-L93 HydrophobicContact CG1-CD2 4.26Å
59L90.4Very high89.1Confident18 Ų1851 Ų519%0.09426%0.26CS..Hα-helixtrans-61.6-32.4179.5-69.3174.2000112.6M1 L4 F8 Y18 W22 A55 L56 R63 L66 L78M1-L59 HydrophobicContact CE-CB 4.15Å; M1-L59 WeakPolarHBondContact CE-O 3.36Å; L4-L59 HydrophobicContact CD2-CB 4.13Å; L4-L59 HydrophobicContact CD2-CD2 4.46Å; F8-L59 HydrophobicContact CE2-CD2 4.12Å; F8-L59 HydrophobicContact CZ-CD2 4.25Å; Y18-L59 HydrophobicContact CE2-CD1 4.36Å; Y18-L59 HydrophobicContact CE2-CD2 4.16Å; W22-L59 HydrophobicContact CH2-CD2 3.93Å; W22-L59 HydrophobicContact CH2-CG 4.18Å; W22-L59 HydrophobicContact CZ3-CD2 4.35Å; W22-L59 HydrophobicContact CZ3-CG 4.19Å; A55-L59 WeakPolarHBondContact O-CG 3.17Å; A55-L59 PolarHBondContact O-N 2.87Å; L56-L59 PolarHBondContact O-N 3.46Å; L59-R63 WeakPolarHBondContact O-CA 3.35Å; L59-R63 WeakPolarHBondContact O-CB 3.25Å; L59-R63 PolarHBondContact O-N 3.46Å; L59-R63 VanDerWaalsContact O-N 3.14Å; L59-L66 HydrophobicContact CD2-CD1 4.14Å; L59-L78 HydrophobicContact CD2-CD1 4.46Å; L59-L78 HydrophobicContact CD2-CD2 4.36Å
60Q88.7Confident89.1Confident110 Ų11050 Ų5051%0.51426%0.258SS..Hα-helixtrans-71.8-41.7178.2-176.5172.7-15.200112.2M1 L56 A57 I58 R63M1-Q60 HydrophobicContact CE-CB 4.07Å; M1-Q60 HydrophobicContact SD-CB 4.38Å; M1-Q60 HydrophobicContact SD-CG 4.39Å; L56-Q60 WeakPolarHBondContact O-CB 3.44Å; L56-Q60 PolarHBondContact O-N 2.73Å; A57-Q60 PolarHBondContact O-N 3.25Å; I58-Q60 PolarHBondContact O-N 3.4Å; Q60-R63 VanDerWaalsContact O-CB 3.27Å; Q60-R63 WeakPolarHBondContact O-CB 3.47Å
61L88.9Confident89Confident65 Ų6553.5 Ų53.534%0.3428%0.275SS..Hα-helixtrans-70.8-43.8177.9-73.2172.8000111.5A57 I58 R63 F86 L93 V96A57-L61 WeakPolarHBondContact O-CB 3.43Å; A57-L61 WeakPolarHBondContact O-CG 3.43Å; A57-L61 PolarHBondContact O-N 3.25Å; I58-L61 PolarHBondContact O-N 3.12Å; L61-R63 PolarHBondContact O-N 3.32Å; L61-F86 HydrophobicContact CB-CZ 4.42Å; L61-F86 HydrophobicContact CD1-CE1 3.74Å; L61-F86 HydrophobicContact CD1-CZ 4.18Å; L61-L93 HydrophobicContact CD1-CB 4.27Å; L61-L93 HydrophobicContact CD1-CD1 4.1Å; L61-V96 HydrophobicContact CD2-CG2 4.01Å; L61-V96 HydrophobicContact CG-CG2 4.39Å
62C88.3Confident88.8Confident4 Ų460.8 Ų60.83%0.02731%0.309CS..THydrogen-bonded Turntrans-78.10.1178.4-63.10000113.6I58 V64 D65 L66 Y77I58-C62 WeakPolarHBondContact O-CB 3.44Å; I58-C62 PolarHBondContact O-N 2.88Å; I58-C62 PolarHBondContact O-SG 3.26Å; I58-C62 VanDerWaalsContact O-SG 3.4Å; C62-V64 VanDerWaalsContact C-N 3.27Å; C62-V64 PolarHBondContact O-N 3.49Å; C62-D65 PolarHBondContact O-N 3.22Å; C62-L66 HydrophobicContact CB-CD1 3.74Å; C62-L66 HydrophobicContact CB-CG 4.1Å; C62-L66 WeakPolarHBondContact O-CB 3.05Å; C62-L66 WeakPolarHBondContact O-CD1 3.48Å; C62-L66 WeakPolarHBondContact O-CG 3.46Å; C62-L66 PolarHBondContact O-N 3.2Å; C62-Y77 HydrophobicContact CB-CE1 3.87Å
63R87.6Confident88.6Confident67 Ų6755.9 Ų55.925%0.25329%0.289SS..Hα-helixtrans-53-44.2-171.1179.7178.7167.4122.90.1112.4M1 D3 L59 Q60 L61 L66 F67M1-R63 PolarHBondContact SD-NH1 3.18Å; M1-R63 VanDerWaalsContact SD-NH1 3.36Å; D3-R63 IonicContact OD2-CZ 2.7Å; D3-R63 IonicContact OD2-NH1 3.61Å; D3-R63 IonicContact OD2-NH2 2.99Å; D3-R63 PolarHBondContact OD2-NH2 3.01Å; L59-R63 WeakPolarHBondContact O-CA 3.35Å; L59-R63 WeakPolarHBondContact O-CB 3.25Å; L59-R63 PolarHBondContact O-N 3.46Å; L59-R63 VanDerWaalsContact O-N 3.14Å; Q60-R63 VanDerWaalsContact O-CB 3.27Å; Q60-R63 WeakPolarHBondContact O-CB 3.47Å; L61-R63 PolarHBondContact O-N 3.32Å; R63-L66 PolarHBondContact O-N 3.06Å; R63-F67 HydrophobicContact CG-CD2 3.89Å; R63-F67 HydrophobicContact CG-CE2 3.67Å; R63-F67 WeakPolarHBondContact O-CD2 3.22Å; R63-F67 PolarHBondContact O-N 2.79Å
64V86.2Confident88.7Confident117 Ų11753.3 Ų53.371%0.70928%0.279SS*.Hα-helixtrans-65.3-45.3-174.7-178.70000111C62C62-V64 VanDerWaalsContact C-N 3.27Å; C62-V64 PolarHBondContact O-N 3.49Å
65D87.9Confident88.5Confident62 Ų6255 Ų5533%0.33229%0.288SS..Hα-helixtrans-67.8-42.8179.7-52-42.4000110.8C62 F67 S68 Y77C62-D65 PolarHBondContact O-N 3.22Å; D65-F67 VanDerWaalsContact C-N 3.26Å; D65-F67 PolarHBondContact O-N 3.41Å; D65-S68 PolarHBondContact O-N 3.43Å; D65-S68 PolarHBondContact O-OG 2.86Å; D65-Y77 HydrophobicContact CB-CE1 4.18Å; D65-Y77 HydrophobicContact CB-CE2 4.33Å; D65-Y77 PolarHBondContact OD2-OH 2.62Å
66L88.4Confident88.4Confident0 Ų062 Ų620%031%0.313CS..Hα-helixtrans-59.8-32.2-178.5-72168.4000113.5L4 H7 F8 L59 C62 R63 S68 I74 Y77 L78L4-L66 HydrophobicContact CD1-CB 4.06Å; L4-L66 HydrophobicContact CD1-CD1 4.49Å; L4-L66 HydrophobicContact CD2-CD1 4.3Å; H7-L66 PolarHBondContact NE2-O 3Å; F8-L66 HydrophobicContact CE1-CB 4.41Å; F8-L66 HydrophobicContact CE1-CD2 4.48Å; F8-L66 HydrophobicContact CZ-CD1 4.11Å; F8-L66 HydrophobicContact CZ-CD2 4.31Å; L59-L66 HydrophobicContact CD2-CD1 4.14Å; C62-L66 HydrophobicContact CB-CD1 3.74Å; C62-L66 HydrophobicContact CB-CG 4.1Å; C62-L66 WeakPolarHBondContact O-CB 3.05Å; C62-L66 WeakPolarHBondContact O-CD1 3.48Å; C62-L66 WeakPolarHBondContact O-CG 3.46Å; C62-L66 PolarHBondContact O-N 3.2Å; R63-L66 PolarHBondContact O-N 3.06Å; L66-S68 PolarHBondContact O-N 3.01Å; L66-I74 HydrophobicContact CD2-CB 4.37Å; L66-I74 HydrophobicContact CD2-CG1 4.2Å; L66-I74 HydrophobicContact CD2-CG2 3.8Å; L66-Y77 HydrophobicContact CD2-CD1 4.05Å; L66-L78 HydrophobicContact CD1-CD2 4.26Å; L66-L78 HydrophobicContact CD2-CD1 4.26Å; L66-L78 HydrophobicContact CD2-CD2 3.91Å; L66-L78 HydrophobicContact CD2-CG 3.98Å
67F88.2Confident88.3Confident79 Ų7957.8 Ų57.835%0.34629%0.29SS..THydrogen-bonded Turntrans-69.3-21.1177.4-92.8-70.7000113.9D3 L4 H7 R63 D65D3-F67 HydrophobicContact CB-CZ 3.98Å; L4-F67 HydrophobicContact CB-CE2 4.38Å; L4-F67 HydrophobicContact CB-CZ 4.36Å; L4-F67 HydrophobicContact CD1-CD2 4.28Å; L4-F67 HydrophobicContact CD1-CE2 3.98Å; L4-F67 HydrophobicContact CD1-CZ 4.31Å; H7-F67 HydrophobicContact CB-CD1 4.09Å; H7-F67 HydrophobicContact CB-CE1 3.65Å; H7-F67 HydrophobicContact CB-CZ 4.41Å; H7-F67 AromaticContact CG-CD1 3.86Å; H7-F67 AromaticContact CG-CE1 3.97Å; R63-F67 HydrophobicContact CG-CD2 3.89Å; R63-F67 HydrophobicContact CG-CE2 3.67Å; R63-F67 WeakPolarHBondContact O-CD2 3.22Å; R63-F67 PolarHBondContact O-N 2.79Å; D65-F67 VanDerWaalsContact C-N 3.26Å; D65-F67 PolarHBondContact O-N 3.41Å
68S85.8Confident88.3Confident98 Ų9857.7 Ų57.769%0.68529%0.289SS*.THydrogen-bonded Turntrans-94.2-7.3-176.770.80000113.9D65 L66D65-S68 PolarHBondContact O-N 3.43Å; D65-S68 PolarHBondContact O-OG 2.86Å; L66-S68 PolarHBondContact O-N 3.01Å
69L88.9Confident88.1Confident47 Ų4761 Ų6125%0.24631%0.305CS..  trans-100.2154.4-173.6-67.4170.4000111.6I74 Y77L69-I74 HydrophobicContact CB-CG1 3.69Å; L69-Y77 HydrophobicContact CD1-CD2 4.13Å; L69-Y77 HydrophobicContact CD1-CG 3.91Å
70D87.8Confident87.8Confident103 Ų10366.5 Ų66.555%0.55133%0.329SS*.  trans-87.7-176.1170.763.6-5.9000111.4E72 G73 I74D70-E72 PolarHBondContact O-N 3.47Å; D70-G73 PolarHBondContact O-N 2.93Å; D70-G73 VanDerWaalsContact OD1-CA 3.32Å; D70-G73 WeakPolarHBondContact OD1-CA 3.18Å; D70-G73 PolarHBondContact OD1-N 3.44Å; D70-I74 WeakPolarHBondContact O-CB 3.45Å; D70-I74 VanDerWaalsContact O-CG1 3.27Å; D70-I74 WeakPolarHBondContact O-CG1 3.34Å; D70-I74 PolarHBondContact O-N 2.82Å
71M86.2Confident87.7Confident76 Ų7663.7 Ų63.737%0.37432%0.318SS..Hα-helixtrans-56-50.6-175.4-166.6-157.4-150.800112.8V11 G12 I13 M17 L75V11-M71 HydrophobicContact CG1-CB 3.54Å; V11-M71 HydrophobicContact CG1-CG 4.09Å; G12-M71 VanDerWaalsContact O-CE 3.24Å; G12-M71 WeakPolarHBondContact O-CE 3.47Å; I13-M71 HydrophobicContact CD1-CG 4.36Å; I13-M71 HydrophobicContact CG1-CG 3.79Å; M17-M71 HydrophobicContact SD-CE 4.48Å; M71-L75 PolarHBondContact O-N 3.26Å
72E87.3Confident87.5Confident154 Ų15460.6 Ų60.672%0.7230%0.302SS*.Hα-helixtrans-69.3-39.6-180-67.8-177.8-176.800111.2D70 L75 R76D70-E72 PolarHBondContact O-N 3.47Å; E72-L75 PolarHBondContact O-N 3.32Å; E72-R76 WeakPolarHBondContact O-CB 3.07Å; E72-R76 PolarHBondContact O-N 3.3Å
73G88.8Confident87.3Confident4 Ų462.1 Ų62.14%0.04132%0.315CS..Hα-helixtrans-59.5-45.5175.700000112.5D70 R76 Y77D70-G73 PolarHBondContact O-N 2.93Å; D70-G73 VanDerWaalsContact OD1-CA 3.32Å; D70-G73 WeakPolarHBondContact OD1-CA 3.18Å; D70-G73 PolarHBondContact OD1-N 3.44Å; G73-R76 PolarHBondContact O-N 3.4Å; G73-Y77 WeakPolarHBondContact O-CB 3.35Å; G73-Y77 PolarHBondContact O-N 2.91Å
74I89.8Confident87Confident0 Ų066.5 Ų66.50%034%0.338CS..Hα-helixtrans-63.1-46.3177.8-69.3165.5000110.9F8 V11 I13 L66 L69 D70 Y77 L78F8-I74 HydrophobicContact CD1-CD1 4.19Å; F8-I74 HydrophobicContact CE1-CD1 4Å; F8-I74 HydrophobicContact CE1-CG2 3.97Å; F8-I74 HydrophobicContact CZ-CG2 4.1Å; V11-I74 HydrophobicContact CG1-CD1 4.36Å; I13-I74 HydrophobicContact CD1-CB 3.44Å; I13-I74 VanDerWaalsContact CD1-CB 3.44Å; I13-I74 HydrophobicContact CD1-CD1 3.49Å; I13-I74 VanDerWaalsContact CD1-CD1 3.49Å; I13-I74 HydrophobicContact CD1-CG1 4.04Å; I13-I74 HydrophobicContact CD1-CG2 3.34Å; L66-I74 HydrophobicContact CD2-CB 4.37Å; L66-I74 HydrophobicContact CD2-CG1 4.2Å; L66-I74 HydrophobicContact CD2-CG2 3.8Å; L69-I74 HydrophobicContact CB-CG1 3.69Å; D70-I74 WeakPolarHBondContact O-CB 3.45Å; D70-I74 VanDerWaalsContact O-CG1 3.27Å; D70-I74 WeakPolarHBondContact O-CG1 3.34Å; D70-I74 PolarHBondContact O-N 2.82Å; I74-Y77 PolarHBondContact O-N 2.91Å; I74-L78 HydrophobicContact CG2-CD1 3.8Å; I74-L78 HydrophobicContact CG2-CG 4.32Å; I74-L78 WeakPolarHBondContact O-CB 3.41Å; I74-L78 VanDerWaalsContact O-CG 3.32Å; I74-L78 WeakPolarHBondContact O-CG 3.33Å; I74-L78 PolarHBondContact O-N 2.81Å
75L87.8Confident86.6Confident36 Ų3665.6 Ų65.619%0.18833%0.326CS..Hα-helixtrans-65.2-43.5-179.9-71.7175000111.7I13 M17 M71 E72 Y77 L78 Q79I13-L75 HydrophobicContact CG2-CD2 4.4Å; M17-L75 HydrophobicContact CB-CD2 3.8Å; M71-L75 PolarHBondContact O-N 3.26Å; E72-L75 PolarHBondContact O-N 3.32Å; L75-Y77 VanDerWaalsContact C-N 3.32Å; L75-Y77 PolarHBondContact O-N 2.6Å; L75-L78 PolarHBondContact O-N 2.73Å; L75-Q79 VanDerWaalsContact O-CB 3.25Å; L75-Q79 WeakPolarHBondContact O-CB 3.41Å; L75-Q79 VanDerWaalsContact O-CG 3.26Å; L75-Q79 WeakPolarHBondContact O-CG 3.17Å; L75-Q79 PolarHBondContact O-N 3.42Å
76R88.6Confident86.3Confident152 Ų15263.2 Ų63.257%0.57431%0.313SS*.Hα-helixtrans-61.1-43.8175-174.1176.865.9-151.7-6.2111.2E72 G73 Q79 H80 D81E72-R76 WeakPolarHBondContact O-CB 3.07Å; E72-R76 PolarHBondContact O-N 3.3Å; G73-R76 PolarHBondContact O-N 3.4Å; R76-Q79 PolarHBondContact O-N 3.33Å; R76-H80 WeakPolarHBondContact O-CB 3.31Å; R76-H80 PolarHBondContact O-N 3.34Å; R76-D81 PolarHBondContact O-N 3.1Å
77Y88.8Confident85.8Confident19 Ų1968.1 Ų68.18%0.07534%0.339CS..Iπ-helixtrans-62.1-46.5179.8-168.3-98.4000112C62 D65 L66 L69 G73 I74 L75 D81 L82 Q85C62-Y77 HydrophobicContact CB-CE1 3.87Å; D65-Y77 HydrophobicContact CB-CE1 4.18Å; D65-Y77 HydrophobicContact CB-CE2 4.33Å; D65-Y77 PolarHBondContact OD2-OH 2.62Å; L66-Y77 HydrophobicContact CD2-CD1 4.05Å; L69-Y77 HydrophobicContact CD1-CD2 4.13Å; L69-Y77 HydrophobicContact CD1-CG 3.91Å; G73-Y77 WeakPolarHBondContact O-CB 3.35Å; G73-Y77 PolarHBondContact O-N 2.91Å; I74-Y77 PolarHBondContact O-N 2.91Å; L75-Y77 VanDerWaalsContact C-N 3.32Å; L75-Y77 PolarHBondContact O-N 2.6Å; Y77-D81 HydrophobicContact CD2-CB 3.91Å; Y77-D81 HydrophobicContact CE2-CB 4.41Å; Y77-D81 HydrophobicContact CG-CB 4.47Å; Y77-D81 PolarHBondContact O-N 3.32Å; Y77-L82 PolarHBondContact O-N 2.91Å; Y77-Q85 HydrophobicContact CE2-CG 4.31Å; Y77-Q85 WeakPolarHBondContact OH-CG 3.18Å; Y77-Q85 PolarHBondContact OH-NE2 3.33Å
78L89.5Confident85Confident0 Ų072.9 Ų72.90%036%0.362CS..Iπ-helixtrans-75.2-23.2-178.6-67.2179.7000114.4F8 Y18 W22 L59 L66 I74 L75F8-L78 HydrophobicContact CZ-CD1 4.4Å; Y18-L78 HydrophobicContact CD1-CD1 4.02Å; Y18-L78 HydrophobicContact CD2-CD1 3.84Å; Y18-L78 HydrophobicContact CE1-CD1 4.46Å; Y18-L78 HydrophobicContact CE2-CD1 4.32Å; Y18-L78 HydrophobicContact CG-CD1 3.68Å; W22-L78 HydrophobicContact CH2-CD1 4.47Å; W22-L78 HydrophobicContact CH2-CD2 3.98Å; W22-L78 HydrophobicContact CZ2-CB 3.98Å; W22-L78 HydrophobicContact CZ2-CD1 4.41Å; W22-L78 HydrophobicContact CZ2-CD2 3.84Å; W22-L78 HydrophobicContact CZ2-CG 4.28Å; W22-L78 PolarHBondContact NE1-O 3.43Å; L59-L78 HydrophobicContact CD2-CD1 4.46Å; L59-L78 HydrophobicContact CD2-CD2 4.36Å; L66-L78 HydrophobicContact CD1-CD2 4.26Å; L66-L78 HydrophobicContact CD2-CD1 4.26Å; L66-L78 HydrophobicContact CD2-CD2 3.91Å; L66-L78 HydrophobicContact CD2-CG 3.98Å; I74-L78 HydrophobicContact CG2-CD1 3.8Å; I74-L78 HydrophobicContact CG2-CG 4.32Å; I74-L78 WeakPolarHBondContact O-CB 3.41Å; I74-L78 VanDerWaalsContact O-CG 3.32Å; I74-L78 WeakPolarHBondContact O-CG 3.33Å; I74-L78 PolarHBondContact O-N 2.81Å; L75-L78 PolarHBondContact O-N 2.73Å
79Q87Confident84.5Confident70 Ų7071 Ų7133%0.32735%0.345SS..Iπ-helixtrans-99.2-30.9-177.6-67.7-1800.200113.9M17 L75 R76M17-Q79 PolarHBondContact O-NE2 2.95Å; M17-Q79 VanDerWaalsContact O-NE2 3.11Å; L75-Q79 VanDerWaalsContact O-CB 3.25Å; L75-Q79 WeakPolarHBondContact O-CB 3.41Å; L75-Q79 VanDerWaalsContact O-CG 3.26Å; L75-Q79 WeakPolarHBondContact O-CG 3.17Å; L75-Q79 PolarHBondContact O-N 3.42Å; R76-Q79 PolarHBondContact O-N 3.33Å
80H84.1Confident84Confident133 Ų13370.9 Ų70.962%0.61634%0.343SS*.Iπ-helixtrans-124.1-44.8-173-67.5-57.1000113.5R76 L82R76-H80 WeakPolarHBondContact O-CB 3.31Å; R76-H80 PolarHBondContact O-N 3.34Å; H80-L82 VanDerWaalsContact C-N 3.29Å; H80-L82 PolarHBondContact O-N 2.93Å
81D85.1Confident83.8Confident51 Ų5173.2 Ų73.227%0.27335%0.35SS..Iπ-helixtrans-82-12.9-172.2-49.4-26.5000112.3R76 Y77 A83 E84 Q85R76-D81 PolarHBondContact O-N 3.1Å; Y77-D81 HydrophobicContact CD2-CB 3.91Å; Y77-D81 HydrophobicContact CE2-CB 4.41Å; Y77-D81 HydrophobicContact CG-CB 4.47Å; Y77-D81 PolarHBondContact O-N 3.32Å; D81-A83 VanDerWaalsContact C-N 3.28Å; D81-A83 PolarHBondContact O-N 3.2Å; D81-E84 PolarHBondContact O-N 3.44Å; D81-Q85 PolarHBondContact O-N 2.94Å
82L84.9Confident83.7Confident0 Ų076.7 Ų76.70%036%0.359CS..Hα-helixtrans-59.8-37.1-179.4-157.471.4000112.9W22 L31 I58 Y77 H80 E84 Q85 F86W22-L82 HydrophobicContact CZ2-CD2 4.3Å; L31-L82 HydrophobicContact CD2-CD2 3.58Å; L31-L82 HydrophobicContact CD2-CG 3.87Å; L31-L82 HydrophobicContact CG-CD2 4.34Å; I58-L82 HydrophobicContact CD1-CD2 4.37Å; I58-L82 HydrophobicContact CG2-CD1 3.76Å; I58-L82 HydrophobicContact CG2-CD2 3.92Å; I58-L82 HydrophobicContact CG2-CG 4.38Å; Y77-L82 PolarHBondContact O-N 2.91Å; H80-L82 VanDerWaalsContact C-N 3.29Å; H80-L82 PolarHBondContact O-N 2.93Å; L82-E84 VanDerWaalsContact C-N 3.31Å; L82-E84 PolarHBondContact O-N 3.1Å; L82-Q85 PolarHBondContact O-N 3.48Å; L82-F86 HydrophobicContact CD1-CD2 4.29Å; L82-F86 HydrophobicContact CD1-CE2 3.73Å; L82-F86 HydrophobicContact CG-CD2 4Å; L82-F86 HydrophobicContact CG-CE2 3.86Å; L82-F86 VanDerWaalsContact O-CD2 3.3Å; L82-F86 WeakPolarHBondContact O-CD2 3.48Å; L82-F86 PolarHBondContact O-N 3.47Å
83A84Confident83.8Confident36 Ų3669.3 Ų69.330%0.29833%0.325SS..Hα-helixtrans-63.9-38.5-179.800000111.9T30 P32 D81 D87T30-A83 PolarHBondContact O-N 3.09Å; P32-A83 WeakPolarHBondContact CG-O 3.49Å; D81-A83 VanDerWaalsContact C-N 3.28Å; D81-A83 PolarHBondContact O-N 3.2Å; A83-D87 PolarHBondContact O-N 2.93Å
84E82Confident83.7Confident159 Ų15969.3 Ų69.374%0.74332%0.324SS*.Hα-helixtrans-70.6-34.5-179.7-167.4172.9-172.100111.9D81 L82D81-E84 PolarHBondContact O-N 3.44Å; L82-E84 VanDerWaalsContact C-N 3.31Å; L82-E84 PolarHBondContact O-N 3.1Å
85Q78.6Confident83.6Confident98 Ų9872.1 Ų72.146%0.45834%0.343SS..Hα-helixtrans-67.5-36.8178.3-71.1-70.5-18.100113.1Y77 D81 L82Y77-Q85 HydrophobicContact CE2-CG 4.31Å; Y77-Q85 WeakPolarHBondContact OH-CG 3.18Å; Y77-Q85 PolarHBondContact OH-NE2 3.33Å; D81-Q85 PolarHBondContact O-N 2.94Å; L82-Q85 PolarHBondContact O-N 3.48Å
86F80.7Confident83.7Confident12 Ų1271.8 Ų71.85%0.05334%0.343CS..Hα-helixtrans-91.6-16.5-175.7-72.4-71.9000114.2L31 I35 I58 L61 L82 Q88 D89 H90 L93L31-F86 HydrophobicContact CD2-CD2 3.63Å; L31-F86 HydrophobicContact CD2-CE2 4.18Å; L31-F86 HydrophobicContact CD2-CG 4.34Å; I35-F86 HydrophobicContact CD1-CB 3.51Å; I35-F86 HydrophobicContact CD1-CG 4.23Å; I58-F86 HydrophobicContact CG1-CE2 4.35Å; I58-F86 HydrophobicContact CG1-CZ 4.33Å; I58-F86 HydrophobicContact CG2-CE2 4.3Å; L61-F86 HydrophobicContact CB-CZ 4.42Å; L61-F86 HydrophobicContact CD1-CE1 3.74Å; L61-F86 HydrophobicContact CD1-CZ 4.18Å; L82-F86 HydrophobicContact CD1-CD2 4.29Å; L82-F86 HydrophobicContact CD1-CE2 3.73Å; L82-F86 HydrophobicContact CG-CD2 4Å; L82-F86 HydrophobicContact CG-CE2 3.86Å; L82-F86 VanDerWaalsContact O-CD2 3.3Å; L82-F86 WeakPolarHBondContact O-CD2 3.48Å; L82-F86 PolarHBondContact O-N 3.47Å; F86-Q88 PolarHBondContact O-N 3.48Å; F86-D89 PolarHBondContact O-N 2.88Å; F86-H90 PolarHBondContact O-CD2 2.79Å; F86-H90 PolarHBondContact O-N 2.91Å; F86-H90 PolarHBondContact O-NE2 3.44Å; F86-L93 HydrophobicContact CD1-CB 4.14Å; F86-L93 HydrophobicContact CD1-CD2 4.4Å; F86-L93 HydrophobicContact CE1-CB 3.89Å; F86-L93 HydrophobicContact CE1-CD1 4.16Å; F86-L93 HydrophobicContact CE1-CD2 4.31Å; F86-L93 HydrophobicContact CE1-CG 4.34Å; F86-L93 HydrophobicContact CZ-CD1 4.27Å
87D77.2Confident83.6Confident103 Ų10364.7 Ų64.755%0.55132%0.317SS*.THydrogen-bonded Turntrans-49.1-32.6-176-163.147.4000114.1A83A83-D87 PolarHBondContact O-N 2.93Å
88Q71.6Confident83.6Confident179 Ų17966.8 Ų66.884%0.83633%0.326SS*.THydrogen-bonded Turntrans-100.2-18.6-180-62.9179.224.200114.7F86F86-Q88 PolarHBondContact O-N 3.48Å
89D74.8Confident83.4Confident59 Ų5971.9 Ų71.932%0.31635%0.35SS..  trans-12837.8-166.7-91.8-36.1000113F86 E91 R92F86-D89 PolarHBondContact O-N 2.88Å; D89-E91 VanDerWaalsContact C-N 3.27Å; D89-E91 PolarHBondContact O-N 3.35Å; D89-E91 VanDerWaalsContact O-N 3.16Å; D89-R92 HydrophobicContact CB-CG 4.31Å; D89-R92 PolarHBondContact O-N 3.27Å; D89-R92 VanDerWaalsContact O-N 3.14Å; D89-R92 IonicContact OD1-CZ 3.53Å; D89-R92 IonicContact OD1-NE 3.88Å; D89-R92 PolarHBondContact OD1-NE 3.31Å; D89-R92 IonicContact OD1-NH1 2.64Å; D89-R92 IonicContact OD1-NH2 3.17Å; D89-R92 PolarHBondContact OD1-NH2 3.05Å; D89-R92 IonicContact OD2-CZ 3.23Å; D89-R92 IonicContact OD2-NE 3.72Å; D89-R92 IonicContact OD2-NH1 3.16Å; D89-R92 PolarHBondContact OD2-NH1 3.26Å; D89-R92 IonicContact OD2-NH2 3.32Å; D89-R92 PolarHBondContact OD2-NH2 3.5Å
90H79Confident83.1Confident45 Ų4570.1 Ų70.121%0.20835%0.351CS..Hα-helixtrans-50.6-39.6179.5-63.5157.7000114.2I35 F86 R92 F94I35-H90 HydrophobicContact CD1-CB 4.47Å; I35-H90 WeakPolarHBondContact CD1-CD2 3.42Å; I35-H90 HydrophobicContact CG1-CB 4.16Å; I35-H90 WeakPolarHBondContact CG1-CD2 3.01Å; F86-H90 PolarHBondContact O-CD2 2.79Å; F86-H90 PolarHBondContact O-N 2.91Å; F86-H90 PolarHBondContact O-NE2 3.44Å; H90-R92 PolarHBondContact O-N 3.44Å; H90-F94 WeakPolarHBondContact O-CD2 3.25Å
91E83.3Confident82.8Confident152 Ų15265.8 Ų65.871%0.7133%0.332SS*.Hα-helixtrans-70.5-29.8-176.7-68.1-154.9151.700113.6D89 L93 F94 S95D89-E91 VanDerWaalsContact C-N 3.27Å; D89-E91 PolarHBondContact O-N 3.35Å; D89-E91 VanDerWaalsContact O-N 3.16Å; E91-L93 VanDerWaalsContact C-N 3.31Å; E91-L93 PolarHBondContact O-N 3.47Å; E91-F94 PolarHBondContact O-N 2.87Å; E91-S95 PolarHBondContact O-N 3.47Å
92R85.5Confident82.6Confident148 Ų14870.6 Ų70.656%0.55835%0.351SS*.Hα-helixtrans-64.2-39.4-179.2-67-169.6-177.4154.116.4111.5D89 H90 S95 V96D89-R92 HydrophobicContact CB-CG 4.31Å; D89-R92 PolarHBondContact O-N 3.27Å; D89-R92 VanDerWaalsContact O-N 3.14Å; D89-R92 IonicContact OD1-CZ 3.53Å; D89-R92 IonicContact OD1-NE 3.88Å; D89-R92 PolarHBondContact OD1-NE 3.31Å; D89-R92 IonicContact OD1-NH1 2.64Å; D89-R92 IonicContact OD1-NH2 3.17Å; D89-R92 PolarHBondContact OD1-NH2 3.05Å; D89-R92 IonicContact OD2-CZ 3.23Å; D89-R92 IonicContact OD2-NE 3.72Å; D89-R92 IonicContact OD2-NH1 3.16Å; D89-R92 PolarHBondContact OD2-NH1 3.26Å; D89-R92 IonicContact OD2-NH2 3.32Å; D89-R92 PolarHBondContact OD2-NH2 3.5Å; H90-R92 PolarHBondContact O-N 3.44Å; R92-S95 PolarHBondContact O-N 3.16Å; R92-V96 WeakPolarHBondContact O-CG2 3.34Å; R92-V96 PolarHBondContact O-N 2.86Å
93L88Confident82.5Confident0 Ų072.8 Ų72.80%037%0.368CS..Hα-helixtrans-58.7-50.9178.1177.960.9000111.7L31 I35 I54 A57 I58 L61 F86 E91 V96 A97L31-L93 HydrophobicContact CD1-CD2 4.23Å; I35-L93 HydrophobicContact CG2-CD2 3.86Å; I54-L93 HydrophobicContact CG2-CD2 4.2Å; A57-L93 HydrophobicContact CB-CD1 3.73Å; I58-L93 HydrophobicContact CG1-CD1 3.65Å; I58-L93 HydrophobicContact CG1-CD2 4.26Å; L61-L93 HydrophobicContact CD1-CB 4.27Å; L61-L93 HydrophobicContact CD1-CD1 4.1Å; F86-L93 HydrophobicContact CD1-CB 4.14Å; F86-L93 HydrophobicContact CD1-CD2 4.4Å; F86-L93 HydrophobicContact CE1-CB 3.89Å; F86-L93 HydrophobicContact CE1-CD1 4.16Å; F86-L93 HydrophobicContact CE1-CD2 4.31Å; F86-L93 HydrophobicContact CE1-CG 4.34Å; F86-L93 HydrophobicContact CZ-CD1 4.27Å; E91-L93 VanDerWaalsContact C-N 3.31Å; E91-L93 PolarHBondContact O-N 3.47Å; L93-V96 PolarHBondContact O-N 3.23Å; L93-A97 WeakPolarHBondContact O-CB 3.3Å; L93-A97 PolarHBondContact O-N 3.33Å
94F88Confident82.4Confident3 Ų375.1 Ų75.11%0.01337%0.373CS..Hα-helixtrans-67.4-38.4178.3-70.9-77.7000111.8I35 R38 I54 H90 E91 V96 A97 F98I35-F94 HydrophobicContact CG2-CE2 3.85Å; I35-F94 HydrophobicContact CG2-CZ 3.97Å; R38-F94 HydrophobicContact CB-CE1 4.49Å; R38-F94 HydrophobicContact CB-CE2 4.09Å; R38-F94 HydrophobicContact CB-CZ 3.7Å; R38-F94 VanDerWaalsContact CD-CE2 3.49Å; R38-F94 HydrophobicContact CG-CE1 3.96Å; R38-F94 HydrophobicContact CG-CE2 3.86Å; R38-F94 HydrophobicContact CG-CZ 3.53Å; R38-F94 VanDerWaalsContact NH1-CD2 3.34Å; I54-F94 HydrophobicContact CD1-CE1 3.98Å; H90-F94 WeakPolarHBondContact O-CD2 3.25Å; E91-F94 PolarHBondContact O-N 2.87Å; F94-V96 PolarHBondContact O-N 3.42Å; F94-A97 PolarHBondContact O-N 2.93Å; F94-F98 HydrophobicContact CB-CD2 4.03Å; F94-F98 HydrophobicContact CB-CE2 3.95Å; F94-F98 AromaticContact CD1-CE2 3.92Å; F94-F98 HydrophobicContact CD1-CE2 3.92Å; F94-F98 HydrophobicContact CG-CE2 4.38Å; F94-F98 WeakPolarHBondContact O-CB 3.47Å; F94-F98 WeakPolarHBondContact O-CD2 3.47Å; F94-F98 PolarHBondContact O-N 3.24Å
95S88Confident82.5Confident59 Ų5970.8 Ų70.841%0.41336%0.355SS..Hα-helixtrans-57-49.2176.1-160.90000111.3E91 R92 A97 F98 E99E91-S95 PolarHBondContact O-N 3.47Å; R92-S95 PolarHBondContact O-N 3.16Å; S95-A97 PolarHBondContact O-N 3.45Å; S95-F98 PolarHBondContact O-N 2.81Å; S95-E99 VanDerWaalsContact O-CB 3.25Å; S95-E99 WeakPolarHBondContact O-CB 3.43Å; S95-E99 WeakPolarHBondContact O-CG 3.19Å; S95-E99 PolarHBondContact O-N 3.33Å; S95-E99 PolarHBondContact OG-OE1 2.84Å
96V88.3Confident82.9Confident29 Ų2973.8 Ų73.818%0.17636%0.362CS..Hα-helixtrans-63.5-42.8178.3174.70000111.4A57 L61 R92 L93 F94 F98 E99 G100A57-V96 HydrophobicContact CB-CB 4.31Å; A57-V96 HydrophobicContact CB-CG1 3.99Å; L61-V96 HydrophobicContact CD2-CG2 4.01Å; L61-V96 HydrophobicContact CG-CG2 4.39Å; R92-V96 WeakPolarHBondContact O-CG2 3.34Å; R92-V96 PolarHBondContact O-N 2.86Å; L93-V96 PolarHBondContact O-N 3.23Å; F94-V96 PolarHBondContact O-N 3.42Å; V96-F98 PolarHBondContact O-N 3.32Å; V96-E99 PolarHBondContact O-N 2.96Å; V96-G100 PolarHBondContact O-N 2.88Å
97A88Confident83.3Confident4 Ų478.7 Ų78.73%0.03339%0.389CS..Hα-helixtrans-61.7-42.9177.800000112.4I54 A57 L93 F94 S95I54-A97 HydrophobicContact CG1-CB 4.27Å; A57-A97 HydrophobicContact CB-CB 3.96Å; L93-A97 WeakPolarHBondContact O-CB 3.3Å; L93-A97 PolarHBondContact O-N 3.33Å; F94-A97 PolarHBondContact O-N 2.93Å; S95-A97 PolarHBondContact O-N 3.45Å
98F87.6Confident83.9Confident62 Ų6278.3 Ų78.327%0.27239%0.386SS..Hα-helixtrans-79.2-28.2179.1-71.1-62.9000113.5V42 I50 F94 S95 V96 G100 I101 K102V42-F98 HydrophobicContact CG1-CE1 4.13Å; V42-F98 HydrophobicContact CG1-CZ 3.78Å; V42-F98 HydrophobicContact CG2-CZ 4.1Å; I50-F98 HydrophobicContact CD1-CE1 3.95Å; I50-F98 HydrophobicContact CD1-CZ 4.25Å; F94-F98 HydrophobicContact CB-CD2 4.03Å; F94-F98 HydrophobicContact CB-CE2 3.95Å; F94-F98 AromaticContact CD1-CE2 3.92Å; F94-F98 HydrophobicContact CD1-CE2 3.92Å; F94-F98 HydrophobicContact CG-CE2 4.38Å; F94-F98 WeakPolarHBondContact O-CB 3.47Å; F94-F98 WeakPolarHBondContact O-CD2 3.47Å; F94-F98 PolarHBondContact O-N 3.24Å; S95-F98 PolarHBondContact O-N 2.81Å; V96-F98 PolarHBondContact O-N 3.32Å; F98-G100 VanDerWaalsContact C-N 3.29Å; F98-G100 PolarHBondContact O-N 3.38Å; F98-I101 HydrophobicContact CD1-CD1 3.89Å; F98-I101 HydrophobicContact CE1-CD1 4.42Å; F98-I101 WeakPolarHBondContact O-CB 3.32Å; F98-I101 PolarHBondContact O-N 2.94Å; F98-K102 PolarHBondContact O-N 3.36Å
99E86Confident84.7Confident107 Ų10777.4 Ų77.450%0.538%0.375SS..Hα-helixtrans-62.8-37.6172.7-82.5168.5-146.600111.5S95 V96 I101 K102 A103S95-E99 VanDerWaalsContact O-CB 3.25Å; S95-E99 WeakPolarHBondContact O-CB 3.43Å; S95-E99 WeakPolarHBondContact O-CG 3.19Å; S95-E99 PolarHBondContact O-N 3.33Å; S95-E99 PolarHBondContact OG-OE1 2.84Å; V96-E99 PolarHBondContact O-N 2.96Å; E99-I101 VanDerWaalsContact C-N 3.29Å; E99-I101 PolarHBondContact O-N 2.95Å; E99-K102 PolarHBondContact O-N 3.47Å; E99-A103 WeakPolarHBondContact O-CB 3.37Å; E99-A103 PolarHBondContact O-N 2.93Å
100G79.6Confident85.6Confident34 Ų3479.7 Ų79.735%0.35138%0.383SS..Hα-helixtrans-55.1-44.517100000112.3V96 F98 A103 E104V96-G100 PolarHBondContact O-N 2.88Å; F98-G100 VanDerWaalsContact C-N 3.29Å; F98-G100 PolarHBondContact O-N 3.38Å; G100-A103 PolarHBondContact O-N 2.85Å; G100-E104 VanDerWaalsContact O-CB 3.29Å; G100-E104 WeakPolarHBondContact O-CB 3.29Å; G100-E104 PolarHBondContact O-N 3.47Å
101I78.1Confident86.2Confident41 Ų4184.3 Ų84.321%0.2140%0.399CS..Hα-helixtrans-62.7-45.1176.4-65.8169.7000110.9I50 F98 E99 N105I50-I101 HydrophobicContact CD1-CD1 4.49Å; F98-I101 HydrophobicContact CD1-CD1 3.89Å; F98-I101 HydrophobicContact CE1-CD1 4.42Å; F98-I101 WeakPolarHBondContact O-CB 3.32Å; F98-I101 PolarHBondContact O-N 2.94Å; E99-I101 VanDerWaalsContact C-N 3.29Å; E99-I101 PolarHBondContact O-N 2.95Å; I101-N105 VanDerWaalsContact CG2-ND2 3.26Å; I101-N105 WeakPolarHBondContact CG2-ND2 3.43Å; I101-N105 VanDerWaalsContact O-CB 3.27Å; I101-N105 WeakPolarHBondContact O-CB 3.48Å; I101-N105 PolarHBondContact O-N 3.49Å; I101-N105 PolarHBondContact O-ND2 2.87Å
102K81.8Confident86.5Confident153 Ų15382.5 Ų82.567%0.66539%0.394SS*.Hα-helixtrans-64.4-40.9179.3-70176.8-177.6172.70111.9F98 E99 R106F98-K102 PolarHBondContact O-N 3.36Å; E99-K102 PolarHBondContact O-N 3.47Å; K102-R106 VanDerWaalsContact O-CB 3.24Å; K102-R106 WeakPolarHBondContact O-CB 3.47Å; K102-R106 PolarHBondContact O-N 3.16Å
103A81.5Confident86.8Confident45 Ų4581.4 Ų81.437%0.37240%0.395SS..Hα-helixtrans-67.9-45.117900000111.9E99 G100 R106 L107E99-A103 WeakPolarHBondContact O-CB 3.37Å; E99-A103 PolarHBondContact O-N 2.93Å; G100-A103 PolarHBondContact O-N 2.85Å; A103-R106 PolarHBondContact O-N 3.08Å; A103-L107 PolarHBondContact O-N 2.83Å
104E82.3Confident87Confident86 Ų8687.1 Ų87.140%0.40242%0.417SS..Hα-helixtrans-62.6-49.2176.5-175.2176.2-167.900111R53 G100 R106 L107 L108R53-E104 IonicContact CZ-OE2 3.66Å; R53-E104 IonicContact NH1-OE2 3.65Å; R53-E104 PolarHBondContact NH1-OE2 3.42Å; R53-E104 IonicContact NH2-OE2 3.88Å; R53-E104 PolarHBondContact NH2-OE2 3.33Å; R53-E104 VanDerWaalsContact NH2-OE2 3.08Å; G100-E104 VanDerWaalsContact O-CB 3.29Å; G100-E104 WeakPolarHBondContact O-CB 3.29Å; G100-E104 PolarHBondContact O-N 3.47Å; E104-R106 VanDerWaalsContact C-N 3.3Å; E104-R106 PolarHBondContact O-N 3.45Å; E104-L107 PolarHBondContact O-N 3.42Å; E104-L107 VanDerWaalsContact O-N 3.13Å; E104-L108 HydrophobicContact CG-CD1 4.15Å; E104-L108 WeakPolarHBondContact O-CG 3.5Å; E104-L108 PolarHBondContact O-N 2.92Å
105N84.7Confident87Confident68 Ų6890.7 Ų90.736%0.36444%0.436SS..Hα-helixtrans-61.6-36.6175.7-82.8-74.1000112.8I101 L108 R109I101-N105 VanDerWaalsContact CG2-ND2 3.26Å; I101-N105 WeakPolarHBondContact CG2-ND2 3.43Å; I101-N105 VanDerWaalsContact O-CB 3.27Å; I101-N105 WeakPolarHBondContact O-CB 3.48Å; I101-N105 PolarHBondContact O-N 3.49Å; I101-N105 PolarHBondContact O-ND2 2.87Å; N105-L108 PolarHBondContact O-N 3.16Å; N105-R109 WeakPolarHBondContact O-CB 3.36Å; N105-R109 VanDerWaalsContact O-CG 3.26Å; N105-R109 WeakPolarHBondContact O-CG 3.23Å; N105-R109 PolarHBondContact O-N 3.37Å
106R87.3Confident87.2Confident161 Ų16194.6 Ų94.661%0.60845%0.448SS*.Hα-helixtrans-63.6-43.2174.5-176.1178.367.9-167.60.1111.1K102 A103 E104 R109 Q110K102-R106 VanDerWaalsContact O-CB 3.24Å; K102-R106 WeakPolarHBondContact O-CB 3.47Å; K102-R106 PolarHBondContact O-N 3.16Å; A103-R106 PolarHBondContact O-N 3.08Å; E104-R106 VanDerWaalsContact C-N 3.3Å; E104-R106 PolarHBondContact O-N 3.45Å; R106-R109 PolarHBondContact O-N 3.23Å; R106-Q110 VanDerWaalsContact O-CG 3.32Å; R106-Q110 WeakPolarHBondContact O-CG 3.24Å; R106-Q110 PolarHBondContact O-N 2.75Å
107L89.7Confident87.4Confident115 Ų115100.1 Ų100.160%0.60247%0.472SS*.Hα-helixtrans-66.5-41.9177.4-173.864.9000111.7A103 E104 Q110 R111A103-L107 PolarHBondContact O-N 2.83Å; E104-L107 PolarHBondContact O-N 3.42Å; E104-L107 VanDerWaalsContact O-N 3.13Å; L107-Q110 PolarHBondContact O-N 3.06Å; L107-R111 WeakPolarHBondContact O-CB 3.36Å; L107-R111 PolarHBondContact O-N 2.92Å
108L88.4Confident87.5Confident94 Ų94104.4 Ų104.449%0.49249%0.491SS..Hα-helixtrans-62.2-42.8175.6-71.1171.6000111.6E104 N105 R111 L112E104-L108 HydrophobicContact CG-CD1 4.15Å; E104-L108 WeakPolarHBondContact O-CG 3.5Å; E104-L108 PolarHBondContact O-N 2.92Å; N105-L108 PolarHBondContact O-N 3.16Å; L108-R111 PolarHBondContact O-N 3.19Å; L108-L112 WeakPolarHBondContact O-CB 3.4Å; L108-L112 WeakPolarHBondContact O-CG 3.47Å; L108-L112 PolarHBondContact O-N 2.98Å
109R90Very high87.3Confident161 Ų161104.7 Ų104.761%0.60850%0.501SS*.Hα-helixtrans-61.8-46.1173.7-74.1176.3-166.7172.13.7112.2N105 R106 R111 L112 E113N105-R109 WeakPolarHBondContact O-CB 3.36Å; N105-R109 VanDerWaalsContact O-CG 3.26Å; N105-R109 WeakPolarHBondContact O-CG 3.23Å; N105-R109 PolarHBondContact O-N 3.37Å; R106-R109 PolarHBondContact O-N 3.23Å; R109-R111 VanDerWaalsContact C-N 3.26Å; R109-R111 PolarHBondContact O-N 3.32Å; R109-L112 PolarHBondContact O-N 3.2Å; R109-E113 WeakPolarHBondContact O-CG 3.43Å; R109-E113 PolarHBondContact O-N 3.19Å
110Q92.4Very high87.6Confident106 Ų106101 Ų10150%0.49549%0.492SS..Hα-helixtrans-59.5-38.6174.9-74.6174.8-15.100112R106 L107 Y114R106-Q110 VanDerWaalsContact O-CG 3.32Å; R106-Q110 WeakPolarHBondContact O-CG 3.24Å; R106-Q110 PolarHBondContact O-N 2.75Å; L107-Q110 PolarHBondContact O-N 3.06Å; Q110-Y114 WeakPolarHBondContact O-CB 3.4Å; Q110-Y114 PolarHBondContact O-N 3.18Å
111R92.2Very high88.1Confident142 Ų142101.6 Ų101.654%0.53649%0.491SS..Hα-helixtrans-70-39.6177.1-170.960.1176.1172.44.2111.9L107 L108 R109 Y114 L115L107-R111 WeakPolarHBondContact O-CB 3.36Å; L107-R111 PolarHBondContact O-N 2.92Å; L108-R111 PolarHBondContact O-N 3.19Å; R109-R111 VanDerWaalsContact C-N 3.26Å; R109-R111 PolarHBondContact O-N 3.32Å; R111-Y114 PolarHBondContact O-N 3.48Å; R111-L115 HydrophobicContact CG-CD1 4.18Å; R111-L115 WeakPolarHBondContact O-CB 3.48Å; R111-L115 VanDerWaalsContact O-CG 3.25Å; R111-L115 WeakPolarHBondContact O-CG 3.42Å; R111-L115 PolarHBondContact O-N 2.85Å
112L89.2Confident88.7Confident115 Ų115104 Ų10460%0.60250%0.504SS*.Hα-helixtrans-62.1-48.9174.1-78.5167000111.2L108 R109 Y114 L115 E116L108-L112 WeakPolarHBondContact O-CB 3.4Å; L108-L112 WeakPolarHBondContact O-CG 3.47Å; L108-L112 PolarHBondContact O-N 2.98Å; R109-L112 PolarHBondContact O-N 3.2Å; L112-Y114 VanDerWaalsContact C-N 3.32Å; L112-Y114 PolarHBondContact O-N 3.47Å; L112-L115 PolarHBondContact O-N 2.88Å; L112-E116 WeakPolarHBondContact O-CB 3.19Å; L112-E116 PolarHBondContact O-N 3.39Å
113E92.8Very high89.2Confident125 Ų12599 Ų9958%0.58449%0.49SS*.Hα-helixtrans-58.4-43.2176.6-74.1169.1-166.600111.8R109 E116 Q117R109-E113 WeakPolarHBondContact O-CG 3.43Å; R109-E113 PolarHBondContact O-N 3.19Å; E113-E116 PolarHBondContact O-N 3.45Å; E113-Q117 WeakPolarHBondContact O-CB 3.33Å; E113-Q117 PolarHBondContact O-N 3.44Å
114Y91.7Very high89.7Confident120 Ų120101.5 Ų101.547%0.47150%0.497SS..Hα-helixtrans-63.3-45.9176.4-179.8-87.8000112.2Q110 R111 L112 E116 Q117 E118Q110-Y114 WeakPolarHBondContact O-CB 3.4Å; Q110-Y114 PolarHBondContact O-N 3.18Å; R111-Y114 PolarHBondContact O-N 3.48Å; L112-Y114 VanDerWaalsContact C-N 3.32Å; L112-Y114 PolarHBondContact O-N 3.47Å; Y114-E116 VanDerWaalsContact C-N 3.34Å; Y114-Q117 PolarHBondContact O-N 3.21Å; Y114-E118 WeakPolarHBondContact CE1-OE2 3.37Å; Y114-E118 WeakPolarHBondContact O-CB 3.29Å; Y114-E118 PolarHBondContact O-N 3.39Å
115L88.3Confident90.1Very high78 Ų78104 Ų10441%0.40850%0.503SS..Hα-helixtrans-66.7-37.3178.6-72.5172.4000111.7R111 L112 E118 S119R111-L115 HydrophobicContact CG-CD1 4.18Å; R111-L115 WeakPolarHBondContact O-CB 3.48Å; R111-L115 VanDerWaalsContact O-CG 3.25Å; R111-L115 WeakPolarHBondContact O-CG 3.42Å; R111-L115 PolarHBondContact O-N 2.85Å; L112-L115 PolarHBondContact O-N 2.88Å; L115-E118 PolarHBondContact O-N 2.89Å; L115-S119 VanDerWaalsContact O-CB 3.27Å; L115-S119 WeakPolarHBondContact O-CB 3.32Å; L115-S119 PolarHBondContact O-N 3.35Å; L115-S119 PolarHBondContact O-OG 3.34Å
116E91Very high90.4Very high140 Ų140105.4 Ų105.465%0.65451%0.51SS*.Hα-helixtrans-64-46.3175.1-170.9170.2-165.200110.5L112 E113 Y114 E118 S119 G120L112-E116 WeakPolarHBondContact O-CB 3.19Å; L112-E116 PolarHBondContact O-N 3.39Å; E113-E116 PolarHBondContact O-N 3.45Å; Y114-E116 VanDerWaalsContact C-N 3.34Å; E116-E118 PolarHBondContact O-N 2.93Å; E116-S119 WeakPolarHBondContact CA-OG 3.45Å; E116-S119 PolarHBondContact O-N 2.81Å; E116-S119 PolarHBondContact O-OG 3.16Å; E116-G120 PolarHBondContact O-N 3.06Å
117Q92.5Very high90.7Very high145 Ų145102.4 Ų102.468%0.67851%0.505SS*.Hα-helixtrans-60.5-44.4174.2-172.9-179.317.100112.4E113 Y114 G120 S121E113-Q117 WeakPolarHBondContact O-CB 3.33Å; E113-Q117 PolarHBondContact O-N 3.44Å; Y114-Q117 PolarHBondContact O-N 3.21Å; Q117-G120 PolarHBondContact O-N 3.39Å; Q117-S121 WeakPolarHBondContact O-CB 3.35Å; Q117-S121 PolarHBondContact O-N 3.44Å; Q117-S121 PolarHBondContact O-OG 3.32Å
118E89.7Confident90.9Very high94 Ų94102.2 Ų102.244%0.43950%0.504SS..Hα-helixtrans-62.7-45.1177.6-174.6171.7-164.100110.9Y114 L115 E116 S121 L122Y114-E118 WeakPolarHBondContact CE1-OE2 3.37Å; Y114-E118 WeakPolarHBondContact O-CB 3.29Å; Y114-E118 PolarHBondContact O-N 3.39Å; L115-E118 PolarHBondContact O-N 2.89Å; E116-E118 PolarHBondContact O-N 2.93Å; E118-S121 PolarHBondContact O-N 2.83Å; E118-S121 PolarHBondContact O-OG 3.3Å; E118-L122 WeakPolarHBondContact O-CB 3.48Å; E118-L122 PolarHBondContact O-N 3.07Å
119S84.6Confident91.1Very high69 Ų69104.7 Ų104.748%0.48351%0.511SS..Hα-helixtrans-64.8-41.617872.80000113L115 E116 L122 A123L115-S119 VanDerWaalsContact O-CB 3.27Å; L115-S119 WeakPolarHBondContact O-CB 3.32Å; L115-S119 PolarHBondContact O-N 3.35Å; L115-S119 PolarHBondContact O-OG 3.34Å; E116-S119 WeakPolarHBondContact CA-OG 3.45Å; E116-S119 PolarHBondContact O-N 2.81Å; E116-S119 PolarHBondContact O-OG 3.16Å; S119-L122 PolarHBondContact O-N 3.29Å; S119-A123 WeakPolarHBondContact O-CB 3.43Å; S119-A123 PolarHBondContact O-N 2.9Å
120G90.9Very high91.1Very high30 Ų30103.3 Ų103.331%0.30951%0.512SS..Hα-helixtrans-62.4-47.3173.800000111.5E116 Q117 L122 A123 D124E116-G120 PolarHBondContact O-N 3.06Å; Q117-G120 PolarHBondContact O-N 3.39Å; G120-L122 VanDerWaalsContact C-N 3.25Å; G120-L122 PolarHBondContact O-N 3.15Å; G120-A123 WeakPolarHBondContact O-CB 3.31Å; G120-A123 PolarHBondContact O-N 2.91Å; G120-A123 VanDerWaalsContact O-N 3.14Å; G120-D124 PolarHBondContact O-N 3.23Å
121S91.8Very high91.1Very high46 Ų46101.5 Ų101.532%0.32251%0.508SS..Hα-helixtrans-63.1-30.5177.380.20000113.5Q117 E118 R125Q117-S121 WeakPolarHBondContact O-CB 3.35Å; Q117-S121 PolarHBondContact O-N 3.44Å; Q117-S121 PolarHBondContact O-OG 3.32Å; E118-S121 PolarHBondContact O-N 2.83Å; E118-S121 PolarHBondContact O-OG 3.3Å; S121-R125 WeakPolarHBondContact O-CG 3.22Å; S121-R125 PolarHBondContact O-N 2.94Å; S121-R125 PolarHBondContact O-NE 2.87Å; S121-R125 PolarHBondContact OG-NH2 2.9Å
122L89.9Confident91.1Very high92 Ų9298.2 Ų98.248%0.48251%0.506SS..Hα-helixtrans-73.4-43.8175-179.564.4000110.4E118 S119 G120 R125 L126E118-L122 WeakPolarHBondContact O-CB 3.48Å; E118-L122 PolarHBondContact O-N 3.07Å; S119-L122 PolarHBondContact O-N 3.29Å; G120-L122 VanDerWaalsContact C-N 3.25Å; G120-L122 PolarHBondContact O-N 3.15Å; L122-R125 PolarHBondContact O-N 2.85Å; L122-L126 HydrophobicContact CD1-CD1 4.48Å; L122-L126 HydrophobicContact CD1-CG 4.5Å; L122-L126 HydrophobicContact CG-CD1 4.12Å; L122-L126 WeakPolarHBondContact O-CB 3.27Å; L122-L126 VanDerWaalsContact O-CG 3.3Å; L122-L126 WeakPolarHBondContact O-CG 3.36Å; L122-L126 PolarHBondContact O-N 2.94Å
123A91.7Very high91.3Very high46 Ų4698 Ų9838%0.3851%0.505SS..Hα-helixtrans-59.2-4617600000111.5S119 G120 R125 L126 I127S119-A123 WeakPolarHBondContact O-CB 3.43Å; S119-A123 PolarHBondContact O-N 2.9Å; G120-A123 WeakPolarHBondContact O-CB 3.31Å; G120-A123 PolarHBondContact O-N 2.91Å; G120-A123 VanDerWaalsContact O-N 3.14Å; A123-R125 PolarHBondContact O-N 3.22Å; A123-L126 PolarHBondContact O-N 3.41Å; A123-I127 VanDerWaalsContact O-CG1 3.29Å; A123-I127 WeakPolarHBondContact O-CG1 3.4Å; A123-I127 PolarHBondContact O-N 2.87Å
124D91.6Very high91.2Very high98 Ų9894.3 Ų94.352%0.52450%0.497SS..Hα-helixtrans-60.1-46.8177.2-68.6-22.5000111.6G120 L126 I127 D128G120-D124 PolarHBondContact O-N 3.23Å; D124-L126 VanDerWaalsContact C-N 3.29Å; D124-L126 PolarHBondContact O-N 3.28Å; D124-I127 PolarHBondContact O-N 3.46Å; D124-D128 PolarHBondContact O-N 2.86Å
125R92.6Very high91.2Very high140 Ų14093.7 Ų93.753%0.52850%0.498SS..Hα-helixtrans-62.2-34.9176.2-76.7-179-70.3-168.6-0.5113.1S121 L122 A123 K129S121-R125 WeakPolarHBondContact O-CG 3.22Å; S121-R125 PolarHBondContact O-N 2.94Å; S121-R125 PolarHBondContact O-NE 2.87Å; S121-R125 PolarHBondContact OG-NH2 2.9Å; L122-R125 PolarHBondContact O-N 2.85Å; A123-R125 PolarHBondContact O-N 3.22Å; R125-K129 WeakPolarHBondContact O-CB 3.32Å; R125-K129 WeakPolarHBondContact O-CG 3.1Å; R125-K129 PolarHBondContact O-N 3.49Å; R125-K129 VanDerWaalsContact O-N 3.08Å
126L90.9Very high91.3Very high97 Ų9791.8 Ų91.851%0.50850%0.497SS..Hα-helixtrans-71-41.3176.2-74.4171000111.2L122 A123 D124 K129 Q130L122-L126 HydrophobicContact CD1-CD1 4.48Å; L122-L126 HydrophobicContact CD1-CG 4.5Å; L122-L126 HydrophobicContact CG-CD1 4.12Å; L122-L126 WeakPolarHBondContact O-CB 3.27Å; L122-L126 VanDerWaalsContact O-CG 3.3Å; L122-L126 WeakPolarHBondContact O-CG 3.36Å; L122-L126 PolarHBondContact O-N 2.94Å; A123-L126 PolarHBondContact O-N 3.41Å; D124-L126 VanDerWaalsContact C-N 3.29Å; D124-L126 PolarHBondContact O-N 3.28Å; L126-K129 PolarHBondContact O-N 2.73Å; L126-Q130 WeakPolarHBondContact O-CB 3.27Å; L126-Q130 PolarHBondContact O-N 3.37Å
127I93.1Very high91.3Very high98 Ų9887.6 Ų87.650%0.50349%0.487SS..Hα-helixtrans-60.6-49174.2-68.9165.3000109.7A123 D124 K129 Q130 V131A123-I127 VanDerWaalsContact O-CG1 3.29Å; A123-I127 WeakPolarHBondContact O-CG1 3.4Å; A123-I127 PolarHBondContact O-N 2.87Å; D124-I127 PolarHBondContact O-N 3.46Å; I127-K129 VanDerWaalsContact C-N 3.35Å; I127-K129 PolarHBondContact O-N 3.34Å; I127-Q130 PolarHBondContact O-N 3.34Å; I127-Q130 VanDerWaalsContact O-N 3.15Å; I127-V131 HydrophobicContact CG2-CG2 4.19Å; I127-V131 WeakPolarHBondContact O-CB 3.31Å; I127-V131 VanDerWaalsContact O-CG2 3.25Å; I127-V131 WeakPolarHBondContact O-CG2 3.39Å; I127-V131 PolarHBondContact O-N 2.84Å
128D93.4Very high91.3Very high110 Ų11087 Ų8759%0.58848%0.484SS*.Hα-helixtrans-58.1-45.5178.4-75.6-20000112.1D124 V131 S132D124-D128 PolarHBondContact O-N 2.86Å; D128-V131 PolarHBondContact O-N 3.47Å; D128-S132 WeakPolarHBondContact O-CB 3.24Å; D128-S132 PolarHBondContact O-N 2.86Å
129K92.2Very high91.5Very high146 Ų14687.5 Ų87.564%0.63549%0.49SS*.Hα-helixtrans-62.9-43.7176.1-78-178.1177.5-173.60111.7R125 L126 I127 S132 L133R125-K129 WeakPolarHBondContact O-CB 3.32Å; R125-K129 WeakPolarHBondContact O-CG 3.1Å; R125-K129 PolarHBondContact O-N 3.49Å; R125-K129 VanDerWaalsContact O-N 3.08Å; L126-K129 PolarHBondContact O-N 2.73Å; I127-K129 VanDerWaalsContact C-N 3.35Å; I127-K129 PolarHBondContact O-N 3.34Å; K129-S132 PolarHBondContact O-N 2.98Å; K129-L133 WeakPolarHBondContact O-CB 3.36Å; K129-L133 VanDerWaalsContact O-CG 3.27Å; K129-L133 WeakPolarHBondContact O-CG 3.28Å; K129-L133 PolarHBondContact O-N 3.08Å
130Q90.9Very high92Very high132 Ų13288.5 Ų88.562%0.61749%0.489SS*.Hα-helixtrans-67.9-37.2-179.5-167.367.4-6.800112L126 I127 A134L126-Q130 WeakPolarHBondContact O-CB 3.27Å; L126-Q130 PolarHBondContact O-N 3.37Å; I127-Q130 PolarHBondContact O-N 3.34Å; I127-Q130 VanDerWaalsContact O-N 3.15Å; Q130-A134 WeakPolarHBondContact O-CB 3.46Å; Q130-A134 PolarHBondContact O-N 3.1Å
131V92Very high92.1Very high69 Ų6990.8 Ų90.842%0.41850%0.497SS..Hα-helixtrans-65.2-44.7173.1170.80000110.4I127 D128 L133 A134 Q135I127-V131 HydrophobicContact CG2-CG2 4.19Å; I127-V131 WeakPolarHBondContact O-CB 3.31Å; I127-V131 VanDerWaalsContact O-CG2 3.25Å; I127-V131 WeakPolarHBondContact O-CG2 3.39Å; I127-V131 PolarHBondContact O-N 2.84Å; D128-V131 PolarHBondContact O-N 3.47Å; V131-L133 PolarHBondContact O-N 2.84Å; V131-A134 PolarHBondContact O-N 2.89Å; V131-Q135 HydrophobicContact CG1-CG 4.44Å; V131-Q135 WeakPolarHBondContact O-CB 3.26Å; V131-Q135 VanDerWaalsContact O-CG 3.29Å; V131-Q135 WeakPolarHBondContact O-CG 3.28Å; V131-Q135 PolarHBondContact O-N 3.22Å
132S92.7Very high92.3Very high72 Ų7292.1 Ų92.150%0.50350%0.503SS..Hα-helixtrans-63.9-39.9176.9-179.50000112.6D128 K129 Q135 G136D128-S132 WeakPolarHBondContact O-CB 3.24Å; D128-S132 PolarHBondContact O-N 2.86Å; K129-S132 PolarHBondContact O-N 2.98Å; S132-Q135 PolarHBondContact O-N 3.22Å; S132-G136 PolarHBondContact O-N 2.91Å
133L93.1Very high92.5Very high111 Ų11191.7 Ų91.758%0.58150%0.501SS*.Hα-helixtrans-65.7-40.9174.3-72173.5000111.9K129 V131 G136 A137K129-L133 WeakPolarHBondContact O-CB 3.36Å; K129-L133 VanDerWaalsContact O-CG 3.27Å; K129-L133 WeakPolarHBondContact O-CG 3.28Å; K129-L133 PolarHBondContact O-N 3.08Å; V131-L133 PolarHBondContact O-N 2.84Å; L133-G136 PolarHBondContact O-N 3.44Å; L133-A137 WeakPolarHBondContact O-CB 3.32Å; L133-A137 PolarHBondContact O-N 2.86Å
134A91.6Very high92.7Very high48 Ų4893 Ų9340%0.39751%0.508SS..Hα-helixtrans-64-44.9175.200000111.4Q130 V131 G136 A137 E138Q130-A134 WeakPolarHBondContact O-CB 3.46Å; Q130-A134 PolarHBondContact O-N 3.1Å; V131-A134 PolarHBondContact O-N 2.89Å; A134-G136 PolarHBondContact O-N 2.77Å; A134-A137 WeakPolarHBondContact O-CB 3.4Å; A134-A137 PolarHBondContact O-N 2.91Å; A134-E138 WeakPolarHBondContact O-CG 3.43Å; A134-E138 PolarHBondContact O-N 3.49Å
135Q91.2Very high92.8Very high106 Ų10694.6 Ų94.650%0.49551%0.511SS..Hα-helixtrans-58.9-47.1173.9-75.3172.1-12.200111.5V131 S132 A137 E138 D139V131-Q135 HydrophobicContact CG1-CG 4.44Å; V131-Q135 WeakPolarHBondContact O-CB 3.26Å; V131-Q135 VanDerWaalsContact O-CG 3.29Å; V131-Q135 WeakPolarHBondContact O-CG 3.28Å; V131-Q135 PolarHBondContact O-N 3.22Å; S132-Q135 PolarHBondContact O-N 3.22Å; Q135-A137 VanDerWaalsContact C-N 3.27Å; Q135-A137 PolarHBondContact O-N 3.43Å; Q135-E138 WeakPolarHBondContact O-CB 3.24Å; Q135-E138 PolarHBondContact O-N 3.48Å; Q135-E138 VanDerWaalsContact O-N 3.14Å; Q135-D139 VanDerWaalsContact O-CG 3.31Å; Q135-D139 PolarHBondContact O-N 2.87Å
136G90.8Very high93Very high39 Ų3993.3 Ų93.340%0.40251%0.511SS..Hα-helixtrans-62.4-33.1176.500000113.4S132 L133 A134 L140S132-G136 PolarHBondContact O-N 2.91Å; L133-G136 PolarHBondContact O-N 3.44Å; A134-G136 PolarHBondContact O-N 2.77Å; G136-L140 WeakPolarHBondContact O-CB 3.43Å; G136-L140 PolarHBondContact O-N 2.98Å
137A91.1Very high93.2Very high52 Ų5290.9 Ų90.943%0.4350%0.498SS..Hα-helixtrans-70.6-40.1173.400000112.1L133 A134 Q135 L140 V141L133-A137 WeakPolarHBondContact O-CB 3.32Å; L133-A137 PolarHBondContact O-N 2.86Å; A134-A137 WeakPolarHBondContact O-CB 3.4Å; A134-A137 PolarHBondContact O-N 2.91Å; Q135-A137 VanDerWaalsContact C-N 3.27Å; Q135-A137 PolarHBondContact O-N 3.43Å; A137-L140 PolarHBondContact O-N 3.34Å; A137-V141 WeakPolarHBondContact O-CG2 3.42Å; A137-V141 PolarHBondContact O-N 3.45Å
138E91.5Very high93.2Very high131 Ų13187.7 Ų87.761%0.61249%0.487SS*.Hα-helixtrans-62.7-46.5173.1-72.8178.817700111.2A134 Q135 L140 V141 T142A134-E138 WeakPolarHBondContact O-CG 3.43Å; A134-E138 PolarHBondContact O-N 3.49Å; Q135-E138 WeakPolarHBondContact O-CB 3.24Å; Q135-E138 PolarHBondContact O-N 3.48Å; Q135-E138 VanDerWaalsContact O-N 3.14Å; E138-L140 VanDerWaalsContact C-N 3.33Å; E138-L140 PolarHBondContact O-N 2.92Å; E138-V141 WeakPolarHBondContact O-CB 3.26Å; E138-V141 PolarHBondContact O-N 3.26Å; E138-V141 VanDerWaalsContact O-N 3.1Å; E138-T142 WeakPolarHBondContact O-CG2 3.46Å; E138-T142 PolarHBondContact O-N 2.82Å
139D94.2Very high93.4Very high106 Ų10687.4 Ų87.457%0.56748%0.481SS*.Hα-helixtrans-59.1-42.2175.6-70.2-21.9000111.6Q135 V141 T142 L143Q135-D139 VanDerWaalsContact O-CG 3.31Å; Q135-D139 PolarHBondContact O-N 2.87Å; D139-V141 VanDerWaalsContact C-N 3.32Å; D139-V141 PolarHBondContact O-N 2.9Å; D139-T142 WeakPolarHBondContact CA-OG1 3.35Å; D139-T142 PolarHBondContact O-N 2.86Å; D139-T142 PolarHBondContact O-OG1 3.48Å; D139-L143 WeakPolarHBondContact O-CB 3.26Å; D139-L143 PolarHBondContact O-N 2.84Å
140L93.9Very high93.5Very high90 Ų9085.1 Ų85.147%0.47148%0.475SS..Hα-helixtrans-62.5-40.3175.5-179.265.9000111.8G136 A137 E138 S144 L225G136-L140 WeakPolarHBondContact O-CB 3.43Å; G136-L140 PolarHBondContact O-N 2.98Å; A137-L140 PolarHBondContact O-N 3.34Å; E138-L140 VanDerWaalsContact C-N 3.33Å; E138-L140 PolarHBondContact O-N 2.92Å; L140-S144 VanDerWaalsContact O-CB 3.26Å; L140-S144 WeakPolarHBondContact O-CB 3.48Å; L140-S144 PolarHBondContact O-N 3.26Å; L140-L225 HydrophobicContact CD1-CD1 3.95Å
141V94.5Very high93.8Very high78 Ų7885.8 Ų85.847%0.47347%0.472SS..Hα-helixtrans-66.4-45.2176.4171.90000110.3A137 E138 D139 S144 H145A137-V141 WeakPolarHBondContact O-CG2 3.42Å; A137-V141 PolarHBondContact O-N 3.45Å; E138-V141 WeakPolarHBondContact O-CB 3.26Å; E138-V141 PolarHBondContact O-N 3.26Å; E138-V141 VanDerWaalsContact O-N 3.1Å; D139-V141 VanDerWaalsContact C-N 3.32Å; D139-V141 PolarHBondContact O-N 2.9Å; V141-S144 WeakPolarHBondContact O-CB 3.32Å; V141-S144 PolarHBondContact O-N 3.47Å; V141-H145 VanDerWaalsContact CG1-CE1 3.44Å; V141-H145 WeakPolarHBondContact CG1-CE1 3.22Å; V141-H145 PolarHBondContact O-N 3.45Å; V141-H145 PolarHBondContact O-ND1 2.85Å
142T94.9Very high93.9Very high73 Ų7390.6 Ų90.645%0.44848%0.483SS..Hα-helixtrans-61.5-46.5176.861.50000111.5E138 D139 S144 H145 E146E138-T142 WeakPolarHBondContact O-CG2 3.46Å; E138-T142 PolarHBondContact O-N 2.82Å; D139-T142 WeakPolarHBondContact CA-OG1 3.35Å; D139-T142 PolarHBondContact O-N 2.86Å; D139-T142 PolarHBondContact O-OG1 3.48Å; T142-S144 VanDerWaalsContact C-N 3.31Å; T142-S144 PolarHBondContact O-N 3.38Å; T142-H145 WeakPolarHBondContact O-CB 3.35Å; T142-H145 PolarHBondContact O-N 3.39Å; T142-H145 VanDerWaalsContact O-N 3.08Å; T142-E146 WeakPolarHBondContact O-CG 3.46Å; T142-E146 PolarHBondContact O-N 2.93Å
143L95.4Very high94.1Very high83 Ų8391.5 Ų91.544%0.43548%0.482SS..Hα-helixtrans-61.4-39176.2-172.865.8000111.8D139 H145 E146 M147D139-L143 WeakPolarHBondContact O-CB 3.26Å; D139-L143 PolarHBondContact O-N 2.84Å; L143-H145 VanDerWaalsContact C-N 3.35Å; L143-H145 PolarHBondContact O-N 2.87Å; L143-E146 PolarHBondContact O-N 3.41Å; L143-M147 HydrophobicContact CD1-CE 3.76Å; L143-M147 HydrophobicContact CG-CE 4.3Å; L143-M147 HydrophobicContact CG-CG 4.42Å; L143-M147 WeakPolarHBondContact O-CB 3.42Å; L143-M147 WeakPolarHBondContact O-CG 3.43Å; L143-M147 PolarHBondContact O-N 2.84Å
144S94.6Very high94.2Very high75 Ų7589.9 Ų89.952%0.52447%0.471SS..Hα-helixtrans-62.1-41.4174.1-176.30000112L140 V141 T142 M147 A148L140-S144 VanDerWaalsContact O-CB 3.26Å; L140-S144 WeakPolarHBondContact O-CB 3.48Å; L140-S144 PolarHBondContact O-N 3.26Å; V141-S144 WeakPolarHBondContact O-CB 3.32Å; V141-S144 PolarHBondContact O-N 3.47Å; T142-S144 VanDerWaalsContact C-N 3.31Å; T142-S144 PolarHBondContact O-N 3.38Å; S144-M147 PolarHBondContact O-N 3.48Å; S144-A148 WeakPolarHBondContact O-CB 3.43Å; S144-A148 PolarHBondContact O-N 3.01Å
145H95.1Very high94.3Very high130 Ų13090.1 Ų90.160%0.60247%0.47SS*.Hα-helixtrans-64.5-42.2174.2-74.984.9000111.9V141 T142 L143 A148 H149V141-H145 VanDerWaalsContact CG1-CE1 3.44Å; V141-H145 WeakPolarHBondContact CG1-CE1 3.22Å; V141-H145 PolarHBondContact O-N 3.45Å; V141-H145 PolarHBondContact O-ND1 2.85Å; T142-H145 WeakPolarHBondContact O-CB 3.35Å; T142-H145 PolarHBondContact O-N 3.39Å; T142-H145 VanDerWaalsContact O-N 3.08Å; L143-H145 VanDerWaalsContact C-N 3.35Å; L143-H145 PolarHBondContact O-N 2.87Å; H145-A148 PolarHBondContact O-N 2.89Å; H145-H149 WeakPolarHBondContact O-CB 3.48Å; H145-H149 PolarHBondContact O-N 3.13Å
146E96.3Very high94.5Very high113 Ų11386.3 Ų86.353%0.52846%0.459SS..Hα-helixtrans-63.7-43.6175.5-70.7179.3177.200111.9T142 L143 A148 H149 L150T142-E146 WeakPolarHBondContact O-CG 3.46Å; T142-E146 PolarHBondContact O-N 2.93Å; L143-E146 PolarHBondContact O-N 3.41Å; E146-A148 PolarHBondContact O-N 2.87Å; E146-H149 WeakPolarHBondContact O-CB 3.46Å; E146-H149 PolarHBondContact O-N 3.31Å; E146-L150 WeakPolarHBondContact O-CB 3.45Å; E146-L150 WeakPolarHBondContact O-CG 3.39Å; E146-L150 PolarHBondContact O-N 3.07Å
147M94.1Very high94.7Very high46 Ų4687.7 Ų87.723%0.22746%0.459CS..Hα-helixtrans-64.1-40.7176.1-70.5-66.3159.700111.7L143 S144 H149 L150 R151 L218L143-M147 HydrophobicContact CD1-CE 3.76Å; L143-M147 HydrophobicContact CG-CE 4.3Å; L143-M147 HydrophobicContact CG-CG 4.42Å; L143-M147 WeakPolarHBondContact O-CB 3.42Å; L143-M147 WeakPolarHBondContact O-CG 3.43Å; L143-M147 PolarHBondContact O-N 2.84Å; S144-M147 PolarHBondContact O-N 3.48Å; M147-H149 VanDerWaalsContact C-N 3.34Å; M147-L150 PolarHBondContact O-N 2.94Å; M147-R151 WeakPolarHBondContact O-CB 3.44Å; M147-R151 WeakPolarHBondContact O-CG 3.5Å; M147-R151 PolarHBondContact O-N 2.93Å; M147-L218 HydrophobicContact CE-CD1 4.27Å; M147-L218 HydrophobicContact CE-CD2 3.82Å; M147-L218 HydrophobicContact SD-CD1 3.65Å; M147-L218 HydrophobicContact SD-CD2 4.05Å; M147-L218 HydrophobicContact SD-CG 4.49Å
148A94.5Very high94.8Very high32 Ų3290.6 Ų90.626%0.26446%0.462SS..Hα-helixtrans-64.4-39.3173.900000111.7S144 H145 E146 R152S144-A148 WeakPolarHBondContact O-CB 3.43Å; S144-A148 PolarHBondContact O-N 3.01Å; H145-A148 PolarHBondContact O-N 2.89Å; E146-A148 PolarHBondContact O-N 2.87Å; A148-R152 WeakPolarHBondContact O-CG 3.25Å; A148-R152 PolarHBondContact O-N 3.05Å; A148-R152 VanDerWaalsContact O-N 3.1Å
149H96.6Very high95Very high103 Ų10390 Ų9048%0.47746%0.46SS..Hα-helixtrans-64.6-48.2174.6179.5-103.8000111.9H145 E146 M147 R151 R152 L153H145-H149 WeakPolarHBondContact O-CB 3.48Å; H145-H149 PolarHBondContact O-N 3.13Å; E146-H149 WeakPolarHBondContact O-CB 3.46Å; E146-H149 PolarHBondContact O-N 3.31Å; M147-H149 VanDerWaalsContact C-N 3.34Å; H149-R151 VanDerWaalsContact C-N 3.32Å; H149-R151 PolarHBondContact O-N 3.34Å; H149-R152 PolarHBondContact O-N 2.91Å; H149-R152 VanDerWaalsContact O-N 3.15Å; H149-L153 WeakPolarHBondContact CE1-CD1 3.36Å; H149-L153 PolarHBondContact O-N 3.11Å
150L95.4Very high95Very high98 Ų9891.1 Ų91.151%0.51346%0.461SS..Hα-helixtrans-61.3-38.4176.1-73.1173.9000112.2E146 M147 L153 H154E146-L150 WeakPolarHBondContact O-CB 3.45Å; E146-L150 WeakPolarHBondContact O-CG 3.39Å; E146-L150 PolarHBondContact O-N 3.07Å; M147-L150 PolarHBondContact O-N 2.94Å; L150-L153 PolarHBondContact O-N 3.35Å; L150-H154 VanDerWaalsContact O-CB 3.26Å; L150-H154 WeakPolarHBondContact O-CB 3.45Å; L150-H154 PolarHBondContact O-N 3.34Å
151R95.8Very high95Very high147 Ų14789.7 Ų89.756%0.55545%0.454SS*.Hα-helixtrans-63.2-40.6174.3-76.5172.6-1771722112.2M147 H149 H154 S155M147-R151 WeakPolarHBondContact O-CB 3.44Å; M147-R151 WeakPolarHBondContact O-CG 3.5Å; M147-R151 PolarHBondContact O-N 2.93Å; H149-R151 VanDerWaalsContact C-N 3.32Å; H149-R151 PolarHBondContact O-N 3.34Å; R151-H154 PolarHBondContact O-N 3.13Å; R151-S155 PolarHBondContact O-N 2.96Å; R151-S155 PolarHBondContact O-OG 3.47Å
152R95.5Very high94.9Very high170 Ų17090.6 Ų90.664%0.64245%0.453SS*.Hα-helixtrans-66.8-40.6174.7-71.3-176.9-162.4108.5-1.2112.3A148 H149 H154 S155 G156A148-R152 WeakPolarHBondContact O-CG 3.25Å; A148-R152 PolarHBondContact O-N 3.05Å; A148-R152 VanDerWaalsContact O-N 3.1Å; H149-R152 PolarHBondContact O-N 2.91Å; H149-R152 VanDerWaalsContact O-N 3.15Å; R152-H154 VanDerWaalsContact C-N 3.35Å; R152-S155 WeakPolarHBondContact CA-OG 3.38Å; R152-S155 PolarHBondContact O-N 3.44Å; R152-S155 PolarHBondContact O-OG 2.86Å; R152-G156 PolarHBondContact O-N 3.2Å
153L95.9Very high94.9Very high91 Ų9193.3 Ų93.348%0.47646%0.46SS..Hα-helixtrans-64.5-42.5174.2-70.8-179.8000111.2H149 L150 G156 V157H149-L153 WeakPolarHBondContact CE1-CD1 3.36Å; H149-L153 PolarHBondContact O-N 3.11Å; L150-L153 PolarHBondContact O-N 3.35Å; L153-G156 PolarHBondContact O-N 3.18Å; L153-V157 WeakPolarHBondContact O-CG2 3.42Å; L153-V157 PolarHBondContact O-N 2.93Å
154H94.3Very high94.7Very high76 Ų7691.2 Ų91.235%0.35246%0.455SS..Hα-helixtrans-63.4-41.9177-177.6-81.2000112L150 R151 R152 K158 L211L150-H154 VanDerWaalsContact O-CB 3.26Å; L150-H154 WeakPolarHBondContact O-CB 3.45Å; L150-H154 PolarHBondContact O-N 3.34Å; R151-H154 PolarHBondContact O-N 3.13Å; R152-H154 VanDerWaalsContact C-N 3.35Å; H154-K158 VanDerWaalsContact O-CB 3.32Å; H154-K158 WeakPolarHBondContact O-CB 3.43Å; H154-K158 PolarHBondContact O-N 2.85Å; H154-L211 WeakPolarHBondContact NE2-CD1 3.36Å
155S94.5Very high94.7Very high54 Ų5491.9 Ų91.938%0.37845%0.447SS..Hα-helixtrans-64.3-43.1174.362.90000111.5R151 R152 K158 E159R151-S155 PolarHBondContact O-N 2.96Å; R151-S155 PolarHBondContact O-OG 3.47Å; R152-S155 WeakPolarHBondContact CA-OG 3.38Å; R152-S155 PolarHBondContact O-N 3.44Å; R152-S155 PolarHBondContact O-OG 2.86Å; S155-K158 WeakPolarHBondContact O-CB 3.42Å; S155-K158 PolarHBondContact O-N 3.36Å; S155-E159 WeakPolarHBondContact O-CG 3.37Å; S155-E159 PolarHBondContact O-N 3.28Å
156G95.2Very high94.5Very high25 Ų2589.6 Ų89.626%0.25844%0.439SS..Hα-helixtrans-63.4-42.3177.300000113.5R152 L153 K158 E159 Q160R152-G156 PolarHBondContact O-N 3.2Å; L153-G156 PolarHBondContact O-N 3.18Å; G156-K158 VanDerWaalsContact C-N 3.29Å; G156-K158 PolarHBondContact O-N 3.26Å; G156-E159 PolarHBondContact O-N 3.03Å; G156-Q160 WeakPolarHBondContact O-CG 3.44Å; G156-Q160 PolarHBondContact O-N 3.46Å
157V94.8Very high94.2Very high69 Ų6987.9 Ų87.942%0.41844%0.436SS..Hα-helixtrans-65.5-35174.2171.40000111.1L153 L161L153-V157 WeakPolarHBondContact O-CG2 3.42Å; L153-V157 PolarHBondContact O-N 2.93Å; V157-L161 WeakPolarHBondContact O-CB 3.37Å; V157-L161 PolarHBondContact O-N 2.86Å
158K94.4Very high93.9Very high112 Ų11289.7 Ų89.749%0.48745%0.446SS..Hα-helixtrans-67-44.2176.3-169.3-174.5176.7-159.10111.6H154 S155 G156 L161 E162H154-K158 VanDerWaalsContact O-CB 3.32Å; H154-K158 WeakPolarHBondContact O-CB 3.43Å; H154-K158 PolarHBondContact O-N 2.85Å; S155-K158 WeakPolarHBondContact O-CB 3.42Å; S155-K158 PolarHBondContact O-N 3.36Å; G156-K158 VanDerWaalsContact C-N 3.29Å; G156-K158 PolarHBondContact O-N 3.26Å; K158-L161 WeakPolarHBondContact O-CB 3.25Å; K158-L161 PolarHBondContact O-N 3.41Å; K158-E162 WeakPolarHBondContact CE-OE1 3.45Å; K158-E162 IonicContact NZ-OE1 3.99Å; K158-E162 WeakPolarHBondContact O-CG 3.32Å; K158-E162 PolarHBondContact O-N 3.11Å
159E94.7Very high93.6Very high119 Ų11995.1 Ų95.156%0.55646%0.46SS*.Hα-helixtrans-60.4-44.9174.2-73.8169.5-173.600111.2S155 G156 L161 E162 E163S155-E159 WeakPolarHBondContact O-CG 3.37Å; S155-E159 PolarHBondContact O-N 3.28Å; G156-E159 PolarHBondContact O-N 3.03Å; E159-L161 VanDerWaalsContact C-N 3.29Å; E159-L161 PolarHBondContact O-N 2.94Å; E159-E162 PolarHBondContact O-N 2.62Å; E159-E163 WeakPolarHBondContact O-CG 3.29Å; E159-E163 PolarHBondContact O-N 2.92Å
160Q95Very high93Very high130 Ų13092.3 Ų92.361%0.60745%0.452SS*.Hα-helixtrans-60.6-36.9174.7-73.6176.6-9.800112.9G156 A164G156-Q160 WeakPolarHBondContact O-CG 3.44Å; G156-Q160 PolarHBondContact O-N 3.46Å; Q160-A164 WeakPolarHBondContact O-CB 3.44Å; Q160-A164 PolarHBondContact O-N 2.95Å
161L93.5Very high92.4Very high59 Ų5993 Ų9331%0.30946%0.456SS..Hα-helixtrans-69.8-40.5176.4-175.367.5000111.4V157 K158 E159 A164 Y165V157-L161 WeakPolarHBondContact O-CB 3.37Å; V157-L161 PolarHBondContact O-N 2.86Å; K158-L161 WeakPolarHBondContact O-CB 3.25Å; K158-L161 PolarHBondContact O-N 3.41Å; E159-L161 VanDerWaalsContact C-N 3.29Å; E159-L161 PolarHBondContact O-N 2.94Å; L161-A164 PolarHBondContact O-N 3.39Å; L161-Y165 HydrophobicContact CD1-CD2 4.25Å; L161-Y165 HydrophobicContact CD1-CE2 3.76Å; L161-Y165 HydrophobicContact CD2-CE2 4.04Å; L161-Y165 HydrophobicContact CG-CD2 3.91Å; L161-Y165 HydrophobicContact CG-CE2 3.61Å; L161-Y165 WeakPolarHBondContact O-CD2 3.43Å; L161-Y165 PolarHBondContact O-N 2.88Å
162E93.1Very high91.6Very high97 Ų9791.3 Ų91.345%0.45346%0.457SS..Hα-helixtrans-63.4-43.9174.3-73.4174.5-171.500111.1K158 E159 A164 Y165 D166K158-E162 WeakPolarHBondContact CE-OE1 3.45Å; K158-E162 IonicContact NZ-OE1 3.99Å; K158-E162 WeakPolarHBondContact O-CG 3.32Å; K158-E162 PolarHBondContact O-N 3.11Å; E159-E162 PolarHBondContact O-N 2.62Å; E162-A164 VanDerWaalsContact C-N 3.34Å; E162-A164 PolarHBondContact O-N 3.25Å; E162-Y165 PolarHBondContact O-N 2.87Å; E162-D166 WeakPolarHBondContact O-CB 3.33Å; E162-D166 PolarHBondContact O-N 2.86Å
163E93.8Very high90.7Very high130 Ų13087.1 Ų87.161%0.60745%0.45SS*.Hα-helixtrans-60.5-40.5172.1-73.5-179.3178.600112.3E159 D166 T167E159-E163 WeakPolarHBondContact O-CG 3.29Å; E159-E163 PolarHBondContact O-N 2.92Å; E163-D166 PolarHBondContact O-N 3.31Å; E163-T167 WeakPolarHBondContact O-CB 3.39Å; E163-T167 VanDerWaalsContact O-CG2 3.26Å; E163-T167 WeakPolarHBondContact O-CG2 3.36Å; E163-T167 PolarHBondContact O-N 2.85Å; E163-T167 PolarHBondContact O-OG1 2.93Å
164A92.6Very high89.5Confident39 Ų3989 Ų8932%0.32245%0.454SS..Hα-helixtrans-63.1-43.9174.600000111.5Q160 L161 E162 D166 T167 I168Q160-A164 WeakPolarHBondContact O-CB 3.44Å; Q160-A164 PolarHBondContact O-N 2.95Å; L161-A164 PolarHBondContact O-N 3.39Å; E162-A164 VanDerWaalsContact C-N 3.34Å; E162-A164 PolarHBondContact O-N 3.25Å; A164-D166 PolarHBondContact O-N 2.9Å; A164-T167 WeakPolarHBondContact CA-OG1 3.46Å; A164-T167 PolarHBondContact O-N 3.02Å; A164-T167 PolarHBondContact O-OG1 3.39Å; A164-I168 WeakPolarHBondContact O-CB 3.49Å; A164-I168 WeakPolarHBondContact O-CD1 3.35Å; A164-I168 WeakPolarHBondContact O-CG1 3.44Å; A164-I168 PolarHBondContact O-N 3.47Å
165Y93.2Very high88Confident89 Ų8992.3 Ų92.335%0.34947%0.468SS..Hα-helixtrans-65.2-38.2175.5-80.9-60.5000112.8L161 E162 R169L161-Y165 HydrophobicContact CD1-CD2 4.25Å; L161-Y165 HydrophobicContact CD1-CE2 3.76Å; L161-Y165 HydrophobicContact CD2-CE2 4.04Å; L161-Y165 HydrophobicContact CG-CD2 3.91Å; L161-Y165 HydrophobicContact CG-CE2 3.61Å; L161-Y165 WeakPolarHBondContact O-CD2 3.43Å; L161-Y165 PolarHBondContact O-N 2.88Å; E162-Y165 PolarHBondContact O-N 2.87Å; Y165-R169 WeakPolarHBondContact O-CB 3.4Å; Y165-R169 PolarHBondContact O-N 3.32Å
166D91Very high86.1Confident83 Ų8396.8 Ų96.844%0.44449%0.487SS..Hα-helixtrans-70.8-38.1177.8-75.3-9.2000111.8E162 E163 A164 R169 S170E162-D166 WeakPolarHBondContact O-CB 3.33Å; E162-D166 PolarHBondContact O-N 2.86Å; E163-D166 PolarHBondContact O-N 3.31Å; A164-D166 PolarHBondContact O-N 2.9Å; D166-R169 PolarHBondContact O-N 3.23Å; D166-R169 IonicContact OD1-CZ 3.94Å; D166-R169 IonicContact OD1-NH1 3.17Å; D166-R169 PolarHBondContact OD1-NH1 3.37Å; D166-R169 IonicContact OD1-NH2 3.83Å; D166-R169 PolarHBondContact OD1-NH2 3.05Å; D166-S170 WeakPolarHBondContact O-CB 3.46Å; D166-S170 PolarHBondContact O-N 3.17Å
167T90Very high84Confident76 Ų76101.9 Ų101.947%0.46651%0.509SS..Hα-helixtrans-66.1-44.7173.851.70000111.3E163 A164 R169 S170 L171E163-T167 WeakPolarHBondContact O-CB 3.39Å; E163-T167 VanDerWaalsContact O-CG2 3.26Å; E163-T167 WeakPolarHBondContact O-CG2 3.36Å; E163-T167 PolarHBondContact O-N 2.85Å; E163-T167 PolarHBondContact O-OG1 2.93Å; A164-T167 WeakPolarHBondContact CA-OG1 3.46Å; A164-T167 PolarHBondContact O-N 3.02Å; A164-T167 PolarHBondContact O-OG1 3.39Å; T167-R169 VanDerWaalsContact C-N 3.33Å; T167-R169 PolarHBondContact O-N 3.4Å; T167-S170 PolarHBondContact O-N 3.39Å; T167-S170 PolarHBondContact O-OG 2.89Å; T167-L171 WeakPolarHBondContact O-CB 3.46Å; T167-L171 WeakPolarHBondContact O-CG 3.49Å; T167-L171 PolarHBondContact O-N 3.16Å
168I88.7Confident81.5Confident85 Ų85105.7 Ų105.744%0.43652%0.522SS..Hα-helixtrans-57-47.5172-68.8165.5000110A164 S170 L171 L172A164-I168 WeakPolarHBondContact O-CB 3.49Å; A164-I168 WeakPolarHBondContact O-CD1 3.35Å; A164-I168 WeakPolarHBondContact O-CG1 3.44Å; A164-I168 PolarHBondContact O-N 3.47Å; I168-S170 VanDerWaalsContact C-N 3.35Å; I168-S170 PolarHBondContact O-N 3.45Å; I168-L171 PolarHBondContact O-N 2.89Å; I168-L172 HydrophobicContact CG2-CD1 4.06Å; I168-L172 HydrophobicContact CG2-CG 4.45Å; I168-L172 WeakPolarHBondContact O-CG 3.18Å; I168-L172 PolarHBondContact O-N 2.82Å
169R88.5Confident79Confident145 Ų145105.3 Ų105.355%0.54753%0.529SS..Hα-helixtrans-58.2-44.8175.2-103.4-176.8-89.8119.76112Y165 D166 T167 L171 L172 T173Y165-R169 WeakPolarHBondContact O-CB 3.4Å; Y165-R169 PolarHBondContact O-N 3.32Å; D166-R169 PolarHBondContact O-N 3.23Å; D166-R169 IonicContact OD1-CZ 3.94Å; D166-R169 IonicContact OD1-NH1 3.17Å; D166-R169 PolarHBondContact OD1-NH1 3.37Å; D166-R169 IonicContact OD1-NH2 3.83Å; D166-R169 PolarHBondContact OD1-NH2 3.05Å; T167-R169 VanDerWaalsContact C-N 3.33Å; T167-R169 PolarHBondContact O-N 3.4Å; R169-L171 VanDerWaalsContact C-N 3.34Å; R169-L171 PolarHBondContact O-N 3.3Å; R169-L172 PolarHBondContact O-N 3.12Å; R169-T173 WeakPolarHBondContact O-CG2 3.39Å; R169-T173 PolarHBondContact O-N 2.95Å; R169-T173 PolarHBondContact O-OG1 3.26Å
170S84Confident76.3Confident44 Ų44107.7 Ų107.731%0.30855%0.545SS..Hα-helixtrans-67.3-32.4179.480.20000113.4D166 T167 I168 T173 K174D166-S170 WeakPolarHBondContact O-CB 3.46Å; D166-S170 PolarHBondContact O-N 3.17Å; T167-S170 PolarHBondContact O-N 3.39Å; T167-S170 PolarHBondContact O-OG 2.89Å; I168-S170 VanDerWaalsContact C-N 3.35Å; I168-S170 PolarHBondContact O-N 3.45Å; S170-T173 WeakPolarHBondContact CA-OG1 3.38Å; S170-T173 PolarHBondContact O-OG1 2.84Å; S170-K174 VanDerWaalsContact O-CB 3.32Å; S170-K174 WeakPolarHBondContact O-CB 3.46Å; S170-K174 VanDerWaalsContact O-CG 3.24Å; S170-K174 WeakPolarHBondContact O-CG 3.39Å; S170-K174 PolarHBondContact O-N 2.93Å
171L82.7Confident73.6Confident114 Ų114106.2 Ų106.260%0.59755%0.545SS*.Hα-helixtrans-72.9-39.5175-73172.2000110.7T167 I168 R169 K174 K175T167-L171 WeakPolarHBondContact O-CB 3.46Å; T167-L171 WeakPolarHBondContact O-CG 3.49Å; T167-L171 PolarHBondContact O-N 3.16Å; I168-L171 PolarHBondContact O-N 2.89Å; R169-L171 VanDerWaalsContact C-N 3.34Å; R169-L171 PolarHBondContact O-N 3.3Å; L171-K174 PolarHBondContact O-N 3.35Å; L171-K175 VanDerWaalsContact O-CB 3.25Å; L171-K175 WeakPolarHBondContact O-CB 3.3Å; L171-K175 PolarHBondContact O-N 2.93Å
172L77.9Confident71Confident111 Ų111107.3 Ų107.358%0.58157%0.571SS**Hα-helixtrans-61.6-45.8172.9-71.7171.2000111.2I168 R169 K175 D176I168-L172 HydrophobicContact CG2-CD1 4.06Å; I168-L172 HydrophobicContact CG2-CG 4.45Å; I168-L172 WeakPolarHBondContact O-CG 3.18Å; I168-L172 PolarHBondContact O-N 2.82Å; R169-L172 PolarHBondContact O-N 3.12Å; L172-K175 PolarHBondContact O-N 2.94Å; L172-D176 PolarHBondContact O-N 3.4Å
173T76.9Confident68.6Low81 Ų81108.1 Ų108.150%0.49758%0.582SS.*Hα-helixtrans-66.5-40.3177.257.10000112.3R169 S170 K175 D176 D177R169-T173 WeakPolarHBondContact O-CG2 3.39Å; R169-T173 PolarHBondContact O-N 2.95Å; R169-T173 PolarHBondContact O-OG1 3.26Å; S170-T173 WeakPolarHBondContact CA-OG1 3.38Å; S170-T173 PolarHBondContact O-OG1 2.84Å; T173-K175 VanDerWaalsContact C-N 3.3Å; T173-K175 PolarHBondContact O-N 3.02Å; T173-D176 WeakPolarHBondContact O-CB 3.43Å; T173-D176 PolarHBondContact O-N 3.42Å; T173-D176 VanDerWaalsContact O-N 3.13Å; T173-D177 PolarHBondContact O-N 2.93Å
174K71.8Confident66.5Low131 Ų131110.7 Ų110.757%0.5759%0.594SS**Hα-helixtrans-67.5-30175.9-77.2176.1-179.4176.50112.9S170 L171 D176 H178S170-K174 VanDerWaalsContact O-CB 3.32Å; S170-K174 WeakPolarHBondContact O-CB 3.46Å; S170-K174 VanDerWaalsContact O-CG 3.24Å; S170-K174 WeakPolarHBondContact O-CG 3.39Å; S170-K174 PolarHBondContact O-N 2.93Å; L171-K174 PolarHBondContact O-N 3.35Å; K174-D176 VanDerWaalsContact C-N 3.3Å; K174-H178 PolarHBondContact O-N 2.98Å
175K62.1Low64.5Low145 Ų145113 Ų11363%0.6360%0.6SS**Hα-helixtrans-73.4-25.7172.9-163.7177.9-178.6-177.30111.5L171 L172 T173 H178L171-K175 VanDerWaalsContact O-CB 3.25Å; L171-K175 WeakPolarHBondContact O-CB 3.3Å; L171-K175 PolarHBondContact O-N 2.93Å; L172-K175 PolarHBondContact O-N 2.94Å; T173-K175 VanDerWaalsContact C-N 3.3Å; T173-K175 PolarHBondContact O-N 3.02Å; K175-H178 CarbonylContact O-C 3.57Å
176D54Low63.1Low148 Ų148114.1 Ų114.179%0.79161%0.612SS**Hα-helixtrans-76-36.8171.5-13017.3000111.6L172 T173 K174L172-D176 PolarHBondContact O-N 3.4Å; T173-D176 WeakPolarHBondContact O-CB 3.43Å; T173-D176 PolarHBondContact O-N 3.42Å; T173-D176 VanDerWaalsContact O-N 3.13Å; K174-D176 VanDerWaalsContact C-N 3.3Å
177D51.4Low62.1Low133 Ų133116 Ų11671%0.71162%0.622SS**Hα-helixtrans-76.1-25.6177.3-73.3-25.3000113.4T173T173-D177 PolarHBondContact O-N 2.93Å
178H42.4Very low61.3Low148 Ų148116.6 Ų116.669%0.68563%0.626SS**SBendtrans-119.4111.8177.1-80.3-53.5000111.2K174 K175K174-H178 PolarHBondContact O-N 2.98Å; K175-H178 CarbonylContact O-C 3.57Å
179V42.6Very low60.8Low105 Ų105115.7 Ų115.764%0.63662%0.624SS**  trans115.470.6156.9-169.30000113.4V181V179-V181 HydrophobicContact CG1-CB 3.59Å; V179-V181 HydrophobicContact CG1-CG2 4.12Å; V179-V181 VanDerWaalsContact CG1-N 3.3Å; V179-V181 WeakPolarHBondContact CG1-O 3.31Å; V179-V181 PolarHBondContact O-N 3.44Å
180D37.3Very low60.4Low168 Ų168113.3 Ų113.390%0.89862%0.62SS**  -52.970127.2-179.334.3000110.4
181V38.1Very low60.3Low100 Ų100115.5 Ų115.561%0.60663%0.628SS**SBendtrans-155.6104.3154.7-1760000105.3V179 V183V179-V181 HydrophobicContact CG1-CB 3.59Å; V179-V181 HydrophobicContact CG1-CG2 4.12Å; V179-V181 VanDerWaalsContact CG1-N 3.3Å; V179-V181 WeakPolarHBondContact CG1-O 3.31Å; V179-V181 PolarHBondContact O-N 3.44Å; V181-V183 PolarHBondContact O-N 3.25Å
182G39.8Very low60.3Low82 Ų82116.1 Ų116.185%0.84563%0.628SS**  trans-55.497.9175.600000111.2
183V42.3Very low60.6Low114 Ų114116.7 Ų116.769%0.69163%0.627SS**  trans-95.9110.8157.9-178.80000105.1V181 I185V181-V183 PolarHBondContact O-N 3.25Å; V183-I185 PolarHBondContact O-N 3.02Å
184Q48.8Very low61.1Low183 Ų183116.7 Ų116.786%0.85562%0.623SS**  trans-54.4101.6172.6-68.2170.6-37.700108.1
185I52Low61.8Low89 Ų89115.1 Ų115.146%0.45662%0.618SS.*  trans-87112.7166.8-65.1173.3000104.4V183 D187 T189V183-I185 PolarHBondContact O-N 3.02Å; I185-D187 PolarHBondContact O-N 3.33Å; I185-T189 VanDerWaalsContact CG2-OG1 3.26Å; I185-T189 WeakPolarHBondContact CG2-OG1 3.3Å
186D62.6Low63Low112 Ų112110.2 Ų110.260%0.59960%0.604SS**  trans-52.3130.6-177.3-70.4-35.6000111.1T188 T189 M190D186-T188 PolarHBondContact O-N 3.43Å; D186-T189 PolarHBondContact O-N 3.25Å; D186-T189 PolarHBondContact O-OG1 3.06Å; D186-M190 PolarHBondContact O-N 2.84Å
187D70.8Confident64.8Low123 Ų123106.9 Ų106.966%0.65859%0.586SS**Hα-helixtrans-50.2-28.4-177.1-67.3-29.3000112.9I185 M190 I191I185-D187 PolarHBondContact O-N 3.33Å; D187-M190 PolarHBondContact O-N 2.93Å; D187-I191 WeakPolarHBondContact O-CD1 3.44Å; D187-I191 WeakPolarHBondContact O-CG1 3.38Å; D187-I191 PolarHBondContact O-N 3.48Å
188T73.5Confident66.6Low88 Ų88106 Ų10654%0.5458%0.578SS.*Hα-helixtrans-64-46.517750.90000112.7D186 M190 I191 E192D186-T188 PolarHBondContact O-N 3.43Å; T188-M190 VanDerWaalsContact C-N 3.29Å; T188-M190 PolarHBondContact O-N 2.87Å; T188-I191 PolarHBondContact O-N 3.48Å; T188-E192 WeakPolarHBondContact O-CG 3.27Å; T188-E192 PolarHBondContact O-N 3.32Å
189T77.8Confident68.8Low65 Ų65104.8 Ų104.840%0.39957%0.572SS.*Hα-helixtrans-67.9-31178.363.10000112.1I185 D186 H193I185-T189 VanDerWaalsContact CG2-OG1 3.26Å; I185-T189 WeakPolarHBondContact CG2-OG1 3.3Å; D186-T189 PolarHBondContact O-N 3.25Å; D186-T189 PolarHBondContact O-OG1 3.06Å; T189-H193 WeakPolarHBondContact O-CB 3.47Å; T189-H193 PolarHBondContact O-N 3.48Å
190M79.3Confident71.1Confident96 Ų96105.9 Ų105.947%0.47357%0.57SS.*Hα-helixtrans-69.5-43.8174.8-169.5-177.9-57.600111.2D186 D187 T188 H193 I194D186-M190 PolarHBondContact O-N 2.84Å; D187-M190 PolarHBondContact O-N 2.93Å; T188-M190 VanDerWaalsContact C-N 3.29Å; T188-M190 PolarHBondContact O-N 2.87Å; M190-H193 PolarHBondContact O-N 3.29Å; M190-I194 HydrophobicContact CG-CD1 3.99Å; M190-I194 WeakPolarHBondContact O-CB 3.41Å; M190-I194 VanDerWaalsContact O-CG1 3.23Å; M190-I194 WeakPolarHBondContact O-CG1 3.34Å; M190-I194 PolarHBondContact O-N 3.42Å
191I81.9Confident73.8Confident90 Ų90102 Ų10246%0.46255%0.549SS..Hα-helixtrans-62-45.9175.4-68.2163.4000110.5D187 T188 H193 I194 Q195D187-I191 WeakPolarHBondContact O-CD1 3.44Å; D187-I191 WeakPolarHBondContact O-CG1 3.38Å; D187-I191 PolarHBondContact O-N 3.48Å; T188-I191 PolarHBondContact O-N 3.48Å; I191-H193 VanDerWaalsContact C-N 3.34Å; I191-H193 PolarHBondContact O-N 2.95Å; I191-I194 PolarHBondContact O-N 2.78Å; I191-Q195 HydrophobicContact CG2-CG 4.34Å; I191-Q195 WeakPolarHBondContact O-CB 3.43Å; I191-Q195 WeakPolarHBondContact O-CG 3.2Å; I191-Q195 PolarHBondContact O-N 3.32Å
192E82.8Confident76.4Confident127 Ų127101.7 Ų101.759%0.59355%0.547SS*.Hα-helixtrans-60.3-41.7177.2-74.2174.3-179.700112T188 Q195 A196T188-E192 WeakPolarHBondContact O-CG 3.27Å; T188-E192 PolarHBondContact O-N 3.32Å; E192-Q195 PolarHBondContact O-N 3.48Å; E192-A196 WeakPolarHBondContact O-CB 2.8Å; E192-A196 PolarHBondContact O-N 2.76Å
193H83.8Confident78.8Confident122 Ų122104.1 Ų104.157%0.56554%0.536SS*.Hα-helixtrans-68.9-38.7177-165.763.6000112.5T189 M190 I191 A196 L197T189-H193 WeakPolarHBondContact O-CB 3.47Å; T189-H193 PolarHBondContact O-N 3.48Å; M190-H193 PolarHBondContact O-N 3.29Å; I191-H193 VanDerWaalsContact C-N 3.34Å; I191-H193 PolarHBondContact O-N 2.95Å; H193-A196 PolarHBondContact O-N 2.94Å; H193-L197 WeakPolarHBondContact O-CB 3.32Å; H193-L197 VanDerWaalsContact O-CG 3.3Å; H193-L197 WeakPolarHBondContact O-CG 3.3Å; H193-L197 PolarHBondContact O-N 2.84Å
194I87.5Confident81.2Confident81 Ų8199.9 Ų99.942%0.41551%0.512SS..Hα-helixtrans-63.5-43.4173.9-70.2166.1000110.4M190 I191 L197 Q198M190-I194 HydrophobicContact CG-CD1 3.99Å; M190-I194 WeakPolarHBondContact O-CB 3.41Å; M190-I194 VanDerWaalsContact O-CG1 3.23Å; M190-I194 WeakPolarHBondContact O-CG1 3.34Å; M190-I194 PolarHBondContact O-N 3.42Å; I191-I194 PolarHBondContact O-N 2.78Å; I194-L197 PolarHBondContact O-N 3.38Å; I194-Q198 HydrophobicContact CG2-CG 4.36Å; I194-Q198 WeakPolarHBondContact O-CB 3.24Å; I194-Q198 VanDerWaalsContact O-CG 3.23Å; I194-Q198 WeakPolarHBondContact O-CG 3.36Å; I194-Q198 PolarHBondContact O-N 2.94Å
195Q87.2Confident83.2Confident98 Ų9896 Ų9646%0.45849%0.494SS..Hα-helixtrans-63.9-45.2177.1-74.8175.7-6.200111.4I191 E192 L197 Q198 E199I191-Q195 HydrophobicContact CG2-CG 4.34Å; I191-Q195 WeakPolarHBondContact O-CB 3.43Å; I191-Q195 WeakPolarHBondContact O-CG 3.2Å; I191-Q195 PolarHBondContact O-N 3.32Å; E192-Q195 PolarHBondContact O-N 3.48Å; Q195-L197 PolarHBondContact O-N 3.21Å; Q195-Q198 PolarHBondContact O-N 2.86Å; Q195-E199 WeakPolarHBondContact O-CB 3.4Å; Q195-E199 WeakPolarHBondContact O-CG 3.35Å; Q195-E199 PolarHBondContact O-N 3.45Å
196A87.4Confident85.1Confident42 Ų4293.5 Ų93.535%0.34749%0.49SS..Hα-helixtrans-60.2-43.4175.500000112.1E192 H193 E199 E200E192-A196 WeakPolarHBondContact O-CB 2.8Å; E192-A196 PolarHBondContact O-N 2.76Å; H193-A196 PolarHBondContact O-N 2.94Å; A196-E199 PolarHBondContact O-N 3.39Å; A196-E200 WeakPolarHBondContact O-CB 3.26Å; A196-E200 WeakPolarHBondContact O-CG 3.48Å; A196-E200 PolarHBondContact O-N 3.43Å
197L91.1Very high86.5Confident79 Ų7993.4 Ų93.441%0.41448%0.481SS..Hα-helixtrans-66.3-36.9175.6-73.3173.4000112.6H193 I194 Q195 L201H193-L197 WeakPolarHBondContact O-CB 3.32Å; H193-L197 VanDerWaalsContact O-CG 3.3Å; H193-L197 WeakPolarHBondContact O-CG 3.3Å; H193-L197 PolarHBondContact O-N 2.84Å; I194-L197 PolarHBondContact O-N 3.38Å; Q195-L197 PolarHBondContact O-N 3.21Å; L197-L201 VanDerWaalsContact O-CB 3.28Å; L197-L201 WeakPolarHBondContact O-CB 3.27Å; L197-L201 PolarHBondContact O-N 3.45Å
198Q89.8Confident87.6Confident115 Ų11593.4 Ų93.454%0.53748%0.477SS..Hα-helixtrans-66-43.6174.4-76.8173.2-13.900111.3I194 Q195 L201 V202I194-Q198 HydrophobicContact CG2-CG 4.36Å; I194-Q198 WeakPolarHBondContact O-CB 3.24Å; I194-Q198 VanDerWaalsContact O-CG 3.23Å; I194-Q198 WeakPolarHBondContact O-CG 3.36Å; I194-Q198 PolarHBondContact O-N 2.94Å; Q195-Q198 PolarHBondContact O-N 2.86Å; Q198-L201 PolarHBondContact O-N 3.13Å; Q198-V202 VanDerWaalsContact O-CG2 3.31Å; Q198-V202 WeakPolarHBondContact O-CG2 3.47Å; Q198-V202 PolarHBondContact O-N 3.46Å
199E89.3Confident88.4Confident122 Ų12293.6 Ų93.657%0.5748%0.479SS*.Hα-helixtrans-62.5-47.9174.7-74.1179.2-172.800111Q195 A196 L201 V202 H203Q195-E199 WeakPolarHBondContact O-CB 3.4Å; Q195-E199 WeakPolarHBondContact O-CG 3.35Å; Q195-E199 PolarHBondContact O-N 3.45Å; A196-E199 PolarHBondContact O-N 3.39Å; E199-L201 VanDerWaalsContact C-N 3.3Å; E199-L201 PolarHBondContact O-N 3.29Å; E199-V202 PolarHBondContact O-N 3.37Å; E199-H203 WeakPolarHBondContact O-CB 3.34Å; E199-H203 PolarHBondContact O-N 2.97Å; E199-H203 PolarHBondContact O-ND1 3.5Å
200E91.1Very high89.1Confident128 Ų12893.4 Ų93.460%0.59848%0.48SS*.Hα-helixtrans-60.6-38.2175.9-76.2-173.9174.600112.2A196 H203 S204A196-E200 WeakPolarHBondContact O-CB 3.26Å; A196-E200 WeakPolarHBondContact O-CG 3.48Å; A196-E200 PolarHBondContact O-N 3.43Å; E200-H203 PolarHBondContact O-N 2.96Å; E200-S204 WeakPolarHBondContact O-CB 3.5Å; E200-S204 PolarHBondContact O-N 2.92Å
201L92.2Very high89.8Confident87 Ų8791 Ų9146%0.45547%0.469SS..Hα-helixtrans-64-45.2174.9-176.267.7000111.4L197 Q198 E199 S204 Q205L197-L201 VanDerWaalsContact O-CB 3.28Å; L197-L201 WeakPolarHBondContact O-CB 3.27Å; L197-L201 PolarHBondContact O-N 3.45Å; Q198-L201 PolarHBondContact O-N 3.13Å; E199-L201 VanDerWaalsContact C-N 3.3Å; E199-L201 PolarHBondContact O-N 3.29Å; L201-S204 PolarHBondContact O-N 3.03Å; L201-Q205 WeakPolarHBondContact O-CB 3.27Å; L201-Q205 VanDerWaalsContact O-CG 3.26Å; L201-Q205 WeakPolarHBondContact O-CG 3.36Å; L201-Q205 PolarHBondContact O-N 2.96Å
202V93Very high90.4Very high92 Ų9294.5 Ų94.556%0.55848%0.476SS*.Hα-helixtrans-63.8-44.3177170.50000111Q198 E199 Q205 G206Q198-V202 VanDerWaalsContact O-CG2 3.31Å; Q198-V202 WeakPolarHBondContact O-CG2 3.47Å; Q198-V202 PolarHBondContact O-N 3.46Å; E199-V202 PolarHBondContact O-N 3.37Å; V202-Q205 PolarHBondContact O-N 3.07Å; V202-G206 PolarHBondContact O-N 2.98Å
203H91.1Very high90.8Very high133 Ų13390.8 Ų90.862%0.61646%0.464SS*.Hα-helixtrans-64.4-40.4176-73.590.6000111.7E199 E200 G206 R207E199-H203 WeakPolarHBondContact O-CB 3.34Å; E199-H203 PolarHBondContact O-N 2.97Å; E199-H203 PolarHBondContact O-ND1 3.5Å; E200-H203 PolarHBondContact O-N 2.96Å; H203-G206 PolarHBondContact O-N 3.17Å; H203-R207 WeakPolarHBondContact O-CB 3.35Å; H203-R207 PolarHBondContact O-N 2.92Å
204S91.6Very high91.4Very high26 Ų2688.9 Ų88.918%0.18246%0.458CS..Hα-helixtrans-64.1-45.8176.5-172.90000111.4E200 L201 R207 E208E200-S204 WeakPolarHBondContact O-CB 3.5Å; E200-S204 PolarHBondContact O-N 2.92Å; L201-S204 PolarHBondContact O-N 3.03Å; S204-R207 PolarHBondContact O-N 3.32Å; S204-E208 WeakPolarHBondContact O-CB 3.42Å; S204-E208 PolarHBondContact O-N 2.92Å
205Q92.1Very high91.7Very high101 Ų10188.9 Ų88.947%0.47246%0.462SS..Hα-helixtrans-63.4-40.2174-73.2176.6-7.900112.2L201 V202 E208 T209L201-Q205 WeakPolarHBondContact O-CB 3.27Å; L201-Q205 VanDerWaalsContact O-CG 3.26Å; L201-Q205 WeakPolarHBondContact O-CG 3.36Å; L201-Q205 PolarHBondContact O-N 2.96Å; V202-Q205 PolarHBondContact O-N 3.07Å; Q205-E208 PolarHBondContact O-N 3.39Å; Q205-T209 WeakPolarHBondContact O-CB 3.48Å; Q205-T209 VanDerWaalsContact O-CG2 3.27Å; Q205-T209 WeakPolarHBondContact O-CG2 3.37Å; Q205-T209 PolarHBondContact O-N 2.94Å; Q205-T209 PolarHBondContact O-OG1 3.38Å
206G90.8Very high92.1Very high37 Ų3789.1 Ų89.138%0.38146%0.461SS..Hα-helixtrans-62.5-42.6173.900000112.6V202 H203 T209 S210V202-G206 PolarHBondContact O-N 2.98Å; H203-G206 PolarHBondContact O-N 3.17Å; G206-T209 WeakPolarHBondContact CA-OG1 3.41Å; G206-T209 PolarHBondContact O-OG1 2.85Å; G206-S210 WeakPolarHBondContact O-CB 3.44Å; G206-S210 PolarHBondContact O-N 2.89Å
207R93.4Very high92.4Very high110 Ų11091 Ų9142%0.41547%0.465SS..Hα-helixtrans-67.3-42.5175.9-164.1-173.468.587.92.8111.6H203 S204 S210 L211H203-R207 WeakPolarHBondContact O-CB 3.35Å; H203-R207 PolarHBondContact O-N 2.92Å; S204-R207 PolarHBondContact O-N 3.32Å; R207-S210 PolarHBondContact O-N 3.44Å; R207-L211 HydrophobicContact CG-CD1 4.07Å; R207-L211 WeakPolarHBondContact O-CB 3.29Å; R207-L211 WeakPolarHBondContact O-CD1 3.32Å; R207-L211 WeakPolarHBondContact O-CG 3.43Å; R207-L211 PolarHBondContact O-N 3.37Å
208E92.1Very high92.6Very high123 Ų12390.4 Ų90.458%0.57546%0.462SS*.Hα-helixtrans-63.7-44.6177.3-173.2-178176.100111.6S204 Q205 S210 L211 R212S204-E208 WeakPolarHBondContact O-CB 3.42Å; S204-E208 PolarHBondContact O-N 2.92Å; Q205-E208 PolarHBondContact O-N 3.39Å; E208-S210 PolarHBondContact O-N 3.2Å; E208-L211 PolarHBondContact O-N 2.95Å; E208-R212 WeakPolarHBondContact O-CB 3.35Å; E208-R212 PolarHBondContact O-N 2.92Å
209T90.7Very high92.8Very high92 Ų9287.3 Ų87.356%0.56445%0.453SS*.Hα-helixtrans-62.9-41.5176.749.90000112Q205 G206 R212 S213Q205-T209 WeakPolarHBondContact O-CB 3.48Å; Q205-T209 VanDerWaalsContact O-CG2 3.27Å; Q205-T209 WeakPolarHBondContact O-CG2 3.37Å; Q205-T209 PolarHBondContact O-N 2.94Å; Q205-T209 PolarHBondContact O-OG1 3.38Å; G206-T209 WeakPolarHBondContact CA-OG1 3.41Å; G206-T209 PolarHBondContact O-OG1 2.85Å; T209-R212 PolarHBondContact O-N 3.14Å; T209-S213 PolarHBondContact O-N 3.02Å; T209-S213 PolarHBondContact O-OG 2.91Å
210S92.9Very high93.1Very high60 Ų6088.8 Ų88.842%0.4245%0.454SS..Hα-helixtrans-64.5-42.5174.6-178.70000112.9G206 R207 E208 R212 S213 N214G206-S210 WeakPolarHBondContact O-CB 3.44Å; G206-S210 PolarHBondContact O-N 2.89Å; R207-S210 PolarHBondContact O-N 3.44Å; E208-S210 PolarHBondContact O-N 3.2Å; S210-R212 VanDerWaalsContact C-N 3.34Å; S210-R212 PolarHBondContact O-N 3.27Å; S210-S213 PolarHBondContact O-N 2.93Å; S210-S213 PolarHBondContact O-OG 3.24Å; S210-N214 WeakPolarHBondContact O-CB 3.48Å; S210-N214 PolarHBondContact O-N 3.49Å; S210-N214 PolarHBondContact O-ND2 2.87Å; S210-N214 PolarHBondContact O-OD1 3.44Å
211L93.7Very high93.3Very high47 Ų4789.4 Ų89.425%0.24645%0.45CS..Hα-helixtrans-66.8-38.1175.5-74.3162.3000111.6H154 R207 E208 N214 V215H154-L211 WeakPolarHBondContact NE2-CD1 3.36Å; R207-L211 HydrophobicContact CG-CD1 4.07Å; R207-L211 WeakPolarHBondContact O-CB 3.29Å; R207-L211 WeakPolarHBondContact O-CD1 3.32Å; R207-L211 WeakPolarHBondContact O-CG 3.43Å; R207-L211 PolarHBondContact O-N 3.37Å; E208-L211 PolarHBondContact O-N 2.95Å; L211-N214 PolarHBondContact O-N 3.45Å; L211-V215 WeakPolarHBondContact O-CB 3.48Å; L211-V215 VanDerWaalsContact O-CG2 3.27Å; L211-V215 WeakPolarHBondContact O-CG2 3.35Å; L211-V215 PolarHBondContact O-N 2.84Å
212R94.6Very high93.4Very high162 Ų16288.3 Ų88.361%0.61145%0.447SS*.Hα-helixtrans-67-34.8176.7-166.6174.4-174-116.33.7112.1E208 T209 S210 K216E208-R212 WeakPolarHBondContact O-CB 3.35Å; E208-R212 PolarHBondContact O-N 2.92Å; T209-R212 PolarHBondContact O-N 3.14Å; S210-R212 VanDerWaalsContact C-N 3.34Å; S210-R212 PolarHBondContact O-N 3.27Å; R212-K216 VanDerWaalsContact O-CG 3.31Å; R212-K216 WeakPolarHBondContact O-CG 3.29Å; R212-K216 PolarHBondContact O-N 3.24Å
213S91.8Very high93.4Very high50 Ų5088.4 Ų88.435%0.3545%0.445SS..Hα-helixtrans-68.9-46.8171.358.20000111.4T209 S210 V215 K216 D217T209-S213 PolarHBondContact O-N 3.02Å; T209-S213 PolarHBondContact O-OG 2.91Å; S210-S213 PolarHBondContact O-N 2.93Å; S210-S213 PolarHBondContact O-OG 3.24Å; S213-V215 VanDerWaalsContact C-N 3.32Å; S213-V215 PolarHBondContact O-N 3.32Å; S213-K216 WeakPolarHBondContact O-CB 3.3Å; S213-K216 PolarHBondContact O-N 3.27Å; S213-D217 PolarHBondContact O-N 3.47Å
214N95.6Very high93.5Very high81 Ų8186.8 Ų86.843%0.43344%0.438SS..Hα-helixtrans-60-40.7179-67.6-14000112.4S210 L211 D217 L218S210-N214 WeakPolarHBondContact O-CB 3.48Å; S210-N214 PolarHBondContact O-N 3.49Å; S210-N214 PolarHBondContact O-ND2 2.87Å; S210-N214 PolarHBondContact O-OD1 3.44Å; L211-N214 PolarHBondContact O-N 3.45Å; N214-D217 PolarHBondContact O-N 3.47Å; N214-L218 WeakPolarHBondContact O-CB 3.19Å; N214-L218 WeakPolarHBondContact O-CG 3.24Å; N214-L218 PolarHBondContact O-N 3.23Å
215V94.8Very high93.5Very high81 Ų8188.9 Ų88.949%0.49145%0.446SS..Hα-helixtrans-63.6-41.1175169.20000111.2L211 S213 S219L211-V215 WeakPolarHBondContact O-CB 3.48Å; L211-V215 VanDerWaalsContact O-CG2 3.27Å; L211-V215 WeakPolarHBondContact O-CG2 3.35Å; L211-V215 PolarHBondContact O-N 2.84Å; S213-V215 VanDerWaalsContact C-N 3.32Å; S213-V215 PolarHBondContact O-N 3.32Å; V215-S219 WeakPolarHBondContact O-CB 3.24Å; V215-S219 PolarHBondContact O-N 2.91Å; V215-S219 PolarHBondContact O-OG 3.17Å; V215-S219 VanDerWaalsContact O-OG 3.07Å
216K94.4Very high93.5Very high104 Ų10488.8 Ų88.845%0.45245%0.446SS..Hα-helixtrans-63.1-42.1176-76174.5179.6-177.20111.8R212 S213 S219 R220R212-K216 VanDerWaalsContact O-CG 3.31Å; R212-K216 WeakPolarHBondContact O-CG 3.29Å; R212-K216 PolarHBondContact O-N 3.24Å; S213-K216 WeakPolarHBondContact O-CB 3.3Å; S213-K216 PolarHBondContact O-N 3.27Å; K216-S219 PolarHBondContact O-N 3.4Å; K216-R220 WeakPolarHBondContact O-CG 3.43Å; K216-R220 PolarHBondContact O-N 2.78Å
217D94Very high93.3Very high81 Ų8190 Ų9043%0.43345%0.446SS..Hα-helixtrans-70.8-39.8-179.2-65.7-27.6000111.7S213 N214 R220 R221S213-D217 PolarHBondContact O-N 3.47Å; N214-D217 PolarHBondContact O-N 3.47Å; D217-R220 PolarHBondContact O-N 3.27Å; D217-R220 IonicContact OD1-NH1 3.2Å; D217-R220 PolarHBondContact OD1-NH1 3.27Å; D217-R221 WeakPolarHBondContact O-CB 3.2Å; D217-R221 PolarHBondContact O-N 2.86Å
218L95.2Very high92.8Very high67 Ų6786.9 Ų86.935%0.35144%0.444SS..Hα-helixtrans-64.2-41.3172.1-72.7171.4000112.1M147 N214 R221 V222M147-L218 HydrophobicContact CE-CD1 4.27Å; M147-L218 HydrophobicContact CE-CD2 3.82Å; M147-L218 HydrophobicContact SD-CD1 3.65Å; M147-L218 HydrophobicContact SD-CD2 4.05Å; M147-L218 HydrophobicContact SD-CG 4.49Å; N214-L218 WeakPolarHBondContact O-CB 3.19Å; N214-L218 WeakPolarHBondContact O-CG 3.24Å; N214-L218 PolarHBondContact O-N 3.23Å; L218-R221 PolarHBondContact O-N 3.44Å; L218-V222 WeakPolarHBondContact O-CG2 3.28Å; L218-V222 PolarHBondContact O-N 2.89Å
219S95.4Very high92.3Very high50 Ų5088.7 Ų88.735%0.3545%0.447SS..Hα-helixtrans-63-43.8175.2-68.50000111.8V215 K216 R221 V222 D223V215-S219 WeakPolarHBondContact O-CB 3.24Å; V215-S219 PolarHBondContact O-N 2.91Å; V215-S219 PolarHBondContact O-OG 3.17Å; V215-S219 VanDerWaalsContact O-OG 3.07Å; K216-S219 PolarHBondContact O-N 3.4Å; S219-R221 VanDerWaalsContact C-N 3.31Å; S219-R221 PolarHBondContact O-N 3.43Å; S219-V222 PolarHBondContact O-N 3.27Å; S219-D223 PolarHBondContact O-N 3.4Å
220R94.6Very high92Very high153 Ų15389.8 Ų89.858%0.57744%0.443SS*.Hα-helixtrans-58.4-43.3173.1-75.4169.9177.5167.6-8.7111.7K216 D217 V222 D223 E224K216-R220 WeakPolarHBondContact O-CG 3.43Å; K216-R220 PolarHBondContact O-N 2.78Å; D217-R220 PolarHBondContact O-N 3.27Å; D217-R220 IonicContact OD1-NH1 3.2Å; D217-R220 PolarHBondContact OD1-NH1 3.27Å; R220-V222 VanDerWaalsContact C-N 3.33Å; R220-V222 PolarHBondContact O-N 3.45Å; R220-D223 PolarHBondContact O-N 2.9Å; R220-E224 WeakPolarHBondContact O-CG 3.47Å; R220-E224 PolarHBondContact O-N 3.01Å
221R96Very high91.2Very high140 Ų14095 Ų9553%0.52845%0.454SS..Hα-helixtrans-65.2-37.5178.4-171.957.2173.3169.11.1112.3D217 L218 S219 E224 L225D217-R221 WeakPolarHBondContact O-CB 3.2Å; D217-R221 PolarHBondContact O-N 2.86Å; L218-R221 PolarHBondContact O-N 3.44Å; S219-R221 VanDerWaalsContact C-N 3.31Å; S219-R221 PolarHBondContact O-N 3.43Å; R221-E224 IonicContact CZ-OE2 3.25Å; R221-E224 IonicContact NH1-OE2 3.31Å; R221-E224 PolarHBondContact NH1-OE2 3.31Å; R221-L225 HydrophobicContact CG-CD1 4.37Å; R221-L225 WeakPolarHBondContact O-CB 3.3Å; R221-L225 VanDerWaalsContact O-CG 3.27Å; R221-L225 WeakPolarHBondContact O-CG 3.38Å; R221-L225 PolarHBondContact O-N 2.87Å
222V94.7Very high90.2Very high64 Ų6498.7 Ų98.739%0.38847%0.473SS..Hα-helixtrans-64.5-46.1172.8170.60000110.4L218 S219 R220 E224 L225 E226L218-V222 WeakPolarHBondContact O-CG2 3.28Å; L218-V222 PolarHBondContact O-N 2.89Å; S219-V222 PolarHBondContact O-N 3.27Å; R220-V222 VanDerWaalsContact C-N 3.33Å; R220-V222 PolarHBondContact O-N 3.45Å; V222-E224 VanDerWaalsContact C-N 3.35Å; V222-E224 PolarHBondContact O-N 2.9Å; V222-L225 PolarHBondContact O-N 3.21Å; V222-L225 VanDerWaalsContact O-N 3.16Å; V222-E226 HydrophobicContact CG1-CG 4.26Å; V222-E226 WeakPolarHBondContact O-CB 3.33Å; V222-E226 WeakPolarHBondContact O-CG 3.48Å; V222-E226 PolarHBondContact O-N 3.18Å
223D93.2Very high89.2Confident95 Ų9598.9 Ų98.951%0.50848%0.478SS..Hα-helixtrans-61.8-40.4177.1-68-28.8000112.1S219 R220 E226 T227S219-D223 PolarHBondContact O-N 3.4Å; R220-D223 PolarHBondContact O-N 2.9Å; D223-E226 PolarHBondContact O-N 3.47Å; D223-T227 WeakPolarHBondContact O-CB 3.39Å; D223-T227 VanDerWaalsContact O-CG2 3.25Å; D223-T227 WeakPolarHBondContact O-CG2 3.42Å; D223-T227 PolarHBondContact O-N 2.94Å; D223-T227 PolarHBondContact O-OG1 3.08Å
224E93Very high87.8Confident99 Ų99103.7 Ų103.746%0.46350%0.496SS..Hα-helixtrans-60.7-44172.6-76.4172.3-168.300112.2R220 R221 V222 T227 A228R220-E224 WeakPolarHBondContact O-CG 3.47Å; R220-E224 PolarHBondContact O-N 3.01Å; R221-E224 IonicContact CZ-OE2 3.25Å; R221-E224 IonicContact NH1-OE2 3.31Å; R221-E224 PolarHBondContact NH1-OE2 3.31Å; V222-E224 VanDerWaalsContact C-N 3.35Å; V222-E224 PolarHBondContact O-N 2.9Å; E224-T227 WeakPolarHBondContact CA-OG1 3.39Å; E224-T227 PolarHBondContact O-OG1 3.2Å; E224-A228 VanDerWaalsContact O-CB 3.25Å; E224-A228 WeakPolarHBondContact O-CB 3.25Å; E224-A228 PolarHBondContact O-N 3.01Å
225L91.7Very high85.9Confident70 Ų70105.1 Ų105.137%0.36650%0.502SS..Hα-helixtrans-70.4-39.1178.2-72.6172.2000111.9L140 R221 V222 A228 Y229L140-L225 HydrophobicContact CD1-CD1 3.95Å; R221-L225 HydrophobicContact CG-CD1 4.37Å; R221-L225 WeakPolarHBondContact O-CB 3.3Å; R221-L225 VanDerWaalsContact O-CG 3.27Å; R221-L225 WeakPolarHBondContact O-CG 3.38Å; R221-L225 PolarHBondContact O-N 2.87Å; V222-L225 PolarHBondContact O-N 3.21Å; V222-L225 VanDerWaalsContact O-N 3.16Å; L225-A228 PolarHBondContact O-N 3.33Å; L225-Y229 VanDerWaalsContact O-CB 3.28Å; L225-Y229 WeakPolarHBondContact O-CB 3.22Å; L225-Y229 PolarHBondContact O-N 2.88Å
226E91.2Very high84.2Confident99 Ų99104.4 Ų104.446%0.46350%0.499SS..Hα-helixtrans-65.5-41.2175-75.6-171.7-176.200111.7V222 D223 Y229 K230V222-E226 HydrophobicContact CG1-CG 4.26Å; V222-E226 WeakPolarHBondContact O-CB 3.33Å; V222-E226 WeakPolarHBondContact O-CG 3.48Å; V222-E226 PolarHBondContact O-N 3.18Å; D223-E226 PolarHBondContact O-N 3.47Å; E226-Y229 PolarHBondContact O-N 2.86Å; E226-K230 WeakPolarHBondContact O-CB 3.42Å; E226-K230 VanDerWaalsContact O-CG 3.27Å; E226-K230 WeakPolarHBondContact O-CG 3.27Å; E226-K230 PolarHBondContact O-N 3.37Å
227T85.9Confident82.4Confident61 Ų61103.1 Ų103.137%0.37450%0.502SS..Hα-helixtrans-68.1-39174.6530000111.6D223 E224 K230 R231D223-T227 WeakPolarHBondContact O-CB 3.39Å; D223-T227 VanDerWaalsContact O-CG2 3.25Å; D223-T227 WeakPolarHBondContact O-CG2 3.42Å; D223-T227 PolarHBondContact O-N 2.94Å; D223-T227 PolarHBondContact O-OG1 3.08Å; E224-T227 WeakPolarHBondContact CA-OG1 3.39Å; E224-T227 PolarHBondContact O-OG1 3.2Å; T227-K230 PolarHBondContact O-N 2.9Å; T227-R231 WeakPolarHBondContact O-CB 3.34Å; T227-R231 VanDerWaalsContact O-CG 3.23Å; T227-R231 WeakPolarHBondContact O-CG 3.45Å; T227-R231 PolarHBondContact O-N 3.12Å
228A83.8Confident80.8Confident46 Ų46105.4 Ų105.438%0.3851%0.51SS..Hα-helixtrans-63.5-42.3172.500000112.2E224 L225 R231 L232E224-A228 VanDerWaalsContact O-CB 3.25Å; E224-A228 WeakPolarHBondContact O-CB 3.25Å; E224-A228 PolarHBondContact O-N 3.01Å; L225-A228 PolarHBondContact O-N 3.33Å; A228-R231 WeakPolarHBondContact O-CB 3.42Å; A228-R231 PolarHBondContact O-N 3.35Å; A228-L232 WeakPolarHBondContact O-CB 3.44Å; A228-L232 PolarHBondContact O-N 3.31Å
229Y80.6Confident79.2Confident161 Ų161104.8 Ų104.863%0.63151%0.507SS*.Hα-helixtrans-66.7-41.7177.2-171.6-94.5000111.9L225 E226 L232 K233L225-Y229 VanDerWaalsContact O-CB 3.28Å; L225-Y229 WeakPolarHBondContact O-CB 3.22Å; L225-Y229 PolarHBondContact O-N 2.88Å; E226-Y229 PolarHBondContact O-N 2.86Å; Y229-L232 PolarHBondContact O-N 3.34Å; Y229-K233 WeakPolarHBondContact O-CB 3.35Å; Y229-K233 PolarHBondContact O-N 2.91Å
230K84.6Confident78Confident114 Ų114105.1 Ų105.150%0.49651%0.509SS..Hα-helixtrans-59.7-46.1171.8-76.2171.4-176.1166.10111.1E226 T227 L232 K233 E234E226-K230 WeakPolarHBondContact O-CB 3.42Å; E226-K230 VanDerWaalsContact O-CG 3.27Å; E226-K230 WeakPolarHBondContact O-CG 3.27Å; E226-K230 PolarHBondContact O-N 3.37Å; T227-K230 PolarHBondContact O-N 2.9Å; K230-L232 VanDerWaalsContact C-N 3.34Å; K230-L232 PolarHBondContact O-N 2.98Å; K230-K233 PolarHBondContact O-N 2.99Å; K230-E234 WeakPolarHBondContact O-CB 3.49Å; K230-E234 WeakPolarHBondContact O-CG 3.37Å; K230-E234 PolarHBondContact O-N 3.09Å
231R77Confident77.1Confident170 Ų170101.3 Ų101.364%0.64250%0.5SS*.Hα-helixtrans-58.4-43.7174.2-74170.5-175.4157.52.3112T227 A228 K233 E234 L235T227-R231 WeakPolarHBondContact O-CB 3.34Å; T227-R231 VanDerWaalsContact O-CG 3.23Å; T227-R231 WeakPolarHBondContact O-CG 3.45Å; T227-R231 PolarHBondContact O-N 3.12Å; A228-R231 WeakPolarHBondContact O-CB 3.42Å; A228-R231 PolarHBondContact O-N 3.35Å; R231-K233 VanDerWaalsContact C-N 3.33Å; R231-K233 PolarHBondContact O-N 3.28Å; R231-E234 PolarHBondContact O-N 2.93Å; R231-L235 WeakPolarHBondContact O-CB 3.29Å; R231-L235 WeakPolarHBondContact O-CD1 3.37Å; R231-L235 WeakPolarHBondContact O-CG 3.42Å; R231-L235 PolarHBondContact O-N 2.74Å
232L72Confident76Confident124 Ų12495 Ų9565%0.64948%0.477SS*.Hα-helixtrans-64.4-37.4177.8-156.983.4000112.3A228 Y229 K230A228-L232 WeakPolarHBondContact O-CB 3.44Å; A228-L232 PolarHBondContact O-N 3.31Å; Y229-L232 PolarHBondContact O-N 3.34Å; K230-L232 VanDerWaalsContact C-N 3.34Å; K230-L232 PolarHBondContact O-N 2.98Å
233K73.9Confident75.1Confident166 Ų16694.1 Ų94.172%0.72247%0.47SS*.Hα-helixtrans-76.2-33.3178.5-171176.8-178.9-178.30113.1Y229 K230 R231Y229-K233 WeakPolarHBondContact O-CB 3.35Å; Y229-K233 PolarHBondContact O-N 2.91Å; K230-K233 PolarHBondContact O-N 2.99Å; R231-K233 VanDerWaalsContact C-N 3.33Å; R231-K233 PolarHBondContact O-N 3.28Å
234E63.1Low74.3Confident152 Ų15294.7 Ų94.771%0.7147%0.472SS*.Hα-helixtrans-86.4-18179-71.3176.9-172.400113.3K230 R231 P236K230-E234 WeakPolarHBondContact O-CB 3.49Å; K230-E234 WeakPolarHBondContact O-CG 3.37Å; K230-E234 PolarHBondContact O-N 3.09Å; R231-E234 PolarHBondContact O-N 2.93Å; E234-P236 WeakPolarHBondContact O-CD 3.26Å
235L55.8Low73.6Confident110 Ų11095.2 Ų95.258%0.57648%0.475SS*.SBendtrans-56.7123.3167.5-87.6157.6000107.3R231R231-L235 WeakPolarHBondContact O-CB 3.29Å; R231-L235 WeakPolarHBondContact O-CD1 3.37Å; R231-L235 WeakPolarHBondContact O-CG 3.42Å; R231-L235 PolarHBondContact O-N 2.74Å
236P57.5Low73.1Confident66 Ų6693.1 Ų93.143%0.42946%0.463SS..PPolyproline II helixtrans-53.2148.3171.522.7-30.9000108.3E234 E238E234-P236 WeakPolarHBondContact O-CD 3.26Å; P236-E238 PolarHBondContact O-N 3.29Å
237P56.5Low72.5Confident77 Ų7793.8 Ų93.850%0.547%0.466SS..SBendtrans-46.9132.8178.321.4-32.9000108N239 I241P237-N239 PolarHBondContact O-N 2.67Å; P237-I241 HydrophobicContact CB-CB 4.36Å; P237-I241 HydrophobicContact CB-CG2 4.3Å
238E60.6Low72.6Confident130 Ų13095 Ų9561%0.60747%0.47SS*.  trans-39.8136.3-173.7-65.5-173.5164.600109.8P236 S240 I241 A242P236-E238 PolarHBondContact O-N 3.29Å; E238-S240 VanDerWaalsContact CB-OG 3.24Å; E238-S240 WeakPolarHBondContact CB-OG 3.29Å; E238-S240 CarbonylContact O-C 3.6Å; E238-S240 PolarHBondContact O-N 3.2Å; E238-S240 PolarHBondContact OE2-OG 2.87Å; E238-I241 HydrophobicContact CB-CD1 4.33Å; E238-I241 HydrophobicContact CB-CG1 4.34Å; E238-I241 WeakPolarHBondContact O-CA 3.43Å; E238-I241 PolarHBondContact O-N 2.93Å; E238-A242 PolarHBondContact O-N 3.21Å; E238-A242 VanDerWaalsContact O-N 3.12Å
239N63.2Low72.6Confident54 Ų5498 Ų9829%0.28948%0.478SS..Hα-helixtrans-48.2-30.8-176.9-122.1-8.3000111.7P237 N243 R356 E360P237-N239 PolarHBondContact O-N 2.67Å; N239-N243 VanDerWaalsContact O-CB 3.24Å; N239-N243 WeakPolarHBondContact O-CB 3.38Å; N239-N243 PolarHBondContact O-N 3.5Å; N239-N243 PolarHBondContact O-ND2 3.26Å; N239-N243 PolarHBondContact O-OD1 2.85Å; N239-R356 VanDerWaalsContact OD1-CD 3.3Å; N239-R356 WeakPolarHBondContact OD1-CD 3.24Å; N239-E360 PolarHBondContact ND2-OE1 2.76Å; N239-E360 VanDerWaalsContact ND2-OE1 3.09Å
240S70Confident72.7Confident56 Ų5690.8 Ų90.839%0.39245%0.452SS..Hα-helixtrans-57.5-52.2169.353.90000114.2E238 N243 I244E238-S240 VanDerWaalsContact CB-OG 3.24Å; E238-S240 WeakPolarHBondContact CB-OG 3.29Å; E238-S240 CarbonylContact O-C 3.6Å; E238-S240 PolarHBondContact O-N 3.2Å; E238-S240 PolarHBondContact OE2-OG 2.87Å; S240-N243 PolarHBondContact O-N 2.98Å; S240-I244 WeakPolarHBondContact O-CD1 3.49Å; S240-I244 WeakPolarHBondContact O-CG1 3.2Å; S240-I244 PolarHBondContact O-N 3.33Å
241I74.1Confident72.4Confident74 Ų7488.5 Ų88.538%0.37945%0.448SS..Hα-helixtrans-65.3-42.5179.7-61173000110.3P237 E238 I244 Q245P237-I241 HydrophobicContact CB-CB 4.36Å; P237-I241 HydrophobicContact CB-CG2 4.3Å; E238-I241 HydrophobicContact CB-CD1 4.33Å; E238-I241 HydrophobicContact CB-CG1 4.34Å; E238-I241 WeakPolarHBondContact O-CA 3.43Å; E238-I241 PolarHBondContact O-N 2.93Å; I241-I244 PolarHBondContact O-N 2.88Å; I241-Q245 WeakPolarHBondContact O-CG 3.27Å; I241-Q245 PolarHBondContact O-N 3.34Å
242A72.9Confident72.8Confident7 Ų786.2 Ų86.26%0.05844%0.442CS..Hα-helixtrans-63.7-42.9176.500000111.6E238 Q245 E246E238-A242 PolarHBondContact O-N 3.21Å; E238-A242 VanDerWaalsContact O-N 3.12Å; A242-Q245 PolarHBondContact O-N 3.4Å; A242-E246 WeakPolarHBondContact O-CG 3.46Å; A242-E246 PolarHBondContact O-N 2.82Å
243N75.9Confident73.2Confident46 Ų4685 Ų8525%0.24644%0.435CS..Hα-helixtrans-60.3-45.4173.9-71.4-14.5000111.4N239 S240 Q245 E246 E247N239-N243 VanDerWaalsContact O-CB 3.24Å; N239-N243 WeakPolarHBondContact O-CB 3.38Å; N239-N243 PolarHBondContact O-N 3.5Å; N239-N243 PolarHBondContact O-ND2 3.26Å; N239-N243 PolarHBondContact O-OD1 2.85Å; S240-N243 PolarHBondContact O-N 2.98Å; N243-Q245 VanDerWaalsContact C-N 3.31Å; N243-Q245 PolarHBondContact O-N 3.38Å; N243-E246 PolarHBondContact O-N 3.34Å; N243-E247 WeakPolarHBondContact O-CB 3.49Å; N243-E247 WeakPolarHBondContact O-CG 3.32Å; N243-E247 PolarHBondContact O-N 3.43Å
244I78.3Confident73.6Confident107 Ų10783.3 Ų83.355%0.54942%0.424SS..Hα-helixtrans-62.2-39.6177.8-69.1162.6000111.1S240 I241 L248S240-I244 WeakPolarHBondContact O-CD1 3.49Å; S240-I244 WeakPolarHBondContact O-CG1 3.2Å; S240-I244 PolarHBondContact O-N 3.33Å; I241-I244 PolarHBondContact O-N 2.88Å; I244-L248 WeakPolarHBondContact O-CB 3.34Å; I244-L248 PolarHBondContact O-N 2.9Å
245Q77.6Confident74.4Confident110 Ų11081.5 Ų81.551%0.51442%0.415SS..Hα-helixtrans-65.9-41.4176.5-73.9177.1-4.200112I241 A242 N243 L248 I249I241-Q245 WeakPolarHBondContact O-CG 3.27Å; I241-Q245 PolarHBondContact O-N 3.34Å; A242-Q245 PolarHBondContact O-N 3.4Å; N243-Q245 VanDerWaalsContact C-N 3.31Å; N243-Q245 PolarHBondContact O-N 3.38Å; Q245-L248 PolarHBondContact O-N 3.19Å; Q245-I249 VanDerWaalsContact O-CG1 3.28Å; Q245-I249 WeakPolarHBondContact O-CG1 3.38Å; Q245-I249 PolarHBondContact O-N 3Å
246E80.1Confident75.6Confident26 Ų2678.6 Ų78.612%0.12141%0.407CS..Hα-helixtrans-67.1-44.5175.8-73.1-176155.600112.6A242 N243 L248 I249 A250 N352 R356A242-E246 WeakPolarHBondContact O-CG 3.46Å; A242-E246 PolarHBondContact O-N 2.82Å; N243-E246 PolarHBondContact O-N 3.34Å; E246-L248 VanDerWaalsContact C-N 3.3Å; E246-L248 PolarHBondContact O-N 3.34Å; E246-I249 PolarHBondContact O-N 3.15Å; E246-A250 WeakPolarHBondContact O-CB 3.5Å; E246-A250 PolarHBondContact O-N 3.47Å; E246-N352 WeakPolarHBondContact OE1-CB 3.48Å; E246-N352 PolarHBondContact OE1-ND2 3.39Å; E246-R356 IonicContact OE1-CZ 3.87Å; E246-R356 IonicContact OE1-NH1 3.61Å; E246-R356 PolarHBondContact OE1-NH1 3.36Å; E246-R356 IonicContact OE1-NH2 3.63Å; E246-R356 PolarHBondContact OE1-NH2 3.49Å; E246-R356 IonicContact OE2-CZ 2.62Å; E246-R356 IonicContact OE2-NH1 3.34Å; E246-R356 PolarHBondContact OE2-NH1 2.84Å; E246-R356 IonicContact OE2-NH2 2.85Å
247E79.3Confident76.6Confident113 Ų11377.9 Ų77.953%0.52840%0.398SS..Hα-helixtrans-61-41174.4-74.9-176.1177.600111.1N243 A250 V251N243-E247 WeakPolarHBondContact O-CB 3.49Å; N243-E247 WeakPolarHBondContact O-CG 3.32Å; N243-E247 PolarHBondContact O-N 3.43Å; E247-A250 PolarHBondContact O-N 2.93Å; E247-V251 WeakPolarHBondContact O-CB 3.45Å; E247-V251 VanDerWaalsContact O-CG2 3.24Å; E247-V251 WeakPolarHBondContact O-CG2 3.47Å; E247-V251 PolarHBondContact O-N 2.92Å
248L88.9Confident77.9Confident87 Ų8776.8 Ų76.846%0.45540%0.395SS..Hα-helixtrans-63.4-42175.8-179.462.3000111.8I244 Q245 E246 V251 K252I244-L248 WeakPolarHBondContact O-CB 3.34Å; I244-L248 PolarHBondContact O-N 2.9Å; Q245-L248 PolarHBondContact O-N 3.19Å; E246-L248 VanDerWaalsContact C-N 3.3Å; E246-L248 PolarHBondContact O-N 3.34Å; L248-V251 PolarHBondContact O-N 3.24Å; L248-K252 HydrophobicContact CD1-CD 4.45Å; L248-K252 HydrophobicContact CD1-CG 4.41Å; L248-K252 HydrophobicContact CG-CD 4.33Å; L248-K252 WeakPolarHBondContact O-CB 3.32Å; L248-K252 VanDerWaalsContact O-CG 3.27Å; L248-K252 WeakPolarHBondContact O-CG 3.45Å; L248-K252 PolarHBondContact O-N 2.95Å
249I82.7Confident78.8Confident108 Ų10874.2 Ų74.255%0.55439%0.386SS*.Hα-helixtrans-63-45.7174.7-68.4164.9000109.7Q245 E246 V251 K252 M253Q245-I249 VanDerWaalsContact O-CG1 3.28Å; Q245-I249 WeakPolarHBondContact O-CG1 3.38Å; Q245-I249 PolarHBondContact O-N 3Å; E246-I249 PolarHBondContact O-N 3.15Å; I249-V251 PolarHBondContact O-N 3.44Å; I249-K252 PolarHBondContact O-N 3.49Å; I249-M253 HydrophobicContact CG2-CG 4.42Å; I249-M253 VanDerWaalsContact O-CG 3.29Å; I249-M253 WeakPolarHBondContact O-CG 3.44Å; I249-M253 PolarHBondContact O-N 3.13Å
250A81.9Confident79.9Confident10 Ų1076.4 Ų76.48%0.08340%0.397CS..Hα-helixtrans-63.4-40.1178.500000112.8E246 E247 M253 R254 M349E246-A250 WeakPolarHBondContact O-CB 3.5Å; E246-A250 PolarHBondContact O-N 3.47Å; E247-A250 PolarHBondContact O-N 2.93Å; A250-M253 PolarHBondContact O-N 3.36Å; A250-R254 WeakPolarHBondContact O-CG 3.25Å; A250-R254 PolarHBondContact O-N 3.04Å; A250-R254 PolarHBondContact O-NE 2.88Å; A250-M349 HydrophobicContact CB-SD 4.06Å
251V80.1Confident80.7Confident66 Ų6676.2 Ų76.240%0.440%0.396SS..Hα-helixtrans-63.6-45.8173.5169.90000110.3E247 L248 I249 M253 R254 E255E247-V251 WeakPolarHBondContact O-CB 3.45Å; E247-V251 VanDerWaalsContact O-CG2 3.24Å; E247-V251 WeakPolarHBondContact O-CG2 3.47Å; E247-V251 PolarHBondContact O-N 2.92Å; L248-V251 PolarHBondContact O-N 3.24Å; I249-V251 PolarHBondContact O-N 3.44Å; V251-M253 VanDerWaalsContact C-N 3.31Å; V251-M253 PolarHBondContact O-N 3.18Å; V251-R254 VanDerWaalsContact CG2-NH2 3.35Å; V251-R254 PolarHBondContact O-N 3.44Å; V251-E255 WeakPolarHBondContact O-CB 3.49Å; V251-E255 PolarHBondContact O-N 3.33Å
252K84.2Confident81Confident121 Ų12176.3 Ų76.353%0.52640%0.396SS..Hα-helixtrans-61.8-37.5177.7-77.4179.6176.3-177.90112.7L248 I249 A256L248-K252 HydrophobicContact CD1-CD 4.45Å; L248-K252 HydrophobicContact CD1-CG 4.41Å; L248-K252 HydrophobicContact CG-CD 4.33Å; L248-K252 WeakPolarHBondContact O-CB 3.32Å; L248-K252 VanDerWaalsContact O-CG 3.27Å; L248-K252 WeakPolarHBondContact O-CG 3.45Å; L248-K252 PolarHBondContact O-N 2.95Å; I249-K252 PolarHBondContact O-N 3.49Å; K252-A256 WeakPolarHBondContact O-CB 3.33Å; K252-A256 PolarHBondContact O-N 3.49Å
253M81Confident81.6Confident99 Ų9982.5 Ų82.549%0.48842%0.422SS..Hα-helixtrans-66.4-48.3175.2-68.2-62.5-66.300111.3I249 A250 V251 E255 A256 E257I249-M253 HydrophobicContact CG2-CG 4.42Å; I249-M253 VanDerWaalsContact O-CG 3.29Å; I249-M253 WeakPolarHBondContact O-CG 3.44Å; I249-M253 PolarHBondContact O-N 3.13Å; A250-M253 PolarHBondContact O-N 3.36Å; V251-M253 VanDerWaalsContact C-N 3.31Å; V251-M253 PolarHBondContact O-N 3.18Å; M253-E255 VanDerWaalsContact C-N 3.33Å; M253-E255 PolarHBondContact O-N 2.85Å; M253-A256 WeakPolarHBondContact O-CB 3.4Å; M253-A256 PolarHBondContact O-N 3.28Å; M253-E257 PolarHBondContact O-N 2.89Å
254R81.5Confident82.1Confident130 Ų13084.5 Ų84.549%0.49143%0.43SS..Hα-helixtrans-59.3-41.2175.1-74.7-175.5-71.2160.2-5.6112.7A250 V251 E257 A258A250-R254 WeakPolarHBondContact O-CG 3.25Å; A250-R254 PolarHBondContact O-N 3.04Å; A250-R254 PolarHBondContact O-NE 2.88Å; V251-R254 VanDerWaalsContact CG2-NH2 3.35Å; V251-R254 PolarHBondContact O-N 3.44Å; R254-E257 PolarHBondContact O-N 2.85Å; R254-A258 WeakPolarHBondContact O-CB 3.34Å; R254-A258 PolarHBondContact O-N 2.66Å
255E80Confident82.3Confident114 Ų11483.8 Ų83.853%0.53343%0.43SS..Hα-helixtrans-65.8-40.8176.6-165.9-163.5156.900111.6V251 M253 E257 A258 N259V251-E255 WeakPolarHBondContact O-CB 3.49Å; V251-E255 PolarHBondContact O-N 3.33Å; M253-E255 VanDerWaalsContact C-N 3.33Å; M253-E255 PolarHBondContact O-N 2.85Å; E255-E257 VanDerWaalsContact C-N 3.34Å; E255-E257 PolarHBondContact O-N 2.88Å; E255-A258 PolarHBondContact O-N 2.94Å; E255-N259 VanDerWaalsContact O-CB 3.32Å; E255-N259 WeakPolarHBondContact O-CB 3.33Å; E255-N259 VanDerWaalsContact O-CG 3.31Å; E255-N259 PolarHBondContact O-N 3.41Å; E255-N259 PolarHBondContact O-ND2 3.49Å
256A80.6Confident82.6Confident49 Ų4986.8 Ų86.841%0.40544%0.437SS..Hα-helixtrans-61.5-41.8176.700000111.8K252 M253 N259 L260K252-A256 WeakPolarHBondContact O-CB 3.33Å; K252-A256 PolarHBondContact O-N 3.49Å; M253-A256 WeakPolarHBondContact O-CB 3.4Å; M253-A256 PolarHBondContact O-N 3.28Å; A256-N259 PolarHBondContact O-N 3.39Å; A256-L260 WeakPolarHBondContact O-CG 3.47Å; A256-L260 PolarHBondContact O-N 3.45Å
257E79.3Confident82.9Confident52 Ų5291 Ų9124%0.24346%0.457CS..Hα-helixtrans-70-42.6176.2-76.4153.1-138.100113.5M253 R254 E255 N259 L260 S261 M341M253-E257 PolarHBondContact O-N 2.89Å; R254-E257 PolarHBondContact O-N 2.85Å; E255-E257 VanDerWaalsContact C-N 3.34Å; E255-E257 PolarHBondContact O-N 2.88Å; E257-N259 PolarHBondContact O-N 2.86Å; E257-L260 PolarHBondContact O-N 2.94Å; E257-L260 VanDerWaalsContact O-N 3.13Å; E257-S261 PolarHBondContact O-N 3.33Å; E257-S261 PolarHBondContact O-OG 2.92Å; E257-S261 VanDerWaalsContact O-OG 3.12Å; E257-M341 HydrophobicContact CG-CE 4.27Å; E257-M341 WeakPolarHBondContact OE1-CE 3.23Å; E257-M341 WeakPolarHBondContact OE2-CE 3.44Å
258A82.8Confident83.2Confident53 Ų5390.1 Ų90.144%0.43845%0.451SS..Hα-helixtrans-58.2-41.4173.100000110.5R254 E255 S261 L262R254-A258 WeakPolarHBondContact O-CB 3.34Å; R254-A258 PolarHBondContact O-N 2.66Å; E255-A258 PolarHBondContact O-N 2.94Å; A258-S261 WeakPolarHBondContact CA-OG 3.45Å; A258-S261 PolarHBondContact O-OG 3.3Å; A258-L262 WeakPolarHBondContact O-CB 3.31Å; A258-L262 PolarHBondContact O-N 3.17Å
259N80.6Confident82.9Confident76 Ų7693.1 Ų93.141%0.40646%0.461SS..Hα-helixtrans-66-37.9174.8-80-48.6000113E255 A256 E257 K263E255-N259 VanDerWaalsContact O-CB 3.32Å; E255-N259 WeakPolarHBondContact O-CB 3.33Å; E255-N259 VanDerWaalsContact O-CG 3.31Å; E255-N259 PolarHBondContact O-N 3.41Å; E255-N259 PolarHBondContact O-ND2 3.49Å; A256-N259 PolarHBondContact O-N 3.39Å; E257-N259 PolarHBondContact O-N 2.86Å; N259-K263 VanDerWaalsContact O-CG 3.3Å; N259-K263 WeakPolarHBondContact O-CG 3.39Å; N259-K263 PolarHBondContact O-N 3.07Å
260L86.7Confident82.9Confident101 Ų10190.2 Ų90.253%0.52945%0.453SS..Hα-helixtrans-67.2-47.7175.5-74.7169.9000111.6A256 E257 L262 K263 E264A256-L260 WeakPolarHBondContact O-CG 3.47Å; A256-L260 PolarHBondContact O-N 3.45Å; E257-L260 PolarHBondContact O-N 2.94Å; E257-L260 VanDerWaalsContact O-N 3.13Å; L260-L262 VanDerWaalsContact C-N 3.32Å; L260-L262 PolarHBondContact O-N 3.35Å; L260-K263 WeakPolarHBondContact O-CB 3.5Å; L260-K263 PolarHBondContact O-N 2.83Å; L260-E264 WeakPolarHBondContact O-CG 3.01Å; L260-E264 PolarHBondContact O-N 2.91Å
261S85.4Confident83.1Confident52 Ų5294 Ų9436%0.36447%0.469SS..Hα-helixtrans-63.2-37.1177.460.40000112.4E257 A258 E264 V265E257-S261 PolarHBondContact O-N 3.33Å; E257-S261 PolarHBondContact O-OG 2.92Å; E257-S261 VanDerWaalsContact O-OG 3.12Å; A258-S261 WeakPolarHBondContact CA-OG 3.45Å; A258-S261 PolarHBondContact O-OG 3.3Å; S261-E264 WeakPolarHBondContact O-CB 3.47Å; S261-E264 PolarHBondContact O-N 2.86Å; S261-V265 WeakPolarHBondContact O-CG2 3.31Å; S261-V265 PolarHBondContact O-N 3.41Å
262L81.5Confident83.4Confident75 Ų7596.1 Ų96.139%0.39348%0.477SS..Hα-helixtrans-66.6-38.8174.8-165.5154.1000111.7A258 L260 V265 R266A258-L262 WeakPolarHBondContact O-CB 3.31Å; A258-L262 PolarHBondContact O-N 3.17Å; L260-L262 VanDerWaalsContact C-N 3.32Å; L260-L262 PolarHBondContact O-N 3.35Å; L262-V265 PolarHBondContact O-N 3.08Å; L262-R266 HydrophobicContact CD2-CG 4.05Å; L262-R266 WeakPolarHBondContact O-CB 3.3Å; L262-R266 WeakPolarHBondContact O-CG 3.33Å; L262-R266 PolarHBondContact O-N 3.08Å
263K84.7Confident83.2Confident137 Ų13792 Ų9260%0.59646%0.463SS*.Hα-helixtrans-61.2-42.8171.3-77.1173.1-178.21770111.6N259 L260 R266 Q267N259-K263 VanDerWaalsContact O-CG 3.3Å; N259-K263 WeakPolarHBondContact O-CG 3.39Å; N259-K263 PolarHBondContact O-N 3.07Å; L260-K263 WeakPolarHBondContact O-CB 3.5Å; L260-K263 PolarHBondContact O-N 2.83Å; K263-R266 PolarHBondContact O-N 3.31Å; K263-Q267 WeakPolarHBondContact O-CB 3.41Å; K263-Q267 PolarHBondContact O-N 2.89Å
264E86.9Confident83.3Confident89 Ų8991.8 Ų91.842%0.41647%0.465SS..Hα-helixtrans-62.7-42.8176.3-69.4177.1-172.500112.3L260 S261 Q267 K268 K334L260-E264 WeakPolarHBondContact O-CG 3.01Å; L260-E264 PolarHBondContact O-N 2.91Å; S261-E264 WeakPolarHBondContact O-CB 3.47Å; S261-E264 PolarHBondContact O-N 2.86Å; E264-Q267 PolarHBondContact O-N 3.18Å; E264-K268 WeakPolarHBondContact O-CG 3.49Å; E264-K268 PolarHBondContact O-N 3.5Å; E264-K334 IonicContact OE2-NZ 3.93Å; E264-K334 PolarHBondContact OE2-NZ 3.01Å
265V83.2Confident83.5Confident92 Ų9291.7 Ų91.756%0.55847%0.469SS*.Hα-helixtrans-65-42.8176.3172.80000111S261 L262 Q267 K268 F269S261-V265 WeakPolarHBondContact O-CG2 3.31Å; S261-V265 PolarHBondContact O-N 3.41Å; L262-V265 PolarHBondContact O-N 3.08Å; V265-Q267 VanDerWaalsContact C-N 3.29Å; V265-Q267 PolarHBondContact O-N 3.14Å; V265-K268 PolarHBondContact O-N 2.96Å; V265-F269 WeakPolarHBondContact O-CB 3.39Å; V265-F269 PolarHBondContact O-N 3.43Å
266R82.5Confident83.2Confident172 Ų17294.8 Ų94.865%0.64948%0.476SS*.Hα-helixtrans-60.1-40174.4-77.2-179.4176.8162.75.4111.9L262 K263 F269 A270L262-R266 HydrophobicContact CD2-CG 4.05Å; L262-R266 WeakPolarHBondContact O-CB 3.3Å; L262-R266 WeakPolarHBondContact O-CG 3.33Å; L262-R266 PolarHBondContact O-N 3.08Å; K263-R266 PolarHBondContact O-N 3.31Å; R266-F269 PolarHBondContact O-N 3.27Å; R266-A270 WeakPolarHBondContact O-CB 3.32Å; R266-A270 PolarHBondContact O-N 3.46Å
267Q87.4Confident82.9Confident116 Ų11697.8 Ų97.854%0.54248%0.48SS..Hα-helixtrans-64-48.8175.6-178.8178.7-9.600111.1K263 E264 V265 F269 A270 E271K263-Q267 WeakPolarHBondContact O-CB 3.41Å; K263-Q267 PolarHBondContact O-N 2.89Å; E264-Q267 PolarHBondContact O-N 3.18Å; V265-Q267 VanDerWaalsContact C-N 3.29Å; V265-Q267 PolarHBondContact O-N 3.14Å; Q267-F269 VanDerWaalsContact C-N 3.3Å; Q267-F269 PolarHBondContact O-N 2.91Å; Q267-A270 WeakPolarHBondContact O-CB 3.33Å; Q267-A270 PolarHBondContact O-N 2.87Å; Q267-A270 VanDerWaalsContact O-N 3.11Å; Q267-E271 WeakPolarHBondContact CG-OE1 3.42Å; Q267-E271 PolarHBondContact NE2-OE1 2.86Å; Q267-E271 WeakPolarHBondContact O-CG 3.28Å; Q267-E271 PolarHBondContact O-N 3.47Å
268K85.5Confident82.9Confident93 Ų9398.1 Ų98.140%0.40449%0.492SS..Hα-helixtrans-59.6-39.4176.1-72.2-174.7178.2-165.20112.5E264 V265 E271 L272E264-K268 WeakPolarHBondContact O-CG 3.49Å; E264-K268 PolarHBondContact O-N 3.5Å; V265-K268 PolarHBondContact O-N 2.96Å; K268-E271 PolarHBondContact O-N 3.42Å; K268-L272 WeakPolarHBondContact O-CG 3.46Å; K268-L272 PolarHBondContact O-N 3.43Å
269F82Confident82.5Confident151 Ų15198.9 Ų98.966%0.66249%0.493SS*.Hα-helixtrans-65.5-40.3175.3-175-93.8000111.9V265 R266 Q267 S273V265-F269 WeakPolarHBondContact O-CB 3.39Å; V265-F269 PolarHBondContact O-N 3.43Å; R266-F269 PolarHBondContact O-N 3.27Å; Q267-F269 VanDerWaalsContact C-N 3.3Å; Q267-F269 PolarHBondContact O-N 2.91Å; F269-S273 VanDerWaalsContact O-CB 3.26Å; F269-S273 WeakPolarHBondContact O-CB 3.38Å; F269-S273 PolarHBondContact O-N 2.84Å
270A82.3Confident81.9Confident46 Ų4697.5 Ų97.538%0.3849%0.488SS..Hα-helixtrans-64.6-40.9174.800000111.8R266 Q267 S273 N274R266-A270 WeakPolarHBondContact O-CB 3.32Å; R266-A270 PolarHBondContact O-N 3.46Å; Q267-A270 WeakPolarHBondContact O-CB 3.33Å; Q267-A270 PolarHBondContact O-N 2.87Å; Q267-A270 VanDerWaalsContact O-N 3.11Å; A270-S273 PolarHBondContact O-N 3.38Å; A270-N274 WeakPolarHBondContact O-CB 3.27Å; A270-N274 PolarHBondContact O-N 3.32Å; A270-N274 PolarHBondContact O-ND2 3.2Å
271E86.8Confident81.1Confident91 Ų9196.4 Ų96.443%0.42549%0.488SS..Hα-helixtrans-59.5-53.6174-72.1166.4-172.800110.9Q267 K268 S273 N274 E275Q267-E271 WeakPolarHBondContact CG-OE1 3.42Å; Q267-E271 PolarHBondContact NE2-OE1 2.86Å; Q267-E271 WeakPolarHBondContact O-CG 3.28Å; Q267-E271 PolarHBondContact O-N 3.47Å; K268-E271 PolarHBondContact O-N 3.42Å; E271-S273 VanDerWaalsContact C-N 3.35Å; E271-S273 PolarHBondContact O-N 3.5Å; E271-N274 WeakPolarHBondContact O-CB 3.27Å; E271-N274 PolarHBondContact O-N 2.88Å; E271-N274 VanDerWaalsContact O-N 3.13Å; E271-E275 WeakPolarHBondContact O-CG 3.39Å; E271-E275 PolarHBondContact O-N 3.33Å
272L86.5Confident80.4Confident109 Ų109103.4 Ų103.457%0.57151%0.507SS*.Hα-helixtrans-61.5-38.8177.3-72.5172.5000112.9K268 N274 E275 W276K268-L272 WeakPolarHBondContact O-CG 3.46Å; K268-L272 PolarHBondContact O-N 3.43Å; L272-N274 VanDerWaalsContact C-N 3.33Å; L272-E275 PolarHBondContact O-N 2.91Å; L272-W276 WeakPolarHBondContact O-CB 3.25Å; L272-W276 PolarHBondContact O-N 3.25Å
273S79.2Confident79.5Confident34 Ų34103.8 Ų103.824%0.23852%0.521CS..Hα-helixtrans-64.6-39.4175.6-174.60000111.5F269 A270 E271 W276 K277F269-S273 VanDerWaalsContact O-CB 3.26Å; F269-S273 WeakPolarHBondContact O-CB 3.38Å; F269-S273 PolarHBondContact O-N 2.84Å; A270-S273 PolarHBondContact O-N 3.38Å; E271-S273 VanDerWaalsContact C-N 3.35Å; E271-S273 PolarHBondContact O-N 3.5Å; S273-W276 PolarHBondContact O-N 2.98Å; S273-K277 WeakPolarHBondContact O-CB 3.38Å; S273-K277 VanDerWaalsContact O-CG 3.24Å; S273-K277 WeakPolarHBondContact O-CG 3.34Å; S273-K277 PolarHBondContact O-N 2.86Å
274N83Confident77.8Confident96 Ų96103.6 Ų103.651%0.51353%0.525SS..Hα-helixtrans-69-41.3176.3-70.2-21.9000111.5A270 E271 L272 K277 A278A270-N274 WeakPolarHBondContact O-CB 3.27Å; A270-N274 PolarHBondContact O-N 3.32Å; A270-N274 PolarHBondContact O-ND2 3.2Å; E271-N274 WeakPolarHBondContact O-CB 3.27Å; E271-N274 PolarHBondContact O-N 2.88Å; E271-N274 VanDerWaalsContact O-N 3.13Å; L272-N274 VanDerWaalsContact C-N 3.33Å; N274-K277 PolarHBondContact O-N 3.46Å; N274-A278 WeakPolarHBondContact O-CB 3.35Å; N274-A278 PolarHBondContact O-N 2.97Å
275E86.4Confident75.7Confident127 Ų127103 Ų10359%0.59353%0.532SS*.Hα-helixtrans-61.5-43.4173-73-178.517500111.8E271 L272 A278 C279E271-E275 WeakPolarHBondContact O-CG 3.39Å; E271-E275 PolarHBondContact O-N 3.33Å; L272-E275 PolarHBondContact O-N 2.91Å; E275-A278 PolarHBondContact O-N 2.76Å; E275-C279 WeakPolarHBondContact O-CB 3.25Å; E275-C279 PolarHBondContact O-N 3.37Å
276W74.8Confident73.9Confident179 Ų179103.8 Ų103.868%0.67854%0.538SS*.Hα-helixtrans-64.8-42.8176.7-173.973.4000112L272 S273 A278 C279 T280L272-W276 WeakPolarHBondContact O-CB 3.25Å; L272-W276 PolarHBondContact O-N 3.25Å; S273-W276 PolarHBondContact O-N 2.98Å; W276-A278 VanDerWaalsContact C-N 3.33Å; W276-A278 PolarHBondContact O-N 3.38Å; W276-C279 PolarHBondContact O-N 3.22Å; W276-T280 VanDerWaalsContact O-CB 3.27Å; W276-T280 WeakPolarHBondContact O-CB 3.34Å; W276-T280 PolarHBondContact O-N 3.28Å; W276-T280 PolarHBondContact O-OG1 2.93Å
277K74.1Confident72.1Confident113 Ų113102.5 Ų102.549%0.49155%0.549SS..Hα-helixtrans-62.2-38172.8-74.5170.3-172.4168.70112.4S273 N274 S281S273-K277 WeakPolarHBondContact O-CB 3.38Å; S273-K277 VanDerWaalsContact O-CG 3.24Å; S273-K277 WeakPolarHBondContact O-CG 3.34Å; S273-K277 PolarHBondContact O-N 2.86Å; N274-K277 PolarHBondContact O-N 3.46Å; K277-S281 VanDerWaalsContact O-CB 3.28Å; K277-S281 WeakPolarHBondContact O-CB 3.45Å; K277-S281 PolarHBondContact O-N 3.41Å; K277-S281 PolarHBondContact O-OG 2.82Å
278A78.8Confident69.9Low59 Ų5999.9 Ų99.949%0.48855%0.554SS.*Hα-helixtrans-68.5-43.9176.500000111.5N274 E275 W276 S281 R282N274-A278 WeakPolarHBondContact O-CB 3.35Å; N274-A278 PolarHBondContact O-N 2.97Å; E275-A278 PolarHBondContact O-N 2.76Å; W276-A278 VanDerWaalsContact C-N 3.33Å; W276-A278 PolarHBondContact O-N 3.38Å; A278-S281 PolarHBondContact O-N 3.03Å; A278-R282 WeakPolarHBondContact O-CB 3.17Å; A278-R282 PolarHBondContact O-N 2.84Å
279C73.2Confident67.3Low69 Ų69105.2 Ų105.247%0.46658%0.58SS.*Hα-helixtrans-62.6-44.5175.3-169.80000111.4E275 W276 R282 A283E275-C279 WeakPolarHBondContact O-CB 3.25Å; E275-C279 PolarHBondContact O-N 3.37Å; W276-C279 PolarHBondContact O-N 3.22Å; C279-R282 PolarHBondContact O-N 3.01Å; C279-A283 WeakPolarHBondContact O-CB 3.37Å; C279-A283 PolarHBondContact O-N 2.93Å
280T68.7Low65Low47 Ų47101.5 Ų101.529%0.28859%0.585SS.*Hα-helixtrans-63.9-44177-55.90000111.2W276 R282 A283 L284W276-T280 VanDerWaalsContact O-CB 3.27Å; W276-T280 WeakPolarHBondContact O-CB 3.34Å; W276-T280 PolarHBondContact O-N 3.28Å; W276-T280 PolarHBondContact O-OG1 2.93Å; T280-R282 VanDerWaalsContact C-N 3.33Å; T280-R282 PolarHBondContact O-N 3.22Å; T280-A283 PolarHBondContact O-N 3.1Å; T280-L284 HydrophobicContact CG2-CD1 3.66Å; T280-L284 HydrophobicContact CG2-CG 4.4Å; T280-L284 VanDerWaalsContact O-CB 3.31Å; T280-L284 WeakPolarHBondContact O-CB 3.45Å; T280-L284 WeakPolarHBondContact O-CG 3.46Å; T280-L284 PolarHBondContact O-N 3.28Å
281S69.9Low62.6Low77 Ų77103.3 Ų103.354%0.53860%0.6SS.*Hα-helixtrans-62.7-37.6173.2-62.90000112.5K277 A278 L284 S285K277-S281 VanDerWaalsContact O-CB 3.28Å; K277-S281 WeakPolarHBondContact O-CB 3.45Å; K277-S281 PolarHBondContact O-N 3.41Å; K277-S281 PolarHBondContact O-OG 2.82Å; A278-S281 PolarHBondContact O-N 3.03Å; S281-L284 PolarHBondContact O-N 3.1Å; S281-S285 WeakPolarHBondContact O-CB 3.46Å; S281-S285 PolarHBondContact O-N 3.4Å
282R70.8Confident60Low200 Ų200106 Ų10676%0.75562%0.617SS**Hα-helixtrans-68.5-35.5176.1-169.1176.569.4159.41.9112.2A278 C279 T280A278-R282 WeakPolarHBondContact O-CB 3.17Å; A278-R282 PolarHBondContact O-N 2.84Å; C279-R282 PolarHBondContact O-N 3.01Å; T280-R282 VanDerWaalsContact C-N 3.33Å; T280-R282 PolarHBondContact O-N 3.22Å
283A62.9Low57.5Low83 Ų83108.2 Ų108.269%0.68663%0.629SS**Hα-helixtrans-74.9-34.8175.600000112.6C279 T280C279-A283 WeakPolarHBondContact O-CB 3.37Å; C279-A283 PolarHBondContact O-N 2.93Å; T280-A283 PolarHBondContact O-N 3.1Å
284L48.5Very low55.7Low132 Ų132110.7 Ų110.769%0.69165%0.647SS**Hα-helixtrans-86.2-17.5179.6-73.1168.4000113.9T280 S281 P286T280-L284 HydrophobicContact CG2-CD1 3.66Å; T280-L284 HydrophobicContact CG2-CG 4.4Å; T280-L284 VanDerWaalsContact O-CB 3.31Å; T280-L284 WeakPolarHBondContact O-CB 3.45Å; T280-L284 WeakPolarHBondContact O-CG 3.46Å; T280-L284 PolarHBondContact O-N 3.28Å; S281-L284 PolarHBondContact O-N 3.1Å; L284-P286 WeakPolarHBondContact O-CD 3.42Å; L284-P286 VanDerWaalsContact O-N 3.08Å
285S43.4Very low53.8Low78 Ų78110.5 Ų110.555%0.54566%0.658SS.*SBendtrans-64.3111.7172-177.90000107.9S281 V287S281-S285 WeakPolarHBondContact O-CB 3.46Å; S281-S285 PolarHBondContact O-N 3.4Å; S285-V287 PolarHBondContact O-N 3.04Å
286P45.5Very low51.7Low108 Ų108114.4 Ų114.470%0.70167%0.669SS**  trans-60.7127.9176.226-31.4000107.4L284 G288L284-P286 WeakPolarHBondContact O-CD 3.42Å; L284-P286 VanDerWaalsContact O-N 3.08Å; P286-G288 PolarHBondContact O-N 3.43Å
287V45.5Very low50.1Low144 Ų144111.2 Ų111.287%0.87367%0.674SS**  trans-53.8108168.2172.20000105.7S285 E289S285-V287 PolarHBondContact O-N 3.04Å; V287-E289 PolarHBondContact O-N 3.42Å
288G39.7Very low48.5Very low62 Ų62116.7 Ų116.764%0.63969%0.692SS**  trans-48.3131.8-178.800000109.6P286 G290P286-G288 PolarHBondContact O-N 3.43Å; G288-G290 VanDerWaalsContact C-N 3.26Å; G288-G290 PolarHBondContact O-N 3.01Å
289E32.5Very low46.8Very low204 Ų204124.4 Ų124.495%0.95371%0.708SS**  trans-49.287.1176.5-67.7164148.400110.2V287V287-E289 PolarHBondContact O-N 3.42Å
290G31.7Very low45.3Very low74 Ų74128.6 Ų128.676%0.76372%0.724SS**  trans-98.998.8172.900000107.8G288G288-G290 VanDerWaalsContact C-N 3.26Å; G288-G290 PolarHBondContact O-N 3.01Å
291A33.1Very low44.2Very low84 Ų84131 Ų13169%0.69474%0.735SS**  trans-46.2150.5-179.800000114.9
292N31.6Very low43.5Very low147 Ų147132.1 Ų132.179%0.78674%0.738SS**  trans79.8121.8148.9-64-10.4000119.9
293D34Very low42.8Very low156 Ų156131.3 Ų131.383%0.83474%0.74SS**  trans89.9135.7135.3-76.2-24.7000121.4
294S41.7Very low42.5Very low86 Ų86132.2 Ų132.260%0.60173%0.734SS**  trans82.378.1158.3-161.50000117Y296S294-Y296 PolarHBondContact O-N 2.96Å
295A44.1Very low43.2Very low91 Ų91128.7 Ų128.775%0.75272%0.724SS**THydrogen-bonded Turntrans-70.7516600000114.8
296Y41.2Very low44.5Very low210 Ų210127.9 Ų127.982%0.82472%0.722SS**THydrogen-bonded Turntrans-113.92.5-166.9-92.6-82.8000118.2S294S294-Y296 PolarHBondContact O-N 2.96Å
297S41.4Very low45.7Very low112 Ų112125.9 Ų125.978%0.78371%0.714SS**SBendtrans-110.410.3177.6-1150000116.6
298R39.9Very low47.1Very low228 Ų228121.3 Ų121.386%0.8669%0.691SS**  trans-96.48.4-173.7-111.2-171.7-75.6180-3.9116.8
299R43Very low48.9Very low221 Ų221121.8 Ų121.883%0.83469%0.685SS**SBendtrans-91.7-17.3-177.6-78.5-170.1-167.6176.75.1115.8N301R299-N301 PolarHBondContact O-N 2.79Å
300I41.7Very low51.2Low156 Ų156113.5 Ų113.580%0.865%0.654SS**THydrogen-bonded Turntrans-102.276.2-178.1-51.5179000108.8
301N45.3Very low53.6Low99 Ų99118.4 Ų118.453%0.52965%0.65SS.*THydrogen-bonded Turntrans16530.5151.6-93.5-1.7000113.2R299 K303 D304 A305R299-N301 PolarHBondContact O-N 2.79Å; N301-K303 VanDerWaalsContact C-N 3.25Å; N301-K303 PolarHBondContact O-N 2.8Å; N301-D304 PolarHBondContact O-N 3.47Å; N301-D304 PolarHBondContact OD1-OD2 3.16Å; N301-A305 VanDerWaalsContact O-CB 3.22Å; N301-A305 WeakPolarHBondContact O-CB 3.47Å; N301-A305 PolarHBondContact O-N 3.38Å
302V56.1Low56Low99 Ų99118.9 Ų118.960%0.664%0.64SS**Hα-helixtrans-62.9-31.4177.7-178.10000112A306V302-A306 WeakPolarHBondContact O-CB 3.44Å; V302-A306 PolarHBondContact O-N 2.88Å
303K55.2Low58.4Low183 Ų183116.4 Ų116.480%0.79662%0.623SS**Hα-helixtrans-73.6-44.8178-74.6-171.9176-176.30112.9N301 A305 A306 A307N301-K303 VanDerWaalsContact C-N 3.25Å; N301-K303 PolarHBondContact O-N 2.8Å; K303-A305 VanDerWaalsContact C-N 3.34Å; K303-A306 PolarHBondContact O-N 2.92Å; K303-A307 WeakPolarHBondContact O-CB 3.16Å; K303-A307 PolarHBondContact O-N 3.44Å
304D57.9Low60.7Low102 Ų102114.8 Ų114.855%0.54561%0.611SS.*Hα-helixtrans-67.9-36.4175.7-67.4-18.3000111.4N301 A307 A308N301-D304 PolarHBondContact O-N 3.47Å; N301-D304 PolarHBondContact OD1-OD2 3.16Å; D304-A307 PolarHBondContact O-N 2.84Å; D304-A308 WeakPolarHBondContact O-CB 3.26Å; D304-A308 PolarHBondContact O-N 2.87Å
305A63Low62.9Low59 Ų59115.7 Ų115.749%0.48861%0.608SS.*Hα-helixtrans-67.6-39174.100000112.4N301 K303 S309N301-A305 VanDerWaalsContact O-CB 3.22Å; N301-A305 WeakPolarHBondContact O-CB 3.47Å; N301-A305 PolarHBondContact O-N 3.38Å; K303-A305 VanDerWaalsContact C-N 3.34Å; A305-S309 WeakPolarHBondContact O-CB 3.45Å; A305-S309 PolarHBondContact O-N 2.99Å
306A70Confident64.9Low61 Ų61116.1 Ų116.150%0.50460%0.595SS.*Hα-helixtrans-68.7-40.5174.700000111.9V302 K303 S309 G310V302-A306 WeakPolarHBondContact O-CB 3.44Å; V302-A306 PolarHBondContact O-N 2.88Å; K303-A306 PolarHBondContact O-N 2.92Å; A306-S309 PolarHBondContact O-N 2.87Å; A306-G310 PolarHBondContact O-N 3.49Å
307A71.2Confident67Low65 Ų65110.3 Ų110.354%0.53758%0.578SS.*Hα-helixtrans-66.4-40.9174.400000112K303 D304 G310 R311K303-A307 WeakPolarHBondContact O-CB 3.16Å; K303-A307 PolarHBondContact O-N 3.44Å; D304-A307 PolarHBondContact O-N 2.84Å; A307-G310 PolarHBondContact O-N 3.45Å; A307-R311 WeakPolarHBondContact O-CB 3.38Å; A307-R311 PolarHBondContact O-N 3.44Å
308A74.2Confident69.3Low48 Ų48110.5 Ų110.540%0.39757%0.57SS.*Hα-helixtrans-65-41.9172.900000111.5D304 R311 I312D304-A308 WeakPolarHBondContact O-CB 3.26Å; D304-A308 PolarHBondContact O-N 2.87Å; A308-R311 PolarHBondContact O-N 2.95Å; A308-I312 WeakPolarHBondContact O-CB 3.33Å; A308-I312 WeakPolarHBondContact O-CD1 3.39Å; A308-I312 WeakPolarHBondContact O-CG1 3.46Å; A308-I312 PolarHBondContact O-N 3Å
309S78.4Confident71.6Confident72 Ų72103.5 Ų103.550%0.50355%0.549SS..Hα-helixtrans-63.7-41.3175.3-171.10000111.7A305 A306 I312 Q313A305-S309 WeakPolarHBondContact O-CB 3.45Å; A305-S309 PolarHBondContact O-N 2.99Å; A306-S309 PolarHBondContact O-N 2.87Å; S309-I312 PolarHBondContact O-N 2.88Å; S309-Q313 WeakPolarHBondContact O-CB 3.31Å; S309-Q313 PolarHBondContact O-N 3.38Å
310G80Confident73.6Confident30 Ų3096.1 Ų96.131%0.30953%0.529SS..Hα-helixtrans-62.5-44.9174.100000111.5A306 A307 I312 Q313 E314A306-G310 PolarHBondContact O-N 3.49Å; A307-G310 PolarHBondContact O-N 3.45Å; G310-I312 PolarHBondContact O-N 3.43Å; G310-Q313 PolarHBondContact O-N 2.89Å; G310-E314 WeakPolarHBondContact O-CG 3.36Å; G310-E314 PolarHBondContact O-N 3.26Å
311R82.7Confident75.7Confident178 Ų17890 Ų9067%0.67250%0.504SS*.Hα-helixtrans-68.1-32.6177-168160.8-179.3138.6-1.9113.3A307 A308 L315A307-R311 WeakPolarHBondContact O-CB 3.38Å; A307-R311 PolarHBondContact O-N 3.44Å; A308-R311 PolarHBondContact O-N 2.95Å; R311-L315 WeakPolarHBondContact O-CB 3.43Å; R311-L315 VanDerWaalsContact O-CG 3.24Å; R311-L315 WeakPolarHBondContact O-CG 3.37Å; R311-L315 PolarHBondContact O-N 3.45Å; R311-L315 VanDerWaalsContact O-N 3.08Å
312I82.7Confident77.7Confident94 Ų9488.5 Ų88.548%0.48250%0.498SS..Hα-helixtrans-66-47.6171.8-72.3163.6000109.5A308 S309 G310 E314 L315 E316A308-I312 WeakPolarHBondContact O-CB 3.33Å; A308-I312 WeakPolarHBondContact O-CD1 3.39Å; A308-I312 WeakPolarHBondContact O-CG1 3.46Å; A308-I312 PolarHBondContact O-N 3Å; S309-I312 PolarHBondContact O-N 2.88Å; G310-I312 PolarHBondContact O-N 3.43Å; I312-E314 PolarHBondContact O-N 3.15Å; I312-L315 PolarHBondContact O-N 3.36Å; I312-L315 VanDerWaalsContact O-N 3.16Å; I312-E316 HydrophobicContact CG2-CG 4.39Å; I312-E316 WeakPolarHBondContact O-CG 3.5Å; I312-E316 PolarHBondContact O-N 3.4Å
313Q82.6Confident79.2Confident94 Ų9490.8 Ų90.844%0.43950%0.496SS..Hα-helixtrans-59.7-45.1176.7-172.665.249.400111.6S309 G310 L315 E316 D317S309-Q313 WeakPolarHBondContact O-CB 3.31Å; S309-Q313 PolarHBondContact O-N 3.38Å; G310-Q313 PolarHBondContact O-N 2.89Å; Q313-L315 VanDerWaalsContact C-N 3.31Å; Q313-L315 PolarHBondContact O-N 3.33Å; Q313-E316 WeakPolarHBondContact O-CB 3.5Å; Q313-E316 PolarHBondContact O-N 2.66Å; Q313-E316 VanDerWaalsContact O-N 3.16Å; Q313-D317 PolarHBondContact NE2-OD1 3.04Å; Q313-D317 WeakPolarHBondContact O-CB 3.46Å; Q313-D317 PolarHBondContact O-N 3.3Å
314E83.1Confident80.6Confident123 Ų12387.4 Ų87.458%0.57549%0.485SS*.Hα-helixtrans-58.6-41.3175.4-74.7171.2-170.800112G310 I312 D317 L318G310-E314 WeakPolarHBondContact O-CG 3.36Å; G310-E314 PolarHBondContact O-N 3.26Å; I312-E314 PolarHBondContact O-N 3.15Å; E314-D317 PolarHBondContact O-N 3.31Å; E314-L318 WeakPolarHBondContact O-CB 3.33Å; E314-L318 VanDerWaalsContact O-CG 3.23Å; E314-L318 WeakPolarHBondContact O-CG 3.44Å; E314-L318 PolarHBondContact O-N 2.86Å
315L87.4Confident81.9Confident104 Ų10490.1 Ų90.155%0.54549%0.488SS..Hα-helixtrans-69.6-35.7176.5-72.6171.6000112.3R311 I312 Q313 L319R311-L315 WeakPolarHBondContact O-CB 3.43Å; R311-L315 VanDerWaalsContact O-CG 3.24Å; R311-L315 WeakPolarHBondContact O-CG 3.37Å; R311-L315 PolarHBondContact O-N 3.45Å; R311-L315 VanDerWaalsContact O-N 3.08Å; I312-L315 PolarHBondContact O-N 3.36Å; I312-L315 VanDerWaalsContact O-N 3.16Å; Q313-L315 VanDerWaalsContact C-N 3.31Å; Q313-L315 PolarHBondContact O-N 3.33Å; L315-L319 WeakPolarHBondContact O-CB 3.48Å; L315-L319 PolarHBondContact O-N 2.86Å
316E86.2Confident82.8Confident100 Ų10092.7 Ų92.747%0.46749%0.49SS..Hα-helixtrans-65.9-43.1173.5-72.9176.6172.300111.2I312 Q313 L319 T320I312-E316 HydrophobicContact CG2-CG 4.39Å; I312-E316 WeakPolarHBondContact O-CG 3.5Å; I312-E316 PolarHBondContact O-N 3.4Å; Q313-E316 WeakPolarHBondContact O-CB 3.5Å; Q313-E316 PolarHBondContact O-N 2.66Å; Q313-E316 VanDerWaalsContact O-N 3.16Å; E316-L319 PolarHBondContact O-N 2.96Å; E316-T320 VanDerWaalsContact O-CG2 3.31Å; E316-T320 WeakPolarHBondContact O-CG2 3.45Å; E316-T320 PolarHBondContact O-N 3.36Å; E316-T320 PolarHBondContact O-OG1 3.28Å
317D85.5Confident83.4Confident89 Ų8992 Ų9248%0.47648%0.484SS..Hα-helixtrans-66.1-41.2176.6-66.3-13.2000111.3Q313 E314 T320 G321Q313-D317 PolarHBondContact NE2-OD1 3.04Å; Q313-D317 WeakPolarHBondContact O-CB 3.46Å; Q313-D317 PolarHBondContact O-N 3.3Å; E314-D317 PolarHBondContact O-N 3.31Å; D317-T320 WeakPolarHBondContact CA-OG1 3.41Å; D317-T320 PolarHBondContact O-N 3.46Å; D317-T320 PolarHBondContact O-OG1 2.93Å; D317-G321 PolarHBondContact O-N 3.13Å
318L89.6Confident83.9Confident116 Ų11691.6 Ų91.661%0.60748%0.477SS*.Hα-helixtrans-64.9-40.8173.3-72.7172.6000111.9E314 G321 V322E314-L318 WeakPolarHBondContact O-CB 3.33Å; E314-L318 VanDerWaalsContact O-CG 3.23Å; E314-L318 WeakPolarHBondContact O-CG 3.44Å; E314-L318 PolarHBondContact O-N 2.86Å; L318-G321 PolarHBondContact O-N 2.82Å; L318-V322 WeakPolarHBondContact O-CG2 3.38Å; L318-V322 PolarHBondContact O-N 3.39Å
319L88.8Confident84.4Confident80 Ų8095.4 Ų95.442%0.41949%0.489SS..Hα-helixtrans-66.1-42.1177.3179.262.1000111.6L315 E316 V322 R323L315-L319 WeakPolarHBondContact O-CB 3.48Å; L315-L319 PolarHBondContact O-N 2.86Å; E316-L319 PolarHBondContact O-N 2.96Å; L319-V322 PolarHBondContact O-N 2.74Å; L319-R323 WeakPolarHBondContact O-CG 3.34Å; L319-R323 PolarHBondContact O-N 3.08Å
320T84.9Confident84.8Confident67 Ų6795.6 Ų95.641%0.41148%0.482SS..Hα-helixtrans-63.9-41.9174.455.20000111E316 D317 V322 R323 I324E316-T320 VanDerWaalsContact O-CG2 3.31Å; E316-T320 WeakPolarHBondContact O-CG2 3.45Å; E316-T320 PolarHBondContact O-N 3.36Å; E316-T320 PolarHBondContact O-OG1 3.28Å; D317-T320 WeakPolarHBondContact CA-OG1 3.41Å; D317-T320 PolarHBondContact O-N 3.46Å; D317-T320 PolarHBondContact O-OG1 2.93Å; T320-V322 PolarHBondContact O-N 2.9Å; T320-R323 PolarHBondContact O-N 3.32Å; T320-I324 WeakPolarHBondContact O-CG1 3.36Å; T320-I324 PolarHBondContact O-N 2.98Å
321G84.9Confident85Confident27 Ų2798 Ų9828%0.27849%0.49SS..Hα-helixtrans-63.2-35.3173.800000114.2D317 L318 R325D317-G321 PolarHBondContact O-N 3.13Å; L318-G321 PolarHBondContact O-N 2.82Å; G321-R325 WeakPolarHBondContact O-CG 3.33Å; G321-R325 PolarHBondContact O-N 2.89Å; G321-R325 PolarHBondContact O-NE 2.91Å
322V86.6Confident85Confident67 Ų6795.1 Ų95.141%0.40649%0.485SS..Hα-helixtrans-67.9-44.4171.9171.20000110.8L318 L319 T320 I324 R325 E326L318-V322 WeakPolarHBondContact O-CG2 3.38Å; L318-V322 PolarHBondContact O-N 3.39Å; L319-V322 PolarHBondContact O-N 2.74Å; T320-V322 PolarHBondContact O-N 2.9Å; V322-I324 PolarHBondContact O-N 2.92Å; V322-R325 PolarHBondContact O-N 3.41Å; V322-E326 WeakPolarHBondContact O-CB 3.47Å; V322-E326 PolarHBondContact O-N 3.26Å
323R89.3Confident85.1Confident148 Ų14895 Ų9556%0.55849%0.485SS*.Hα-helixtrans-63-40.3178.1-73.5174.6179170.6-0.6113L319 T320 E326 A327L319-R323 WeakPolarHBondContact O-CG 3.34Å; L319-R323 PolarHBondContact O-N 3.08Å; T320-R323 PolarHBondContact O-N 3.32Å; R323-E326 PolarHBondContact O-N 2.93Å; R323-A327 VanDerWaalsContact O-CB 3.28Å; R323-A327 WeakPolarHBondContact O-CB 3.33Å; R323-A327 PolarHBondContact O-N 3.22Å
324I83.8Confident85.2Confident111 Ų11194.2 Ų94.257%0.56948%0.48SS*.Hα-helixtrans-64.2-42.5176-68166.2000110.5T320 V322 A327 S328T320-I324 WeakPolarHBondContact O-CG1 3.36Å; T320-I324 PolarHBondContact O-N 2.98Å; V322-I324 PolarHBondContact O-N 2.92Å; I324-A327 PolarHBondContact O-N 3.47Å; I324-S328 WeakPolarHBondContact O-CB 3.39Å; I324-S328 PolarHBondContact O-N 2.64Å; I324-S328 PolarHBondContact O-OG 3.46Å
325R84.5Confident85.1Confident160 Ų16094.1 Ų94.160%0.60448%0.479SS*.Hα-helixtrans-64.9-44.2175.5-77.6-175.4-70.3160.5-4.8112.4G321 V322 A327 S328 M329G321-R325 WeakPolarHBondContact O-CG 3.33Å; G321-R325 PolarHBondContact O-N 2.89Å; G321-R325 PolarHBondContact O-NE 2.91Å; V322-R325 PolarHBondContact O-N 3.41Å; R325-A327 VanDerWaalsContact C-N 3.34Å; R325-A327 PolarHBondContact O-N 3.42Å; R325-S328 PolarHBondContact O-N 2.73Å; R325-M329 WeakPolarHBondContact O-CG 3.49Å; R325-M329 PolarHBondContact O-N 3.28Å
326E83.7Confident84.9Confident113 Ų11395.5 Ų95.553%0.52849%0.485SS..Hα-helixtrans-61.2-43175.9-169.2-170.6167.400111.5V322 R323 S328 M329 M330V322-E326 WeakPolarHBondContact O-CB 3.47Å; V322-E326 PolarHBondContact O-N 3.26Å; R323-E326 PolarHBondContact O-N 2.93Å; E326-S328 PolarHBondContact O-N 2.98Å; E326-M329 PolarHBondContact O-N 2.9Å; E326-M330 HydrophobicContact CG-CE 3.87Å; E326-M330 WeakPolarHBondContact O-CB 3.44Å; E326-M330 WeakPolarHBondContact O-CG 3.42Å; E326-M330 PolarHBondContact O-N 3.29Å
327A82Confident84.9Confident47 Ų4798.6 Ų98.639%0.38849%0.492SS..Hα-helixtrans-61.3-42.4174.100000112.1R323 I324 R325 M330 V331R323-A327 VanDerWaalsContact O-CB 3.28Å; R323-A327 WeakPolarHBondContact O-CB 3.33Å; R323-A327 PolarHBondContact O-N 3.22Å; I324-A327 PolarHBondContact O-N 3.47Å; R325-A327 VanDerWaalsContact C-N 3.34Å; R325-A327 PolarHBondContact O-N 3.42Å; A327-M330 WeakPolarHBondContact O-CB 3.41Å; A327-M330 PolarHBondContact O-N 2.87Å; A327-V331 WeakPolarHBondContact O-CG2 3.4Å; A327-V331 PolarHBondContact O-N 2.96Å
328S80.6Confident84.8Confident56 Ų5699.6 Ų99.639%0.39249%0.494SS..Hα-helixtrans-63.8-47.4177.7-54.90000111.3I324 R325 E326 M330 V331 E332I324-S328 WeakPolarHBondContact O-CB 3.39Å; I324-S328 PolarHBondContact O-N 2.64Å; I324-S328 PolarHBondContact O-OG 3.46Å; R325-S328 PolarHBondContact O-N 2.73Å; E326-S328 PolarHBondContact O-N 2.98Å; S328-M330 VanDerWaalsContact C-N 3.29Å; S328-M330 PolarHBondContact O-N 3.3Å; S328-V331 PolarHBondContact O-N 3.47Å; S328-V331 VanDerWaalsContact O-N 3.11Å; S328-E332 PolarHBondContact O-N 3.37Å
329M85.7Confident84.3Confident128 Ų128100.4 Ų100.463%0.63149%0.489SS*.Hα-helixtrans-62.3-34.6175.5-69.3179.968.700112.7R325 E326 L333R325-M329 WeakPolarHBondContact O-CG 3.49Å; R325-M329 PolarHBondContact O-N 3.28Å; E326-M329 PolarHBondContact O-N 2.9Å; M329-L333 WeakPolarHBondContact O-CB 3.39Å; M329-L333 PolarHBondContact O-N 3.39Å
330M86.2Confident84.2Confident76 Ų76100.2 Ų100.237%0.37449%0.491SS..Hα-helixtrans-65.5-37.5173.9-84.9-168.5-95.700112.6E326 A327 S328 K334E326-M330 HydrophobicContact CG-CE 3.87Å; E326-M330 WeakPolarHBondContact O-CB 3.44Å; E326-M330 WeakPolarHBondContact O-CG 3.42Å; E326-M330 PolarHBondContact O-N 3.29Å; A327-M330 WeakPolarHBondContact O-CB 3.41Å; A327-M330 PolarHBondContact O-N 2.87Å; S328-M330 VanDerWaalsContact C-N 3.29Å; S328-M330 PolarHBondContact O-N 3.3Å; M330-K334 VanDerWaalsContact O-CG 3.32Å; M330-K334 WeakPolarHBondContact O-CG 3.43Å; M330-K334 PolarHBondContact O-N 2.95Å; M330-K334 VanDerWaalsContact O-N 3.16Å
331V85.5Confident84Confident79 Ų79100.2 Ų100.248%0.47949%0.487SS..Hα-helixtrans-67.2-50.3175.71730000109.9A327 S328 L333 K334 E335A327-V331 WeakPolarHBondContact O-CG2 3.4Å; A327-V331 PolarHBondContact O-N 2.96Å; S328-V331 PolarHBondContact O-N 3.47Å; S328-V331 VanDerWaalsContact O-N 3.11Å; V331-L333 VanDerWaalsContact C-N 3.33Å; V331-L333 PolarHBondContact O-N 2.88Å; V331-K334 WeakPolarHBondContact O-CB 3.49Å; V331-K334 PolarHBondContact O-N 3.39Å; V331-E335 HydrophobicContact CG1-CG 4.43Å; V331-E335 WeakPolarHBondContact O-CG 3.4Å; V331-E335 PolarHBondContact O-N 3.02Å
332E80.8Confident83.8Confident119 Ų119101.7 Ų101.756%0.55649%0.486SS*.Hα-helixtrans-57.1-44177.3-69.7174.4-17300112.2S328 K334 E335 M336S328-E332 PolarHBondContact O-N 3.37Å; E332-K334 VanDerWaalsContact C-N 3.29Å; E332-K334 PolarHBondContact O-N 3.36Å; E332-E335 PolarHBondContact O-N 3.36Å; E332-M336 WeakPolarHBondContact O-CB 3.29Å; E332-M336 VanDerWaalsContact O-CG 3.25Å; E332-M336 WeakPolarHBondContact O-CG 3.49Å; E332-M336 PolarHBondContact O-N 2.93Å
333L85.2Confident83.6Confident91 Ų91101.9 Ų101.948%0.47649%0.485SS..Hα-helixtrans-64.4-33.9178.1-178.2151.4000112.1M329 V331 R337M329-L333 WeakPolarHBondContact O-CB 3.39Å; M329-L333 PolarHBondContact O-N 3.39Å; V331-L333 VanDerWaalsContact C-N 3.33Å; V331-L333 PolarHBondContact O-N 2.88Å; L333-R337 HydrophobicContact CD2-CG 4.45Å; L333-R337 WeakPolarHBondContact O-CB 3.49Å; L333-R337 VanDerWaalsContact O-CG 3.29Å; L333-R337 WeakPolarHBondContact O-CG 3.48Å; L333-R337 PolarHBondContact O-N 2.8Å
334K85.7Confident83.4Confident78 Ų78100.5 Ų100.534%0.33949%0.485SS..Hα-helixtrans-71.6-43.5174.5-77.8-177.8170.1-150.20112E264 M330 V331 E332 M336 R337 Q338E264-K334 IonicContact OE2-NZ 3.93Å; E264-K334 PolarHBondContact OE2-NZ 3.01Å; M330-K334 VanDerWaalsContact O-CG 3.32Å; M330-K334 WeakPolarHBondContact O-CG 3.43Å; M330-K334 PolarHBondContact O-N 2.95Å; M330-K334 VanDerWaalsContact O-N 3.16Å; V331-K334 WeakPolarHBondContact O-CB 3.49Å; V331-K334 PolarHBondContact O-N 3.39Å; E332-K334 VanDerWaalsContact C-N 3.29Å; E332-K334 PolarHBondContact O-N 3.36Å; K334-M336 VanDerWaalsContact C-N 3.32Å; K334-M336 PolarHBondContact O-N 2.94Å; K334-R337 PolarHBondContact O-N 3.2Å; K334-Q338 PolarHBondContact O-N 2.96Å
335E81.6Confident83.4Confident120 Ų12097 Ų9756%0.56147%0.469SS*.Hα-helixtrans-59.4-44.1174.3-71176.6175.400111.1V331 E332 Q338 R339V331-E335 HydrophobicContact CG1-CG 4.43Å; V331-E335 WeakPolarHBondContact O-CG 3.4Å; V331-E335 PolarHBondContact O-N 3.02Å; E332-E335 PolarHBondContact O-N 3.36Å; E335-Q338 PolarHBondContact O-N 2.96Å; E335-R339 WeakPolarHBondContact O-CB 3.35Å; E335-R339 PolarHBondContact O-N 3.3Å
336M82.3Confident83.3Confident133 Ų13394.9 Ų94.966%0.65547%0.466SS*.Hα-helixtrans-65.7-39176.8-69-64-10000112.2E332 K334 R339 V340E332-M336 WeakPolarHBondContact O-CB 3.29Å; E332-M336 VanDerWaalsContact O-CG 3.25Å; E332-M336 WeakPolarHBondContact O-CG 3.49Å; E332-M336 PolarHBondContact O-N 2.93Å; K334-M336 VanDerWaalsContact C-N 3.32Å; K334-M336 PolarHBondContact O-N 2.94Å; M336-R339 PolarHBondContact O-N 2.89Å; M336-V340 VanDerWaalsContact O-CG2 3.3Å; M336-V340 WeakPolarHBondContact O-CG2 3.33Å; M336-V340 PolarHBondContact O-N 2.91Å
337R85.3Confident83Confident165 Ų16594.4 Ų94.462%0.62347%0.467SS*.Hα-helixtrans-62.9-45.2173.2-78.1178.6-169.4-87.1-0.6111.9L333 K334 R339 V340 M341L333-R337 HydrophobicContact CD2-CG 4.45Å; L333-R337 WeakPolarHBondContact O-CB 3.49Å; L333-R337 VanDerWaalsContact O-CG 3.29Å; L333-R337 WeakPolarHBondContact O-CG 3.48Å; L333-R337 PolarHBondContact O-N 2.8Å; K334-R337 PolarHBondContact O-N 3.2Å; R337-R339 VanDerWaalsContact C-N 3.29Å; R337-R339 PolarHBondContact O-N 3.39Å; R337-V340 PolarHBondContact O-N 3.49Å; R337-M341 WeakPolarHBondContact O-CG 3.21Å; R337-M341 PolarHBondContact O-N 3.47Å
338Q83.3Confident83.1Confident110 Ų11097.9 Ų97.951%0.51448%0.475SS..Hα-helixtrans-60.1-42.6175.6-177.6177.2-1300110.8K334 E335 V340 M341 E342K334-Q338 PolarHBondContact O-N 2.96Å; E335-Q338 PolarHBondContact O-N 2.96Å; Q338-V340 PolarHBondContact O-N 3.3Å; Q338-M341 PolarHBondContact O-N 3.38Å; Q338-E342 PolarHBondContact NE2-OE1 3.05Å; Q338-E342 WeakPolarHBondContact O-CG 3.46Å; Q338-E342 PolarHBondContact O-N 2.95Å
339R80.9Confident83.1Confident134 Ų13497.5 Ų97.551%0.50647%0.467SS..Hα-helixtrans-65.1-40.2178.6-170.357.9177.2175.51.5113E335 M336 R337 M341 E342 L343E335-R339 WeakPolarHBondContact O-CB 3.35Å; E335-R339 PolarHBondContact O-N 3.3Å; M336-R339 PolarHBondContact O-N 2.89Å; R337-R339 VanDerWaalsContact C-N 3.29Å; R337-R339 PolarHBondContact O-N 3.39Å; R339-M341 VanDerWaalsContact C-N 3.32Å; R339-E342 IonicContact CZ-OE2 3.08Å; R339-E342 IonicContact NH1-OE2 3.1Å; R339-E342 PolarHBondContact NH1-OE2 3.49Å; R339-E342 PolarHBondContact O-N 3.44Å; R339-L343 HydrophobicContact CG-CD1 4.36Å; R339-L343 VanDerWaalsContact O-CG 3.3Å; R339-L343 WeakPolarHBondContact O-CG 3.31Å; R339-L343 PolarHBondContact O-N 3.32Å
340V85Confident82.9Confident76 Ų7694 Ų9446%0.46146%0.455SS..Hα-helixtrans-61.1-44174.4168.60000110.4M336 R337 Q338 L343 E344M336-V340 VanDerWaalsContact O-CG2 3.3Å; M336-V340 WeakPolarHBondContact O-CG2 3.33Å; M336-V340 PolarHBondContact O-N 2.91Å; R337-V340 PolarHBondContact O-N 3.49Å; Q338-V340 PolarHBondContact O-N 3.3Å; V340-L343 PolarHBondContact O-N 3.07Å; V340-E344 HydrophobicContact CG1-CG 4.3Å; V340-E344 WeakPolarHBondContact O-CB 3.26Å; V340-E344 VanDerWaalsContact O-CG 3.31Å; V340-E344 WeakPolarHBondContact O-CG 3.42Å; V340-E344 PolarHBondContact O-N 3.44Å
341M82.1Confident82.7Confident66 Ų6694.2 Ų94.233%0.32546%0.463SS..Hα-helixtrans-64.7-41.4177.3-73.1-162.46100113.9E257 R337 Q338 R339 L343 E344 T345E257-M341 HydrophobicContact CG-CE 4.27Å; E257-M341 WeakPolarHBondContact OE1-CE 3.23Å; E257-M341 WeakPolarHBondContact OE2-CE 3.44Å; R337-M341 WeakPolarHBondContact O-CG 3.21Å; R337-M341 PolarHBondContact O-N 3.47Å; Q338-M341 PolarHBondContact O-N 3.38Å; R339-M341 VanDerWaalsContact C-N 3.32Å; M341-L343 VanDerWaalsContact C-N 3.3Å; M341-L343 PolarHBondContact O-N 2.92Å; M341-E344 PolarHBondContact O-N 3.36Å; M341-T345 WeakPolarHBondContact O-CG2 3.37Å; M341-T345 PolarHBondContact O-N 2.96Å; M341-T345 PolarHBondContact O-OG1 3.06Å
342E81Confident82.7Confident58 Ų5891.5 Ų91.527%0.27145%0.446SS..Hα-helixtrans-58.5-43.4172.7-74173-176.500111.4Q338 R339 T345 Q346Q338-E342 PolarHBondContact NE2-OE1 3.05Å; Q338-E342 WeakPolarHBondContact O-CG 3.46Å; Q338-E342 PolarHBondContact O-N 2.95Å; R339-E342 IonicContact CZ-OE2 3.08Å; R339-E342 IonicContact NH1-OE2 3.1Å; R339-E342 PolarHBondContact NH1-OE2 3.49Å; R339-E342 PolarHBondContact O-N 3.44Å; E342-T345 PolarHBondContact O-OG1 2.98Å; E342-Q346 VanDerWaalsContact O-CB 3.27Å; E342-Q346 WeakPolarHBondContact O-CB 3.27Å; E342-Q346 PolarHBondContact O-N 3.05Å
343L82.3Confident82.7Confident72 Ų7289.5 Ų89.538%0.37744%0.436SS..Hα-helixtrans-70.1-37.3178.1-68.6172.4000112.3R339 V340 M341 N347R339-L343 HydrophobicContact CG-CD1 4.36Å; R339-L343 VanDerWaalsContact O-CG 3.3Å; R339-L343 WeakPolarHBondContact O-CG 3.31Å; R339-L343 PolarHBondContact O-N 3.32Å; V340-L343 PolarHBondContact O-N 3.07Å; M341-L343 VanDerWaalsContact C-N 3.3Å; M341-L343 PolarHBondContact O-N 2.92Å; L343-N347 VanDerWaalsContact O-CB 3.26Å; L343-N347 WeakPolarHBondContact O-CB 3.43Å; L343-N347 VanDerWaalsContact O-CG 3.26Å; L343-N347 PolarHBondContact O-N 3.31Å; L343-N347 PolarHBondContact O-ND2 2.91Å
344E84.4Confident82.5Confident118 Ų11889.9 Ų89.955%0.55144%0.438SS*.Hα-helixtrans-64.6-44.8175.4-76.8174.6172.100111.9V340 M341 N347 H348V340-E344 HydrophobicContact CG1-CG 4.3Å; V340-E344 WeakPolarHBondContact O-CB 3.26Å; V340-E344 VanDerWaalsContact O-CG 3.31Å; V340-E344 WeakPolarHBondContact O-CG 3.42Å; V340-E344 PolarHBondContact O-N 3.44Å; M341-E344 PolarHBondContact O-N 3.36Å; E344-N347 PolarHBondContact O-N 3.37Å; E344-H348 WeakPolarHBondContact O-CB 3.3Å; E344-H348 PolarHBondContact O-N 3.25Å
345T83.7Confident82.5Confident38 Ų3892.4 Ų92.423%0.23345%0.445CS..Hα-helixtrans-66.2-42176.252.60000111.7M341 E342 H348 M349M341-T345 WeakPolarHBondContact O-CG2 3.37Å; M341-T345 PolarHBondContact O-N 2.96Å; M341-T345 PolarHBondContact O-OG1 3.06Å; E342-T345 PolarHBondContact O-OG1 2.98Å; T345-H348 PolarHBondContact O-N 2.94Å; T345-M349 WeakPolarHBondContact O-CG 3.34Å; T345-M349 PolarHBondContact O-N 3.49Å
346Q81.4Confident82.6Confident115 Ų11588.9 Ų88.954%0.53743%0.427SS..Hα-helixtrans-61.9-43.4173.9-172.7179.21.800112E342 H348 M349 C350E342-Q346 VanDerWaalsContact O-CB 3.27Å; E342-Q346 WeakPolarHBondContact O-CB 3.27Å; E342-Q346 PolarHBondContact O-N 3.05Å; Q346-H348 VanDerWaalsContact C-N 3.35Å; Q346-M349 PolarHBondContact O-N 3.32Å; Q346-C350 WeakPolarHBondContact O-CB 3.27Å; Q346-C350 PolarHBondContact O-N 3.15Å
347N78.3Confident82.7Confident104 Ų10487.6 Ų87.656%0.55642%0.419SS*.Hα-helixtrans-62.6-41175-81.6-31.8000111.7L343 E344 C350 C351L343-N347 VanDerWaalsContact O-CB 3.26Å; L343-N347 WeakPolarHBondContact O-CB 3.43Å; L343-N347 VanDerWaalsContact O-CG 3.26Å; L343-N347 PolarHBondContact O-N 3.31Å; L343-N347 PolarHBondContact O-ND2 2.91Å; E344-N347 PolarHBondContact O-N 3.37Å; N347-C350 PolarHBondContact O-N 2.91Å; N347-C351 WeakPolarHBondContact O-CB 3.44Å; N347-C351 PolarHBondContact O-N 3.15Å; N347-C351 PolarHBondContact O-SG 2.91Å
348H84.4Confident82.7Confident120 Ų12083.1 Ų83.156%0.55641%0.408SS*.Hα-helixtrans-61.9-45.8176.6-173.262.7000112E344 T345 Q346 C351 N352E344-H348 WeakPolarHBondContact O-CB 3.3Å; E344-H348 PolarHBondContact O-N 3.25Å; T345-H348 PolarHBondContact O-N 2.94Å; Q346-H348 VanDerWaalsContact C-N 3.35Å; H348-C351 PolarHBondContact O-N 3.4Å; H348-N352 PolarHBondContact NE2-ND2 3.1Å; H348-N352 PolarHBondContact O-N 3.08Å
349M80.6Confident82.9Confident47 Ų4782 Ų8223%0.23240%0.402CS..Hα-helixtrans-62-46.6175.5-67.9-171.3-57.200111.8A250 T345 Q346 C351 N352 Q353A250-M349 HydrophobicContact CB-SD 4.06Å; T345-M349 WeakPolarHBondContact O-CG 3.34Å; T345-M349 PolarHBondContact O-N 3.49Å; Q346-M349 PolarHBondContact O-N 3.32Å; M349-C351 PolarHBondContact O-N 2.89Å; M349-N352 PolarHBondContact O-N 3.35Å; M349-Q353 WeakPolarHBondContact O-CG 3.43Å; M349-Q353 PolarHBondContact O-N 2.89Å
350C81.1Confident83.1Confident56 Ų5679.4 Ų79.438%0.37840%0.396SS..Hα-helixtrans-59.6-44.9177.9-173.80000111.7Q346 N347 N352 Q353 I354Q346-C350 WeakPolarHBondContact O-CB 3.27Å; Q346-C350 PolarHBondContact O-N 3.15Å; N347-C350 PolarHBondContact O-N 2.91Å; C350-N352 PolarHBondContact O-N 3.33Å; C350-Q353 PolarHBondContact O-N 3.47Å; C350-I354 VanDerWaalsContact O-CG1 3.32Å; C350-I354 WeakPolarHBondContact O-CG1 3.42Å; C350-I354 PolarHBondContact O-N 2.94Å
351C82.4Confident83.1Confident79 Ų7981.1 Ų81.153%0.53440%0.402SS..Hα-helixtrans-61.1-41.5175.4-76.20000112.6N347 H348 M349 R355N347-C351 WeakPolarHBondContact O-CB 3.44Å; N347-C351 PolarHBondContact O-N 3.15Å; N347-C351 PolarHBondContact O-SG 2.91Å; H348-C351 PolarHBondContact O-N 3.4Å; M349-C351 PolarHBondContact O-N 2.89Å; C351-R355 WeakPolarHBondContact O-CB 3.39Å; C351-R355 PolarHBondContact O-N 3.35Å
352N84.1Confident83.5Confident23 Ų2384 Ų8412%0.12341%0.413CS..Hα-helixtrans-66.1-40.6176.2-74.1-15.3000111.8E246 H348 M349 C350 R355 R356E246-N352 WeakPolarHBondContact OE1-CB 3.48Å; E246-N352 PolarHBondContact OE1-ND2 3.39Å; H348-N352 PolarHBondContact NE2-ND2 3.1Å; H348-N352 PolarHBondContact O-N 3.08Å; M349-N352 PolarHBondContact O-N 3.35Å; C350-N352 PolarHBondContact O-N 3.33Å; N352-R355 PolarHBondContact O-N 2.81Å; N352-R356 WeakPolarHBondContact O-CG 3.39Å; N352-R356 PolarHBondContact O-N 3.35Å
353Q80.8Confident84Confident76 Ų7686.3 Ų86.336%0.35542%0.422SS..Hα-helixtrans-62.5-47.5175.3-73.3176.1-500111.9M349 C350 R355 R356 Q357M349-Q353 WeakPolarHBondContact O-CG 3.43Å; M349-Q353 PolarHBondContact O-N 2.89Å; C350-Q353 PolarHBondContact O-N 3.47Å; Q353-R355 VanDerWaalsContact C-N 3.28Å; Q353-R355 PolarHBondContact O-N 2.92Å; Q353-R356 PolarHBondContact O-N 2.8Å; Q353-Q357 WeakPolarHBondContact O-CG 3.43Å; Q353-Q357 PolarHBondContact O-N 3.05Å
354I82.1Confident84.3Confident99 Ų9987.8 Ų87.851%0.50843%0.43SS..Hα-helixtrans-58.7-43176.1-69.3167.9000110.4C350 R356 Q357 D358C350-I354 VanDerWaalsContact O-CG1 3.32Å; C350-I354 WeakPolarHBondContact O-CG1 3.42Å; C350-I354 PolarHBondContact O-N 2.94Å; I354-R356 PolarHBondContact O-N 3.4Å; I354-Q357 PolarHBondContact O-N 3.25Å; I354-D358 WeakPolarHBondContact O-CB 3.3Å; I354-D358 PolarHBondContact O-N 3.45Å
355R85.7Confident84.6Confident131 Ų13185 Ų8549%0.49443%0.427SS..Hα-helixtrans-62.7-42.3177.7-175.5172.462.695.7-5.2112.3C351 N352 Q353 D358 E359C351-R355 WeakPolarHBondContact O-CB 3.39Å; C351-R355 PolarHBondContact O-N 3.35Å; N352-R355 PolarHBondContact O-N 2.81Å; Q353-R355 VanDerWaalsContact C-N 3.28Å; Q353-R355 PolarHBondContact O-N 2.92Å; R355-D358 PolarHBondContact O-N 3.4Å; R355-E359 IonicContact NH1-OE1 2.67Å; R355-E359 PolarHBondContact NH1-OE1 2.98Å; R355-E359 WeakPolarHBondContact O-CG 3.46Å; R355-E359 PolarHBondContact O-N 2.94Å
356R82.8Confident85Confident47 Ų4785.2 Ų85.218%0.17743%0.432CS..Hα-helixtrans-63.8-44175.3-71.8-177.9-171.3113.410.3111.8N239 E246 N352 Q353 I354 D358 E359 E360N239-R356 VanDerWaalsContact OD1-CD 3.3Å; N239-R356 WeakPolarHBondContact OD1-CD 3.24Å; E246-R356 IonicContact OE1-CZ 3.87Å; E246-R356 IonicContact OE1-NH1 3.61Å; E246-R356 PolarHBondContact OE1-NH1 3.36Å; E246-R356 IonicContact OE1-NH2 3.63Å; E246-R356 PolarHBondContact OE1-NH2 3.49Å; E246-R356 IonicContact OE2-CZ 2.62Å; E246-R356 IonicContact OE2-NH1 3.34Å; E246-R356 PolarHBondContact OE2-NH1 2.84Å; E246-R356 IonicContact OE2-NH2 2.85Å; N352-R356 WeakPolarHBondContact O-CG 3.39Å; N352-R356 PolarHBondContact O-N 3.35Å; Q353-R356 PolarHBondContact O-N 2.8Å; I354-R356 PolarHBondContact O-N 3.4Å; R356-D358 VanDerWaalsContact C-N 3.33Å; R356-D358 PolarHBondContact O-N 3.38Å; R356-E359 PolarHBondContact O-N 2.94Å; R356-E360 WeakPolarHBondContact O-CG 3.46Å; R356-E360 PolarHBondContact O-N 3.5Å
357Q84.2Confident85.5Confident105 Ų10585.3 Ų85.349%0.49143%0.433SS..Hα-helixtrans-62.9-39.5176.8-72177.9-14.800111.8Q353 I354 E360 L361Q353-Q357 WeakPolarHBondContact O-CG 3.43Å; Q353-Q357 PolarHBondContact O-N 3.05Å; I354-Q357 PolarHBondContact O-N 3.25Å; Q357-E360 PolarHBondContact O-N 2.89Å; Q357-L361 WeakPolarHBondContact O-CB 3.4Å; Q357-L361 VanDerWaalsContact O-CG 3.27Å; Q357-L361 WeakPolarHBondContact O-CG 3.38Å; Q357-L361 PolarHBondContact O-N 2.93Å
358D85.4Confident86.1Confident72 Ų7287.1 Ų87.139%0.38544%0.437SS..Hα-helixtrans-64.1-39.6174.7-173.465.1000112I354 R355 R356 L361 K362I354-D358 WeakPolarHBondContact O-CB 3.3Å; I354-D358 PolarHBondContact O-N 3.45Å; R355-D358 PolarHBondContact O-N 3.4Å; R356-D358 VanDerWaalsContact C-N 3.33Å; R356-D358 PolarHBondContact O-N 3.38Å; D358-L361 PolarHBondContact O-N 3.08Å; D358-K362 WeakPolarHBondContact O-CB 3.35Å; D358-K362 VanDerWaalsContact O-CG 3.29Å; D358-K362 WeakPolarHBondContact O-CG 3.42Å; D358-K362 PolarHBondContact O-N 3.41Å; D358-K362 VanDerWaalsContact OD2-CE 3.24Å; D358-K362 WeakPolarHBondContact OD2-CE 3.45Å; D358-K362 IonicContact OD2-NZ 2.76Å; D358-K362 PolarHBondContact OD2-NZ 2.97Å
359E87.3Confident86.5Confident86 Ų8687.2 Ų87.240%0.40244%0.438SS..Hα-helixtrans-65-40.6173.7-71.8171.4-162.600112.2R355 R356 K363R355-E359 IonicContact NH1-OE1 2.67Å; R355-E359 PolarHBondContact NH1-OE1 2.98Å; R355-E359 WeakPolarHBondContact O-CG 3.46Å; R355-E359 PolarHBondContact O-N 2.94Å; R356-E359 PolarHBondContact O-N 2.94Å; E359-K363 WeakPolarHBondContact O-CG 3.32Å; E359-K363 PolarHBondContact O-N 3.46Å; E359-K363 VanDerWaalsContact O-N 3.13Å
360E85.6Confident87.2Confident79 Ų7991.9 Ų91.937%0.36946%0.457SS..Hα-helixtrans-65.4-45.1174.1-73.2174.6-175.700111.9N239 R356 Q357 K362 K363 L364N239-E360 PolarHBondContact ND2-OE1 2.76Å; N239-E360 VanDerWaalsContact ND2-OE1 3.09Å; R356-E360 WeakPolarHBondContact O-CG 3.46Å; R356-E360 PolarHBondContact O-N 3.5Å; Q357-E360 PolarHBondContact O-N 2.89Å; E360-K362 VanDerWaalsContact C-N 3.33Å; E360-K362 PolarHBondContact O-N 2.91Å; E360-K363 WeakPolarHBondContact O-CB 3.36Å; E360-K363 PolarHBondContact O-N 3.45Å; E360-L364 WeakPolarHBondContact O-CG 3.39Å; E360-L364 PolarHBondContact O-N 3.41Å
361L84.5Confident87.7Confident112 Ų11293 Ų9359%0.58647%0.465SS*.Hα-helixtrans-61.9-39.9176.4-74.3173.7000111.8Q357 D358 L364 A365Q357-L361 WeakPolarHBondContact O-CB 3.4Å; Q357-L361 VanDerWaalsContact O-CG 3.27Å; Q357-L361 WeakPolarHBondContact O-CG 3.38Å; Q357-L361 PolarHBondContact O-N 2.93Å; D358-L361 PolarHBondContact O-N 3.08Å; L361-L364 PolarHBondContact O-N 2.92Å; L361-A365 VanDerWaalsContact O-CB 3.26Å; L361-A365 WeakPolarHBondContact O-CB 3.27Å; L361-A365 PolarHBondContact O-N 2.89Å
362K91.9Very high88.3Confident128 Ų12890.6 Ų90.656%0.55745%0.449SS*.Hα-helixtrans-62.2-40.6173.7-79.1167.6175.91600112.4D358 E360 A366D358-K362 WeakPolarHBondContact O-CB 3.35Å; D358-K362 VanDerWaalsContact O-CG 3.29Å; D358-K362 WeakPolarHBondContact O-CG 3.42Å; D358-K362 PolarHBondContact O-N 3.41Å; D358-K362 VanDerWaalsContact OD2-CE 3.24Å; D358-K362 WeakPolarHBondContact OD2-CE 3.45Å; D358-K362 IonicContact OD2-NZ 2.76Å; D358-K362 PolarHBondContact OD2-NZ 2.97Å; E360-K362 VanDerWaalsContact C-N 3.33Å; E360-K362 PolarHBondContact O-N 2.91Å; K362-A366 PolarHBondContact O-N 2.92Å; K362-A366 VanDerWaalsContact O-N 3.08Å
363K90.2Very high88.8Confident106 Ų10692.9 Ų92.946%0.46146%0.461SS..Hα-helixtrans-65-48.8175.7-72.1172.9-176.7178.40111.2E359 E360 A365 A366 E367E359-K363 WeakPolarHBondContact O-CG 3.32Å; E359-K363 PolarHBondContact O-N 3.46Å; E359-K363 VanDerWaalsContact O-N 3.13Å; E360-K363 WeakPolarHBondContact O-CB 3.36Å; E360-K363 PolarHBondContact O-N 3.45Å; K363-A365 VanDerWaalsContact C-N 3.31Å; K363-A365 PolarHBondContact O-N 3.31Å; K363-A366 PolarHBondContact O-N 2.89Å; K363-E367 WeakPolarHBondContact O-CG 3.28Å; K363-E367 PolarHBondContact O-N 3.01Å
364L89.1Confident89.4Confident103 Ų10392.3 Ų92.354%0.53946%0.463SS..Hα-helixtrans-61.4-39177.4-71.5172.4000112E360 L361 E367 H368E360-L364 WeakPolarHBondContact O-CG 3.39Å; E360-L364 PolarHBondContact O-N 3.41Å; L361-L364 PolarHBondContact O-N 2.92Å; L364-E367 PolarHBondContact O-N 3.18Å; L364-H368 WeakPolarHBondContact O-CB 3.42Å; L364-H368 PolarHBondContact O-N 3.3Å
365A90.4Very high89.9Confident60 Ų6092.8 Ų92.850%0.49646%0.463SS..Hα-helixtrans-62.5-42.7174.700000112L361 K363 H368 E369L361-A365 VanDerWaalsContact O-CB 3.26Å; L361-A365 WeakPolarHBondContact O-CB 3.27Å; L361-A365 PolarHBondContact O-N 2.89Å; K363-A365 VanDerWaalsContact C-N 3.31Å; K363-A365 PolarHBondContact O-N 3.31Å; A365-H368 PolarHBondContact O-N 3.37Å; A365-E369 WeakPolarHBondContact O-CB 3.42Å; A365-E369 PolarHBondContact O-N 2.88Å
366A92.9Very high90.4Very high41 Ų4191.8 Ų91.834%0.33946%0.462SS..Hα-helixtrans-67.4-35.6176.300000112.7K362 K363 K370K362-A366 PolarHBondContact O-N 2.92Å; K362-A366 VanDerWaalsContact O-N 3.08Å; K363-A366 PolarHBondContact O-N 2.89Å; A366-K370 VanDerWaalsContact O-CG 3.32Å; A366-K370 WeakPolarHBondContact O-CG 3.22Å; A366-K370 PolarHBondContact O-N 2.87Å; A366-K370 VanDerWaalsContact O-N 3.08Å
367E91.7Very high91Very high118 Ų11893.7 Ų93.755%0.55148%0.476SS*.Hα-helixtrans-68-42.9173.4-72.5179.117400111.9K363 L364 E369 K370 C371K363-E367 WeakPolarHBondContact O-CG 3.28Å; K363-E367 PolarHBondContact O-N 3.01Å; L364-E367 PolarHBondContact O-N 3.18Å; E367-E369 VanDerWaalsContact C-N 3.34Å; E367-E369 PolarHBondContact O-N 3.46Å; E367-K370 PolarHBondContact O-N 3.31Å; E367-C371 WeakPolarHBondContact O-CB 3.24Å; E367-C371 PolarHBondContact O-N 2.89Å
368H90.2Very high91.5Very high141 Ų14196.2 Ų96.265%0.65348%0.482SS*.Hα-helixtrans-61.2-42.4174179.3-84.1000111.6L364 A365 C371 S372L364-H368 WeakPolarHBondContact O-CB 3.42Å; L364-H368 PolarHBondContact O-N 3.3Å; A365-H368 PolarHBondContact O-N 3.37Å; H368-C371 PolarHBondContact O-N 2.96Å; H368-S372 VanDerWaalsContact O-CB 3.32Å; H368-S372 WeakPolarHBondContact O-CB 3.49Å; H368-S372 PolarHBondContact O-N 3.37Å
369E93.7Very high92Very high123 Ų12397.4 Ų97.458%0.57549%0.485SS*.Hα-helixtrans-61.2-44.4175.5-172.7-179.3-179.700111.9A365 E367 S372 N373A365-E369 WeakPolarHBondContact O-CB 3.42Å; A365-E369 PolarHBondContact O-N 2.88Å; E367-E369 VanDerWaalsContact C-N 3.34Å; E367-E369 PolarHBondContact O-N 3.46Å; E369-S372 PolarHBondContact O-N 2.91Å; E369-N373 VanDerWaalsContact O-CG 3.26Å; E369-N373 PolarHBondContact O-N 2.86Å; E369-N373 PolarHBondContact O-ND2 3.3Å
370K94.5Very high92.4Very high144 Ų14498 Ų9863%0.62649%0.491SS*.Hα-helixtrans-60.2-47.1174.5-73.3171.8-176.1176.60111.8A366 E367 N373 T374A366-K370 VanDerWaalsContact O-CG 3.32Å; A366-K370 WeakPolarHBondContact O-CG 3.22Å; A366-K370 PolarHBondContact O-N 2.87Å; A366-K370 VanDerWaalsContact O-N 3.08Å; E367-K370 PolarHBondContact O-N 3.31Å; K370-N373 PolarHBondContact O-N 2.99Å; K370-T374 PolarHBondContact O-N 3.37Å; K370-T374 PolarHBondContact O-OG1 2.88Å
371C91.8Very high92.9Very high79 Ų7999.3 Ų99.353%0.53450%0.497SS..Hα-helixtrans-60.9-45.7177.9-169.50000111.4E367 H368 N373 T374 E375E367-C371 WeakPolarHBondContact O-CB 3.24Å; E367-C371 PolarHBondContact O-N 2.89Å; H368-C371 PolarHBondContact O-N 2.96Å; C371-N373 VanDerWaalsContact C-N 3.31Å; C371-N373 PolarHBondContact O-N 3.42Å; C371-T374 WeakPolarHBondContact CA-OG1 3.34Å; C371-T374 PolarHBondContact O-N 2.84Å; C371-T374 PolarHBondContact O-OG1 2.87Å; C371-E375 WeakPolarHBondContact O-CB 3.45Å; C371-E375 PolarHBondContact O-N 2.83Å
372S94.6Very high93.4Very high29 Ų2999.2 Ų99.220%0.20350%0.496CS..Hα-helixtrans-58.4-40.1175152.60000112.1H368 E369 E375 K376H368-S372 VanDerWaalsContact O-CB 3.32Å; H368-S372 WeakPolarHBondContact O-CB 3.49Å; H368-S372 PolarHBondContact O-N 3.37Å; E369-S372 PolarHBondContact O-N 2.91Å; S372-E375 PolarHBondContact O-N 2.88Å; S372-K376 VanDerWaalsContact O-CG 3.31Å; S372-K376 WeakPolarHBondContact O-CG 3.32Å; S372-K376 PolarHBondContact O-N 3.37Å; S372-K376 VanDerWaalsContact O-N 3.1Å
373N95.4Very high93.6Very high71 Ų7198 Ų9838%0.3850%0.495SS..Hα-helixtrans-68.5-43.9177.2-69.3-18.3000111.6E369 K370 C371 E375 K376 D377E369-N373 VanDerWaalsContact O-CG 3.26Å; E369-N373 PolarHBondContact O-N 2.86Å; E369-N373 PolarHBondContact O-ND2 3.3Å; K370-N373 PolarHBondContact O-N 2.99Å; C371-N373 VanDerWaalsContact C-N 3.31Å; C371-N373 PolarHBondContact O-N 3.42Å; N373-E375 VanDerWaalsContact C-N 3.3Å; N373-E375 PolarHBondContact O-N 3.35Å; N373-K376 PolarHBondContact O-N 2.94Å; N373-D377 PolarHBondContact O-N 2.88Å
374T94Very high93.9Very high65 Ų6598.7 Ų98.740%0.39950%0.5SS..Hα-helixtrans-63.2-36175.355.70000112.7K370 C371 D377 Y378K370-T374 PolarHBondContact O-N 3.37Å; K370-T374 PolarHBondContact O-OG1 2.88Å; C371-T374 WeakPolarHBondContact CA-OG1 3.34Å; C371-T374 PolarHBondContact O-N 2.84Å; C371-T374 PolarHBondContact O-OG1 2.87Å; T374-D377 PolarHBondContact O-N 3.43Å; T374-Y378 WeakPolarHBondContact O-CD2 3.34Å; T374-Y378 PolarHBondContact O-N 3.41Å
375E92.7Very high94.2Very high108 Ų10898.4 Ų98.451%0.50550%0.496SS..Hα-helixtrans-63.6-44175.4-171.4-170.9164.800111.3C371 S372 N373 D377 Y378 Q379C371-E375 WeakPolarHBondContact O-CB 3.45Å; C371-E375 PolarHBondContact O-N 2.83Å; S372-E375 PolarHBondContact O-N 2.88Å; N373-E375 VanDerWaalsContact C-N 3.3Å; N373-E375 PolarHBondContact O-N 3.35Å; E375-D377 VanDerWaalsContact C-N 3.32Å; E375-D377 PolarHBondContact O-N 2.89Å; E375-Y378 PolarHBondContact O-N 2.94Å; E375-Q379 WeakPolarHBondContact O-CB 3.45Å; E375-Q379 VanDerWaalsContact O-CG 3.3Å; E375-Q379 WeakPolarHBondContact O-CG 3.39Å; E375-Q379 PolarHBondContact O-N 3.43Å; E375-Q379 PolarHBondContact OE1-NE2 2.91Å; E375-Q379 VanDerWaalsContact OE1-NE2 3.07Å
376K96.1Very high94.5Very high110 Ų110102.6 Ų102.648%0.47850%0.499SS..Hα-helixtrans-60.8-41.5174.8-70.4169.5-170.9171.10111.8S372 N373 Q379 L380S372-K376 VanDerWaalsContact O-CG 3.31Å; S372-K376 WeakPolarHBondContact O-CG 3.32Å; S372-K376 PolarHBondContact O-N 3.37Å; S372-K376 VanDerWaalsContact O-N 3.1Å; N373-K376 PolarHBondContact O-N 2.94Å; K376-Q379 PolarHBondContact O-N 3.3Å; K376-L380 WeakPolarHBondContact O-CG 3.47Å; K376-L380 PolarHBondContact O-N 2.77Å
377D95Very high94.7Very high87 Ų87104.6 Ų104.647%0.46551%0.507SS..Hα-helixtrans-63-43.3176.7-66.3-22.5000111.3N373 T374 E375 L380 Q381N373-D377 PolarHBondContact O-N 2.88Å; T374-D377 PolarHBondContact O-N 3.43Å; E375-D377 VanDerWaalsContact C-N 3.32Å; E375-D377 PolarHBondContact O-N 2.89Å; D377-L380 PolarHBondContact O-N 3.35Å; D377-Q381 WeakPolarHBondContact O-CG 3.5Å; D377-Q381 PolarHBondContact O-N 3.49Å
378Y95.1Very high94.9Very high158 Ų158105.1 Ų105.162%0.6250%0.504SS*.Hα-helixtrans-66.4-36.7174.8-70.3-53.1000112.9T374 E375 Q381 L382T374-Y378 WeakPolarHBondContact O-CD2 3.34Å; T374-Y378 PolarHBondContact O-N 3.41Å; E375-Y378 PolarHBondContact O-N 2.94Å; Y378-Q381 PolarHBondContact O-N 3.38Å; Y378-L382 VanDerWaalsContact O-CB 3.31Å; Y378-L382 WeakPolarHBondContact O-CB 3.49Å; Y378-L382 PolarHBondContact O-N 2.94Å
379Q95.5Very high95.2Very high97 Ų97101 Ų10145%0.45349%0.494SS..Hα-helixtrans-64.4-40174.4-73.9176.38.300111.5E375 K376 L382 L383E375-Q379 WeakPolarHBondContact O-CB 3.45Å; E375-Q379 VanDerWaalsContact O-CG 3.3Å; E375-Q379 WeakPolarHBondContact O-CG 3.39Å; E375-Q379 PolarHBondContact O-N 3.43Å; E375-Q379 PolarHBondContact OE1-NE2 2.91Å; E375-Q379 VanDerWaalsContact OE1-NE2 3.07Å; K376-Q379 PolarHBondContact O-N 3.3Å; Q379-L382 PolarHBondContact O-N 3.22Å; Q379-L383 WeakPolarHBondContact O-CG 3.31Å; Q379-L383 PolarHBondContact O-N 3.27Å
380L96.3Very high95.3Very high99 Ų9999.3 Ų99.352%0.51849%0.489SS..Hα-helixtrans-64.6-47174.2-72.8171.8000111.6K376 D377 L382 L383 E384K376-L380 WeakPolarHBondContact O-CG 3.47Å; K376-L380 PolarHBondContact O-N 2.77Å; D377-L380 PolarHBondContact O-N 3.35Å; L380-L382 VanDerWaalsContact C-N 3.31Å; L380-L382 PolarHBondContact O-N 2.9Å; L380-L383 WeakPolarHBondContact O-CB 3.38Å; L380-L383 PolarHBondContact O-N 3.28Å; L380-L383 VanDerWaalsContact O-N 3.13Å; L380-E384 WeakPolarHBondContact O-CG 3.48Å; L380-E384 PolarHBondContact O-N 2.99Å
381Q96.1Very high95.4Very high107 Ų10796.6 Ų96.650%0.548%0.482SS..Hα-helixtrans-59.6-41.3175.5-71.7173.112.100112D377 Y378 L383 E384 E385D377-Q381 WeakPolarHBondContact O-CG 3.5Å; D377-Q381 PolarHBondContact O-N 3.49Å; Y378-Q381 PolarHBondContact O-N 3.38Å; Q381-L383 VanDerWaalsContact C-N 3.31Å; Q381-L383 PolarHBondContact O-N 3.23Å; Q381-E384 PolarHBondContact O-N 2.88Å; Q381-E385 WeakPolarHBondContact O-CG 3.4Å; Q381-E385 PolarHBondContact O-N 3.33Å
382L94.5Very high95.6Very high109 Ų10997.2 Ų97.257%0.57148%0.479SS*.Hα-helixtrans-63.9-36.8176.6-176.965.9000112.1Y378 Q379 L380 R386Y378-L382 VanDerWaalsContact O-CB 3.31Å; Y378-L382 WeakPolarHBondContact O-CB 3.49Å; Y378-L382 PolarHBondContact O-N 2.94Å; Q379-L382 PolarHBondContact O-N 3.22Å; L380-L382 VanDerWaalsContact C-N 3.31Å; L380-L382 PolarHBondContact O-N 2.9Å; L382-R386 VanDerWaalsContact O-CB 3.25Å; L382-R386 WeakPolarHBondContact O-CB 3.14Å; L382-R386 PolarHBondContact O-N 2.91Å
383L96.6Very high95.7Very high103 Ų103100.4 Ų100.454%0.53949%0.491SS..Hα-helixtrans-67.2-43.1173.9-73.2170.3000111.3Q379 L380 Q381 R386 V387Q379-L383 WeakPolarHBondContact O-CG 3.31Å; Q379-L383 PolarHBondContact O-N 3.27Å; L380-L383 WeakPolarHBondContact O-CB 3.38Å; L380-L383 PolarHBondContact O-N 3.28Å; L380-L383 VanDerWaalsContact O-N 3.13Å; Q381-L383 VanDerWaalsContact C-N 3.31Å; Q381-L383 PolarHBondContact O-N 3.23Å; L383-R386 PolarHBondContact O-N 2.96Å; L383-V387 WeakPolarHBondContact O-CG2 3.21Å; L383-V387 PolarHBondContact O-N 2.8Å
384E96.4Very high95.8Very high121 Ų121100.4 Ų100.457%0.56550%0.496SS*.Hα-helixtrans-62.2-46176.5-71.7177.5179.300112.2L380 Q381 R386 V387 R388L380-E384 WeakPolarHBondContact O-CG 3.48Å; L380-E384 PolarHBondContact O-N 2.99Å; Q381-E384 PolarHBondContact O-N 2.88Å; E384-R386 VanDerWaalsContact C-N 3.32Å; E384-R386 PolarHBondContact O-N 2.72Å; E384-V387 PolarHBondContact O-N 3.38Å; E384-R388 PolarHBondContact O-N 3.35Å
385E94.7Very high95.9Very high96 Ų96102.4 Ų102.445%0.44950%0.501SS..Hα-helixtrans-66.3-34.7176.2-68.8-54146.100112Q381 R388 A389Q381-E385 WeakPolarHBondContact O-CG 3.4Å; Q381-E385 PolarHBondContact O-N 3.33Å; E385-R388 PolarHBondContact O-N 3.39Å; E385-R388 IonicContact OE1-CZ 3.36Å; E385-R388 IonicContact OE1-NH1 3.58Å; E385-R388 PolarHBondContact OE1-NH1 2.91Å; E385-R388 IonicContact OE1-NH2 3.39Å; E385-R388 IonicContact OE2-CZ 3.67Å; E385-R388 IonicContact OE2-NH1 2.77Å; E385-R388 PolarHBondContact OE2-NH1 3.17Å; E385-A389 WeakPolarHBondContact O-CB 3.36Å; E385-A389 PolarHBondContact O-N 3.45Å
386R96.8Very high96Very high149 Ų149102.6 Ų102.656%0.56251%0.505SS*.Hα-helixtrans-64.9-42.2174-179.4179-66.4-83-0.4111.7L382 L383 E384 A389 N390L382-R386 VanDerWaalsContact O-CB 3.25Å; L382-R386 WeakPolarHBondContact O-CB 3.14Å; L382-R386 PolarHBondContact O-N 2.91Å; L383-R386 PolarHBondContact O-N 2.96Å; E384-R386 VanDerWaalsContact C-N 3.32Å; E384-R386 PolarHBondContact O-N 2.72Å; R386-A389 PolarHBondContact O-N 3.47Å; R386-N390 PolarHBondContact O-N 2.86Å; R386-N390 PolarHBondContact O-ND2 2.85Å
387V97.1Very high96.1Very high83 Ų83103.1 Ų103.150%0.50351%0.507SS..Hα-helixtrans-62.2-47.3174.7171.60000109.9L383 E384 A389 N390 D391L383-V387 WeakPolarHBondContact O-CG2 3.21Å; L383-V387 PolarHBondContact O-N 2.8Å; E384-V387 PolarHBondContact O-N 3.38Å; V387-A389 VanDerWaalsContact C-N 3.33Å; V387-A389 PolarHBondContact O-N 2.94Å; V387-N390 WeakPolarHBondContact O-CB 3.26Å; V387-N390 PolarHBondContact O-N 2.88Å; V387-N390 VanDerWaalsContact O-N 3.15Å; V387-D391 PolarHBondContact O-N 3.21Å
388R96.5Very high96.1Very high128 Ų128104.7 Ų104.748%0.48351%0.512SS..Hα-helixtrans-60.4-40.7177.8-169.7-176.3-66.9145.82.8112.7E384 E385 D391 L392E384-R388 PolarHBondContact O-N 3.35Å; E385-R388 PolarHBondContact O-N 3.39Å; E385-R388 IonicContact OE1-CZ 3.36Å; E385-R388 IonicContact OE1-NH1 3.58Å; E385-R388 PolarHBondContact OE1-NH1 2.91Å; E385-R388 IonicContact OE1-NH2 3.39Å; E385-R388 IonicContact OE2-CZ 3.67Å; E385-R388 IonicContact OE2-NH1 2.77Å; E385-R388 PolarHBondContact OE2-NH1 3.17Å; R388-D391 PolarHBondContact O-N 3.43Å; R388-L392 WeakPolarHBondContact O-CG 3.38Å; R388-L392 PolarHBondContact O-N 3.45Å
389A95.1Very high96.2Very high55 Ų55102.3 Ų102.346%0.45551%0.51SS..Hα-helixtrans-64-41.617600000112E385 R386 V387 D391 L392 E393E385-A389 WeakPolarHBondContact O-CB 3.36Å; E385-A389 PolarHBondContact O-N 3.45Å; R386-A389 PolarHBondContact O-N 3.47Å; V387-A389 VanDerWaalsContact C-N 3.33Å; V387-A389 PolarHBondContact O-N 2.94Å; A389-D391 VanDerWaalsContact C-N 3.35Å; A389-L392 PolarHBondContact O-N 3.29Å; A389-E393 WeakPolarHBondContact O-CB 3.23Å; A389-E393 PolarHBondContact O-N 3.24Å
390N97.1Very high96.2Very high88 Ų88101.1 Ų101.147%0.47151%0.509SS..Hα-helixtrans-63.4-40.3175.3-68.3-19.6000111.7R386 V387 E393 S394R386-N390 PolarHBondContact O-N 2.86Å; R386-N390 PolarHBondContact O-ND2 2.85Å; V387-N390 WeakPolarHBondContact O-CB 3.26Å; V387-N390 PolarHBondContact O-N 2.88Å; V387-N390 VanDerWaalsContact O-N 3.15Å; N390-E393 PolarHBondContact O-N 3.47Å; N390-S394 WeakPolarHBondContact O-CB 3.44Å; N390-S394 PolarHBondContact O-N 2.9Å
391D96.6Very high96.3Very high87 Ų87101 Ų10147%0.46551%0.512SS..Hα-helixtrans-63.5-44.3176.8-68.2-22.6000111.4V387 R388 A389 S394 Q395V387-D391 PolarHBondContact O-N 3.21Å; R388-D391 PolarHBondContact O-N 3.43Å; A389-D391 VanDerWaalsContact C-N 3.35Å; D391-S394 WeakPolarHBondContact O-CB 3.33Å; D391-S394 PolarHBondContact O-N 3.3Å; D391-Q395 WeakPolarHBondContact O-CG 3.48Å; D391-Q395 PolarHBondContact O-N 3.43Å
392L96.2Very high96.3Very high91 Ų9199.9 Ų99.948%0.47651%0.509SS..Hα-helixtrans-65.6-39.9175.9-71.7173.2000112.2R388 A389 S394 Q395 L396R388-L392 WeakPolarHBondContact O-CG 3.38Å; R388-L392 PolarHBondContact O-N 3.45Å; A389-L392 PolarHBondContact O-N 3.29Å; L392-S394 VanDerWaalsContact C-N 3.3Å; L392-S394 PolarHBondContact O-N 2.79Å; L392-Q395 PolarHBondContact O-N 3.39Å; L392-L396 WeakPolarHBondContact O-CB 3.28Å; L392-L396 WeakPolarHBondContact O-CG 3.3Å; L392-L396 PolarHBondContact O-N 2.83Å
393E96.7Very high96.4Very high96 Ų9697.5 Ų97.545%0.44950%0.502SS..Hα-helixtrans-63.5-38.7175-166.2-170.9155.200111.2A389 N390 L396 K397A389-E393 WeakPolarHBondContact O-CB 3.23Å; A389-E393 PolarHBondContact O-N 3.24Å; N390-E393 PolarHBondContact O-N 3.47Å; E393-L396 PolarHBondContact O-N 3.16Å; E393-K397 WeakPolarHBondContact O-CB 3.4Å; E393-K397 VanDerWaalsContact O-CG 3.31Å; E393-K397 WeakPolarHBondContact O-CG 3.34Å; E393-K397 PolarHBondContact O-N 2.85Å; E393-K397 WeakPolarHBondContact OE1-CE 3.35Å; E393-K397 IonicContact OE1-NZ 3.69Å; E393-K397 PolarHBondContact OE1-NZ 3.28Å
394S96.2Very high96.4Very high71 Ų7199.1 Ų99.150%0.49750%0.504SS..Hα-helixtrans-63.1-45.5173.4-169.50000111.7N390 D391 L392 L396 K397 E398N390-S394 WeakPolarHBondContact O-CB 3.44Å; N390-S394 PolarHBondContact O-N 2.9Å; D391-S394 WeakPolarHBondContact O-CB 3.33Å; D391-S394 PolarHBondContact O-N 3.3Å; L392-S394 VanDerWaalsContact C-N 3.3Å; L392-S394 PolarHBondContact O-N 2.79Å; S394-L396 PolarHBondContact O-N 3.47Å; S394-K397 PolarHBondContact O-N 3.48Å; S394-E398 PolarHBondContact O-N 2.88Å
395Q96.7Very high96.4Very high107 Ų10797.5 Ų97.550%0.550%0.499SS..Hα-helixtrans-62.2-41.5176.4-71.7172.71800112.1D391 L392 E398 L399D391-Q395 WeakPolarHBondContact O-CG 3.48Å; D391-Q395 PolarHBondContact O-N 3.43Å; L392-Q395 PolarHBondContact O-N 3.39Å; Q395-E398 PolarHBondContact O-N 3.46Å; Q395-L399 WeakPolarHBondContact O-CG 3.27Å; Q395-L399 PolarHBondContact O-N 2.81Å
396L95.6Very high96.4Very high113 Ų11397 Ų9759%0.59250%0.499SS*.Hα-helixtrans-65.6-39.2176.4-74.2174.2000112.2L392 E393 S394 T400L392-L396 WeakPolarHBondContact O-CB 3.28Å; L392-L396 WeakPolarHBondContact O-CG 3.3Å; L392-L396 PolarHBondContact O-N 2.83Å; E393-L396 PolarHBondContact O-N 3.16Å; S394-L396 PolarHBondContact O-N 3.47Å; L396-T400 WeakPolarHBondContact O-CB 3.46Å; L396-T400 PolarHBondContact O-N 3.22Å; L396-T400 PolarHBondContact O-OG1 2.76Å
397K96.5Very high96.4Very high120 Ų12095.2 Ų95.252%0.52250%0.497SS..Hα-helixtrans-62.5-44.1173.6-75.7170.3-175.2164.10111.1E393 S394 T400 V401E393-K397 WeakPolarHBondContact O-CB 3.4Å; E393-K397 VanDerWaalsContact O-CG 3.31Å; E393-K397 WeakPolarHBondContact O-CG 3.34Å; E393-K397 PolarHBondContact O-N 2.85Å; E393-K397 WeakPolarHBondContact OE1-CE 3.35Å; E393-K397 IonicContact OE1-NZ 3.69Å; E393-K397 PolarHBondContact OE1-NZ 3.28Å; S394-K397 PolarHBondContact O-N 3.48Å; K397-T400 PolarHBondContact O-N 3.37Å; K397-V401 WeakPolarHBondContact O-CG2 3.38Å; K397-V401 PolarHBondContact O-N 2.95Å
398E96.6Very high96.4Very high121 Ų12194 Ų9457%0.56550%0.496SS*.Hα-helixtrans-61.1-49.7176.4-173.8178.1177.100111.8S394 Q395 T400 V401 L402S394-E398 PolarHBondContact O-N 2.88Å; Q395-E398 PolarHBondContact O-N 3.46Å; E398-T400 VanDerWaalsContact C-N 3.3Å; E398-T400 PolarHBondContact O-N 3.04Å; E398-V401 WeakPolarHBondContact O-CB 3.31Å; E398-V401 PolarHBondContact O-N 2.91Å; E398-V401 VanDerWaalsContact O-N 3.08Å; E398-L402 HydrophobicContact CG-CD1 4.42Å; E398-L402 WeakPolarHBondContact O-CG 3.42Å; E398-L402 PolarHBondContact O-N 2.77Å
399L95.9Very high96.4Very high108 Ų10893.1 Ų93.157%0.56550%0.497SS*.Hα-helixtrans-60.6-38176.5-72.6173.2000112.6Q395 V401 L402 S403Q395-L399 WeakPolarHBondContact O-CG 3.27Å; Q395-L399 PolarHBondContact O-N 2.81Å; L399-V401 VanDerWaalsContact C-N 3.32Å; L399-L402 PolarHBondContact O-N 2.93Å; L399-S403 WeakPolarHBondContact O-CB 3.4Å; L399-S403 PolarHBondContact O-N 3.1Å
400T96.6Very high96.4Very high72 Ų7296.5 Ų96.544%0.44251%0.507SS..Hα-helixtrans-65.7-37175.7-56.90000111.4L396 K397 E398 K404L396-T400 WeakPolarHBondContact O-CB 3.46Å; L396-T400 PolarHBondContact O-N 3.22Å; L396-T400 PolarHBondContact O-OG1 2.76Å; K397-T400 PolarHBondContact O-N 3.37Å; E398-T400 VanDerWaalsContact C-N 3.3Å; E398-T400 PolarHBondContact O-N 3.04Å; T400-K404 HydrophobicContact CG2-CD 4.45Å; T400-K404 WeakPolarHBondContact O-CB 3.15Å; T400-K404 VanDerWaalsContact O-CG 3.29Å; T400-K404 WeakPolarHBondContact O-CG 3.47Å; T400-K404 PolarHBondContact O-N 2.91Å; T400-K404 VanDerWaalsContact O-N 3.15Å
401V97.1Very high96.4Very high97 Ų9798.2 Ų98.259%0.58852%0.516SS*.Hα-helixtrans-68-43.6175171.20000110.7K397 E398 L399 K404 L405K397-V401 WeakPolarHBondContact O-CG2 3.38Å; K397-V401 PolarHBondContact O-N 2.95Å; E398-V401 WeakPolarHBondContact O-CB 3.31Å; E398-V401 PolarHBondContact O-N 2.91Å; E398-V401 VanDerWaalsContact O-N 3.08Å; L399-V401 VanDerWaalsContact C-N 3.32Å; V401-K404 PolarHBondContact O-N 3.3Å; V401-L405 WeakPolarHBondContact O-CB 3.38Å; V401-L405 PolarHBondContact O-N 3.35Å
402L96.1Very high96.3Very high83 Ų8399.8 Ų99.844%0.43552%0.52SS..Hα-helixtrans-61.4-47.6176.2-70.1172.4000111.8E398 L399 K404 L405 D406E398-L402 HydrophobicContact CG-CD1 4.42Å; E398-L402 WeakPolarHBondContact O-CG 3.42Å; E398-L402 PolarHBondContact O-N 2.77Å; L399-L402 PolarHBondContact O-N 2.93Å; L402-K404 VanDerWaalsContact C-N 3.29Å; L402-K404 PolarHBondContact O-N 3.2Å; L402-L405 WeakPolarHBondContact O-CB 3.38Å; L402-L405 PolarHBondContact O-N 3.2Å; L402-D406 PolarHBondContact O-N 2.87Å
403S96.6Very high96.4Very high59 Ų5998.8 Ų98.841%0.41352%0.517SS..Hα-helixtrans-59.1-39.5176.7-173.40000112.5L399 L405 E407L399-S403 WeakPolarHBondContact O-CB 3.4Å; L399-S403 PolarHBondContact O-N 3.1Å; S403-L405 VanDerWaalsContact C-N 3.33Å; S403-E407 WeakPolarHBondContact O-CB 3.46Å; S403-E407 VanDerWaalsContact O-CG 3.3Å; S403-E407 WeakPolarHBondContact O-CG 3.28Å; S403-E407 PolarHBondContact O-N 3.38Å
404K96.6Very high96.3Very high136 Ų13697.7 Ų97.759%0.59152%0.515SS*.Hα-helixtrans-69.2-32.2176.3-76177.6178.9-177.90112.6T400 V401 L402 A408T400-K404 HydrophobicContact CG2-CD 4.45Å; T400-K404 WeakPolarHBondContact O-CB 3.15Å; T400-K404 VanDerWaalsContact O-CG 3.29Å; T400-K404 WeakPolarHBondContact O-CG 3.47Å; T400-K404 PolarHBondContact O-N 2.91Å; T400-K404 VanDerWaalsContact O-N 3.15Å; V401-K404 PolarHBondContact O-N 3.3Å; L402-K404 VanDerWaalsContact C-N 3.29Å; L402-K404 PolarHBondContact O-N 3.2Å; K404-A408 WeakPolarHBondContact O-CB 3.48Å; K404-A408 PolarHBondContact O-N 2.93Å
405L96.7Very high96.3Very high87 Ų8795.7 Ų95.746%0.45551%0.505SS..Hα-helixtrans-69.8-46.7175.4-173.5132.1000110.2V401 L402 S403 E407 A408 E409V401-L405 WeakPolarHBondContact O-CB 3.38Å; V401-L405 PolarHBondContact O-N 3.35Å; L402-L405 WeakPolarHBondContact O-CB 3.38Å; L402-L405 PolarHBondContact O-N 3.2Å; S403-L405 VanDerWaalsContact C-N 3.33Å; L405-E407 VanDerWaalsContact C-N 3.34Å; L405-E407 PolarHBondContact O-N 3.46Å; L405-A408 WeakPolarHBondContact O-CB 3.45Å; L405-A408 PolarHBondContact O-N 3.21Å; L405-A408 VanDerWaalsContact O-N 3.08Å; L405-E409 HydrophobicContact CD2-CG 4.46Å; L405-E409 VanDerWaalsContact CD2-OE1 3.3Å; L405-E409 WeakPolarHBondContact CD2-OE1 3.38Å; L405-E409 WeakPolarHBondContact O-CG 3.44Å; L405-E409 PolarHBondContact O-N 2.91Å
406D95.9Very high96.3Very high86 Ų8695.7 Ų95.746%0.4651%0.505SS..Hα-helixtrans-59.3-43.1174.7-67.7-9.1000111.6L402 A408 E409 L410L402-D406 PolarHBondContact O-N 2.87Å; D406-A408 VanDerWaalsContact C-N 3.33Å; D406-A408 PolarHBondContact O-N 3.44Å; D406-E409 PolarHBondContact O-N 2.84Å; D406-L410 WeakPolarHBondContact O-CG 3.43Å; D406-L410 PolarHBondContact O-N 2.86Å
407E96.1Very high96.4Very high111 Ų11195 Ų9552%0.51950%0.502SS..Hα-helixtrans-60.8-40.8173.8-77.8173.5-165.700112.3S403 L405 L410 L411S403-E407 WeakPolarHBondContact O-CB 3.46Å; S403-E407 VanDerWaalsContact O-CG 3.3Å; S403-E407 WeakPolarHBondContact O-CG 3.28Å; S403-E407 PolarHBondContact O-N 3.38Å; L405-E407 VanDerWaalsContact C-N 3.34Å; L405-E407 PolarHBondContact O-N 3.46Å; E407-L410 PolarHBondContact O-N 2.88Å; E407-L411 WeakPolarHBondContact O-CB 3.41Å; E407-L411 VanDerWaalsContact O-CG 3.27Å; E407-L411 WeakPolarHBondContact O-CG 3.33Å; E407-L411 PolarHBondContact O-N 3.4Å
408A96.3Very high96.3Very high57 Ų5795 Ų9547%0.47150%0.502SS..Hα-helixtrans-67.3-39176.800000112K404 L405 D406 L411 H412K404-A408 WeakPolarHBondContact O-CB 3.48Å; K404-A408 PolarHBondContact O-N 2.93Å; L405-A408 WeakPolarHBondContact O-CB 3.45Å; L405-A408 PolarHBondContact O-N 3.21Å; L405-A408 VanDerWaalsContact O-N 3.08Å; D406-A408 VanDerWaalsContact C-N 3.33Å; D406-A408 PolarHBondContact O-N 3.44Å; A408-L411 PolarHBondContact O-N 2.95Å; A408-H412 WeakPolarHBondContact O-CB 3.35Å; A408-H412 PolarHBondContact O-N 2.93Å
409E96.4Very high96.3Very high110 Ų11094.2 Ų94.251%0.51450%0.502SS..Hα-helixtrans-63.1-45.4173.7-71.5-177.3177.900111.4L405 D406 L411 H412 V413L405-E409 HydrophobicContact CD2-CG 4.46Å; L405-E409 VanDerWaalsContact CD2-OE1 3.3Å; L405-E409 WeakPolarHBondContact CD2-OE1 3.38Å; L405-E409 WeakPolarHBondContact O-CG 3.44Å; L405-E409 PolarHBondContact O-N 2.91Å; D406-E409 PolarHBondContact O-N 2.84Å; E409-L411 VanDerWaalsContact C-N 3.35Å; E409-L411 PolarHBondContact O-N 3.36Å; E409-H412 WeakPolarHBondContact O-CB 3.45Å; E409-H412 PolarHBondContact O-N 2.87Å; E409-V413 WeakPolarHBondContact O-CG2 3.31Å; E409-V413 PolarHBondContact O-N 3.35Å
410L96.1Very high96.3Very high126 Ų12693.6 Ų93.666%0.6649%0.494SS*.Hα-helixtrans-63-39.4175.6-71.2176.4000112.4D406 E407 N414D406-L410 WeakPolarHBondContact O-CG 3.43Å; D406-L410 PolarHBondContact O-N 2.86Å; E407-L410 PolarHBondContact O-N 2.88Å; L410-N414 VanDerWaalsContact O-CB 3.24Å; L410-N414 WeakPolarHBondContact O-CB 3.46Å; L410-N414 PolarHBondContact O-N 3.24Å
411L96.2Very high96.3Very high125 Ų12594.5 Ų94.565%0.65450%0.496SS*.Hα-helixtrans-65.8-38174-75.1172.5000111.9E407 A408 E409 G415E407-L411 WeakPolarHBondContact O-CB 3.41Å; E407-L411 VanDerWaalsContact O-CG 3.27Å; E407-L411 WeakPolarHBondContact O-CG 3.33Å; E407-L411 PolarHBondContact O-N 3.4Å; A408-L411 PolarHBondContact O-N 2.95Å; E409-L411 VanDerWaalsContact C-N 3.35Å; E409-L411 PolarHBondContact O-N 3.36Å; L411-G415 PolarHBondContact O-N 3.39Å
412H96.3Very high96.2Very high119 Ų11993 Ų9355%0.55149%0.489SS*.Hα-helixtrans-63.6-51.7175.6-178.556.4000111.3A408 E409 N414 G415 E416A408-H412 WeakPolarHBondContact O-CB 3.35Å; A408-H412 PolarHBondContact O-N 2.93Å; E409-H412 WeakPolarHBondContact O-CB 3.45Å; E409-H412 PolarHBondContact O-N 2.87Å; H412-N414 VanDerWaalsContact C-N 3.32Å; H412-N414 PolarHBondContact O-N 2.85Å; H412-G415 WeakPolarHBondContact O-CA 3.2Å; H412-G415 PolarHBondContact O-N 3.39Å; H412-E416 IonicContact CE1-OE1 2.66Å; H412-E416 IonicContact NE2-OE1 3.36Å; H412-E416 PolarHBondContact NE2-OE1 3.49Å; H412-E416 PolarHBondContact O-N 3.25Å
413V96.6Very high96.1Very high70 Ų7093.4 Ų93.442%0.42449%0.488SS..Hα-helixtrans-59.1-42.4176.71730000111.2E409 G415 E416 L417E409-V413 WeakPolarHBondContact O-CG2 3.31Å; E409-V413 PolarHBondContact O-N 3.35Å; V413-G415 VanDerWaalsContact C-N 3.29Å; V413-G415 PolarHBondContact O-N 3.33Å; V413-E416 PolarHBondContact O-N 2.94Å; V413-L417 HydrophobicContact CG1-CD1 4.12Å; V413-L417 HydrophobicContact CG1-CG 4.41Å; V413-L417 WeakPolarHBondContact O-CB 3.43Å; V413-L417 VanDerWaalsContact O-CG 3.32Å; V413-L417 WeakPolarHBondContact O-CG 3.39Å; V413-L417 PolarHBondContact O-N 3.49Å
414N95.9Very high96.1Very high74 Ų7494.6 Ų94.640%0.39649%0.49SS..Hα-helixtrans-63.4-36.4175.5-169.515.2000112L410 H412 K418L410-N414 VanDerWaalsContact O-CB 3.24Å; L410-N414 WeakPolarHBondContact O-CB 3.46Å; L410-N414 PolarHBondContact O-N 3.24Å; H412-N414 VanDerWaalsContact C-N 3.32Å; H412-N414 PolarHBondContact O-N 2.85Å; N414-K418 WeakPolarHBondContact O-CB 3.46Å; N414-K418 VanDerWaalsContact O-CG 3.28Å; N414-K418 WeakPolarHBondContact O-CG 3.32Å; N414-K418 PolarHBondContact O-N 3.3Å
415G96.5Very high96Very high29 Ų2993.5 Ų93.530%0.29949%0.486SS..Hα-helixtrans-63-45.9172.500000112.8L411 H412 V413 K418 N419L411-G415 PolarHBondContact O-N 3.39Å; H412-G415 WeakPolarHBondContact O-CA 3.2Å; H412-G415 PolarHBondContact O-N 3.39Å; V413-G415 VanDerWaalsContact C-N 3.29Å; V413-G415 PolarHBondContact O-N 3.33Å; G415-K418 PolarHBondContact O-N 2.93Å; G415-N419 PolarHBondContact O-N 2.95Å
416E96.5Very high95.8Very high106 Ų10692.5 Ų92.550%0.49549%0.487SS..Hα-helixtrans-61.4-44.6175.4-67.3-175.1151.300112H412 V413 N419 K420H412-E416 IonicContact CE1-OE1 2.66Å; H412-E416 IonicContact NE2-OE1 3.36Å; H412-E416 PolarHBondContact NE2-OE1 3.49Å; H412-E416 PolarHBondContact O-N 3.25Å; V413-E416 PolarHBondContact O-N 2.94Å; E416-N419 PolarHBondContact O-N 3.23Å; E416-K420 WeakPolarHBondContact O-CB 3.41Å; E416-K420 PolarHBondContact O-N 3.48Å
417L96Very high95.7Very high100 Ų10094.9 Ų94.952%0.52449%0.49SS..Hα-helixtrans-63.3-42.2176.7-70.8175.6000111.9V413 K420 I421V413-L417 HydrophobicContact CG1-CD1 4.12Å; V413-L417 HydrophobicContact CG1-CG 4.41Å; V413-L417 WeakPolarHBondContact O-CB 3.43Å; V413-L417 VanDerWaalsContact O-CG 3.32Å; V413-L417 WeakPolarHBondContact O-CG 3.39Å; V413-L417 PolarHBondContact O-N 3.49Å; L417-K420 PolarHBondContact O-N 3.44Å; L417-I421 VanDerWaalsContact O-CG1 3.3Å; L417-I421 WeakPolarHBondContact O-CG1 3.39Å; L417-I421 PolarHBondContact O-N 3.19Å
418K96.3Very high95.5Very high119 Ų11995.4 Ų95.452%0.51750%0.495SS..Hα-helixtrans-61.6-45.7174.3-78175.2-177.5178.20111.9N414 G415 K420 I421 C422N414-K418 WeakPolarHBondContact O-CB 3.46Å; N414-K418 VanDerWaalsContact O-CG 3.28Å; N414-K418 WeakPolarHBondContact O-CG 3.32Å; N414-K418 PolarHBondContact O-N 3.3Å; G415-K418 PolarHBondContact O-N 2.93Å; K418-K420 VanDerWaalsContact C-N 3.25Å; K418-K420 PolarHBondContact O-N 3.35Å; K418-I421 PolarHBondContact O-N 3.41Å; K418-C422 PolarHBondContact O-N 3.46Å; K418-C422 PolarHBondContact O-SG 2.94Å
419N95.4Very high95.3Very high105 Ų10597 Ų9756%0.56150%0.499SS*.Hα-helixtrans-59.1-41.2175-72.4-17.2000110.9G415 E416 I421 C422 E423G415-N419 PolarHBondContact O-N 2.95Å; E416-N419 PolarHBondContact O-N 3.23Å; N419-I421 PolarHBondContact O-N 2.88Å; N419-C422 PolarHBondContact O-N 2.89Å; N419-E423 WeakPolarHBondContact O-CG 3.23Å; N419-E423 PolarHBondContact O-N 3.36Å
420K96.7Very high95.1Very high94 Ų9496.4 Ų96.441%0.40950%0.496SS..Hα-helixtrans-65.1-39.5177.6-167.367.5-166165.30113E416 L417 K418 E423 L424E416-K420 WeakPolarHBondContact O-CB 3.41Å; E416-K420 PolarHBondContact O-N 3.48Å; L417-K420 PolarHBondContact O-N 3.44Å; K418-K420 VanDerWaalsContact C-N 3.25Å; K418-K420 PolarHBondContact O-N 3.35Å; K420-E423 IonicContact NZ-OE2 2.93Å; K420-E423 PolarHBondContact NZ-OE2 3.41Å; K420-E423 PolarHBondContact O-N 3.02Å; K420-L424 HydrophobicContact CG-CD1 4.5Å; K420-L424 VanDerWaalsContact O-CG 3.31Å; K420-L424 WeakPolarHBondContact O-CG 3.47Å; K420-L424 PolarHBondContact O-N 2.89Å
421I95.6Very high94.7Very high92 Ų9293.4 Ų93.447%0.47249%0.485SS..Hα-helixtrans-62.2-48.1173.2-68.8164.7000109.7L417 K418 N419 E423 L424 E425L417-I421 VanDerWaalsContact O-CG1 3.3Å; L417-I421 WeakPolarHBondContact O-CG1 3.39Å; L417-I421 PolarHBondContact O-N 3.19Å; K418-I421 PolarHBondContact O-N 3.41Å; N419-I421 PolarHBondContact O-N 2.88Å; I421-E423 VanDerWaalsContact C-N 3.33Å; I421-E423 PolarHBondContact O-N 3.43Å; I421-L424 PolarHBondContact O-N 3.49Å; I421-L424 VanDerWaalsContact O-N 3.1Å; I421-E425 HydrophobicContact CG2-CG 4.21Å; I421-E425 WeakPolarHBondContact O-CB 3.26Å; I421-E425 WeakPolarHBondContact O-CG 3.42Å; I421-E425 PolarHBondContact O-N 3.38Å
422C94.8Very high94.4Very high66 Ų6694.8 Ų94.845%0.44648%0.482SS..Hα-helixtrans-59.1-39.6177-67.40000112.9K418 N419 S426K418-C422 PolarHBondContact O-N 3.46Å; K418-C422 PolarHBondContact O-SG 2.94Å; N419-C422 PolarHBondContact O-N 2.89Å; C422-S426 WeakPolarHBondContact O-CB 3.26Å; C422-S426 PolarHBondContact O-N 2.85Å; C422-S426 PolarHBondContact O-OG 3.22Å
423E95.5Very high93.9Very high91 Ų9191.9 Ų91.943%0.42547%0.473SS..Hα-helixtrans-62.1-44.7173.8-76.6178-171.800111.8N419 K420 I421 S426 R427N419-E423 WeakPolarHBondContact O-CG 3.23Å; N419-E423 PolarHBondContact O-N 3.36Å; K420-E423 IonicContact NZ-OE2 2.93Å; K420-E423 PolarHBondContact NZ-OE2 3.41Å; K420-E423 PolarHBondContact O-N 3.02Å; I421-E423 VanDerWaalsContact C-N 3.33Å; I421-E423 PolarHBondContact O-N 3.43Å; E423-S426 PolarHBondContact O-N 2.87Å; E423-R427 WeakPolarHBondContact O-CB 3.47Å; E423-R427 VanDerWaalsContact O-CG 3.27Å; E423-R427 WeakPolarHBondContact O-CG 3.3Å; E423-R427 PolarHBondContact O-N 2.94Å
424L95.1Very high93.2Very high84 Ų8496 Ų9644%0.4448%0.48SS..Hα-helixtrans-67.6-40.7178.7-70.5172.4000111.5K420 I421 R427 L428K420-L424 HydrophobicContact CG-CD1 4.5Å; K420-L424 VanDerWaalsContact O-CG 3.31Å; K420-L424 WeakPolarHBondContact O-CG 3.47Å; K420-L424 PolarHBondContact O-N 2.89Å; I421-L424 PolarHBondContact O-N 3.49Å; I421-L424 VanDerWaalsContact O-N 3.1Å; L424-R427 PolarHBondContact O-N 3.44Å; L424-L428 WeakPolarHBondContact O-CB 3.43Å; L424-L428 VanDerWaalsContact O-CG 3.28Å; L424-L428 WeakPolarHBondContact O-CG 3.32Å; L424-L428 PolarHBondContact O-N 3.27Å
425E94.6Very high92.8Very high112 Ų11297.3 Ų97.352%0.52348%0.484SS..Hα-helixtrans-62.5-44.4174.1-73.2176.5167.500111.3I421 R427 L428 V429I421-E425 HydrophobicContact CG2-CG 4.21Å; I421-E425 WeakPolarHBondContact O-CB 3.26Å; I421-E425 WeakPolarHBondContact O-CG 3.42Å; I421-E425 PolarHBondContact O-N 3.38Å; E425-R427 PolarHBondContact O-N 3.45Å; E425-L428 PolarHBondContact O-N 2.91Å; E425-V429 WeakPolarHBondContact O-CG2 3.4Å; E425-V429 PolarHBondContact O-N 2.65Å
426S92.8Very high92.1Very high67 Ų6799.8 Ų99.847%0.46949%0.488SS..Hα-helixtrans-61.1-44.7175.7-58.50000111.2C422 E423 L428 V429 E430C422-S426 WeakPolarHBondContact O-CB 3.26Å; C422-S426 PolarHBondContact O-N 2.85Å; C422-S426 PolarHBondContact O-OG 3.22Å; E423-S426 PolarHBondContact O-N 2.87Å; S426-L428 PolarHBondContact O-N 2.9Å; S426-V429 PolarHBondContact O-N 3.19Å; S426-E430 WeakPolarHBondContact O-CG 3.41Å; S426-E430 PolarHBondContact O-N 2.81Å
427R93.7Very high91.2Very high136 Ų13699.1 Ų99.151%0.51349%0.487SS..Hα-helixtrans-63.4-38.7175-74.2174.1-175.8-171.90.3112.7E423 L424 E425 E430 C431E423-R427 WeakPolarHBondContact O-CB 3.47Å; E423-R427 VanDerWaalsContact O-CG 3.27Å; E423-R427 WeakPolarHBondContact O-CG 3.3Å; E423-R427 PolarHBondContact O-N 2.94Å; L424-R427 PolarHBondContact O-N 3.44Å; E425-R427 PolarHBondContact O-N 3.45Å; R427-E430 PolarHBondContact O-N 2.96Å; R427-C431 WeakPolarHBondContact O-CB 3.33Å; R427-C431 PolarHBondContact O-N 2.84Å; R427-C431 PolarHBondContact O-SG 2.85Å
428L92.9Very high90.3Very high122 Ų122100.2 Ų100.264%0.63949%0.493SS*.Hα-helixtrans-64.2-42.8175.6-78.3168.8000111L424 E425 S426 C431 W432L424-L428 WeakPolarHBondContact O-CB 3.43Å; L424-L428 VanDerWaalsContact O-CG 3.28Å; L424-L428 WeakPolarHBondContact O-CG 3.32Å; L424-L428 PolarHBondContact O-N 3.27Å; E425-L428 PolarHBondContact O-N 2.91Å; S426-L428 PolarHBondContact O-N 2.9Å; L428-C431 PolarHBondContact O-N 3.04Å; L428-W432 WeakPolarHBondContact O-CB 3.43Å; L428-W432 PolarHBondContact O-N 2.9Å
429V92.4Very high89.3Confident90 Ų90101.8 Ų101.855%0.54550%0.496SS..Hα-helixtrans-63.7-44.7174.2172.70000110.7E425 S426 C431 W432 T433E425-V429 WeakPolarHBondContact O-CG2 3.4Å; E425-V429 PolarHBondContact O-N 2.65Å; S426-V429 PolarHBondContact O-N 3.19Å; V429-C431 PolarHBondContact O-N 3.42Å; V429-W432 PolarHBondContact O-N 3.46Å; V429-T433 HydrophobicContact CG1-CG2 4.28Å; V429-T433 WeakPolarHBondContact O-CG2 3.25Å; V429-T433 PolarHBondContact O-N 3.42Å; V429-T433 PolarHBondContact O-OG1 3.41Å
430E90.7Very high88.2Confident98 Ų98100.1 Ų100.146%0.45849%0.493SS..Hα-helixtrans-57.3-48.9175-75.4172.3-168.100111.7S426 R427 W432 T433 R434S426-E430 WeakPolarHBondContact O-CG 3.41Å; S426-E430 PolarHBondContact O-N 2.81Å; R427-E430 PolarHBondContact O-N 2.96Å; E430-W432 PolarHBondContact O-N 3.26Å; E430-T433 WeakPolarHBondContact CA-OG1 3.41Å; E430-T433 PolarHBondContact O-N 2.79Å; E430-T433 PolarHBondContact O-OG1 3.35Å; E430-R434 PolarHBondContact O-N 3.32Å
431C89.1Confident86.4Confident63 Ų6398.2 Ų98.243%0.42650%0.5SS..Hα-helixtrans-58.7-46.7175.2-73.50000111.7R427 L428 V429 T433 R434 E435R427-C431 WeakPolarHBondContact O-CB 3.33Å; R427-C431 PolarHBondContact O-N 2.84Å; R427-C431 PolarHBondContact O-SG 2.85Å; L428-C431 PolarHBondContact O-N 3.04Å; V429-C431 PolarHBondContact O-N 3.42Å; C431-T433 VanDerWaalsContact C-N 3.34Å; C431-T433 PolarHBondContact O-N 3.17Å; C431-R434 PolarHBondContact O-N 2.96Å; C431-E435 PolarHBondContact O-N 2.85Å
432W89.3Confident84.2Confident153 Ų15399 Ų9958%0.5851%0.509SS*.Hα-helixtrans-62.3-41.4178.2-17482.8000111.9L428 V429 E430 E435 E436L428-W432 WeakPolarHBondContact O-CB 3.43Å; L428-W432 PolarHBondContact O-N 2.9Å; V429-W432 PolarHBondContact O-N 3.46Å; E430-W432 PolarHBondContact O-N 3.26Å; W432-E435 PolarHBondContact O-N 2.97Å; W432-E436 HydrophobicContact CH2-CG 4.47Å; W432-E436 WeakPolarHBondContact O-CB 3.32Å; W432-E436 PolarHBondContact O-N 2.95Å
433T85.1Confident81.8Confident59 Ų59102.5 Ų102.536%0.36252%0.522SS..Hα-helixtrans-66.4-35.7175.456.40000112.8V429 E430 C431 E436 L437V429-T433 HydrophobicContact CG1-CG2 4.28Å; V429-T433 WeakPolarHBondContact O-CG2 3.25Å; V429-T433 PolarHBondContact O-N 3.42Å; V429-T433 PolarHBondContact O-OG1 3.41Å; E430-T433 WeakPolarHBondContact CA-OG1 3.41Å; E430-T433 PolarHBondContact O-N 2.79Å; E430-T433 PolarHBondContact O-OG1 3.35Å; C431-T433 VanDerWaalsContact C-N 3.34Å; C431-T433 PolarHBondContact O-N 3.17Å; T433-E436 PolarHBondContact O-N 2.81Å; T433-L437 WeakPolarHBondContact O-CB 3.2Å; T433-L437 VanDerWaalsContact O-CG 3.23Å; T433-L437 WeakPolarHBondContact O-CG 3.23Å; T433-L437 PolarHBondContact O-N 3.46Å
434R83.3Confident79.2Confident156 Ų156106.3 Ų106.359%0.58954%0.539SS*.Hα-helixtrans-64-49.2172.6-76.7-175.7-176.5128.33.6111.4E430 C431 E436 L437 D438E430-R434 PolarHBondContact O-N 3.32Å; C431-R434 PolarHBondContact O-N 2.96Å; R434-E436 PolarHBondContact O-N 3.38Å; R434-L437 PolarHBondContact O-N 3.02Å; R434-D438 PolarHBondContact O-N 3.29Å
435E86.1Confident76.5Confident101 Ų101110.3 Ų110.347%0.47256%0.556SS.*Hα-helixtrans-59.4-36.9176.6-73.2-176.9-171.700112.2C431 W432 R439C431-E435 PolarHBondContact O-N 2.85Å; W432-E435 PolarHBondContact O-N 2.97Å; E435-R439 WeakPolarHBondContact O-CB 3.43Å; E435-R439 WeakPolarHBondContact O-CG 3.24Å; E435-R439 PolarHBondContact O-N 3.31Å; E435-R439 IonicContact OE2-NH1 2.96Å; E435-R439 IonicContact OE2-NH2 2.66Å; E435-R439 PolarHBondContact OE2-NH2 3.36Å
436E83.2Confident73.7Confident81 Ų81111.9 Ų111.938%0.37957%0.568SS.*Hα-helixtrans-73.8-36.5178.3-161.760.3-162.500112.4W432 T433 R434 R439 S440W432-E436 HydrophobicContact CH2-CG 4.47Å; W432-E436 WeakPolarHBondContact O-CB 3.32Å; W432-E436 PolarHBondContact O-N 2.95Å; T433-E436 PolarHBondContact O-N 2.81Å; R434-E436 PolarHBondContact O-N 3.38Å; E436-R439 PolarHBondContact O-N 2.87Å; E436-R439 IonicContact OE2-CZ 3.04Å; E436-R439 IonicContact OE2-NE 2.65Å; E436-R439 PolarHBondContact OE2-NE 2.96Å; E436-R439 IonicContact OE2-NH2 2.96Å; E436-R439 PolarHBondContact OE2-NH2 3.46Å; E436-S440 VanDerWaalsContact O-CB 3.31Å; E436-S440 WeakPolarHBondContact O-CB 3.37Å; E436-S440 PolarHBondContact O-N 2.97Å; E436-S440 PolarHBondContact O-OG 3.13Å
437L77.4Confident70.9Confident93 Ų93114.3 Ų114.349%0.48758%0.58SS.*Hα-helixtrans-62.2-44.1171.1-74.9168.8000111.1T433 R434 R439 S440 G441T433-L437 WeakPolarHBondContact O-CB 3.2Å; T433-L437 VanDerWaalsContact O-CG 3.23Å; T433-L437 WeakPolarHBondContact O-CG 3.23Å; T433-L437 PolarHBondContact O-N 3.46Å; R434-L437 PolarHBondContact O-N 3.02Å; L437-R439 PolarHBondContact O-N 3.44Å; L437-S440 WeakPolarHBondContact CA-OG 3.36Å; L437-S440 PolarHBondContact O-N 2.92Å; L437-S440 PolarHBondContact O-OG 3.44Å; L437-G441 PolarHBondContact O-N 3.02Å
438D76.8Confident68.1Low122 Ų122116.1 Ų116.165%0.65259%0.594SS**Hα-helixtrans-60.1-43.6173.9-71.4-15.1000111.5R434 G441R434-D438 PolarHBondContact O-N 3.29Å; D438-G441 PolarHBondContact O-N 2.82Å
439R75.5Confident65.4Low153 Ų153117.4 Ų117.458%0.57760%0.602SS**Hα-helixtrans-66-35.4175.8-82.3-168.4-83.9-97.9-5.5113.3E435 E436 L437 G441E435-R439 WeakPolarHBondContact O-CB 3.43Å; E435-R439 WeakPolarHBondContact O-CG 3.24Å; E435-R439 PolarHBondContact O-N 3.31Å; E435-R439 IonicContact OE2-NH1 2.96Å; E435-R439 IonicContact OE2-NH2 2.66Å; E435-R439 PolarHBondContact OE2-NH2 3.36Å; E436-R439 PolarHBondContact O-N 2.87Å; E436-R439 IonicContact OE2-CZ 3.04Å; E436-R439 IonicContact OE2-NE 2.65Å; E436-R439 PolarHBondContact OE2-NE 2.96Å; E436-R439 IonicContact OE2-NH2 2.96Å; E436-R439 PolarHBondContact OE2-NH2 3.46Å; L437-R439 PolarHBondContact O-N 3.44Å; R439-G441 PolarHBondContact O-N 2.95Å
440S71.5Confident62.8Low69 Ų69120.9 Ų120.948%0.48362%0.617SS.*Hα-helixtrans-76.9-6.4-17871.70000114.1E436 L437 V442E436-S440 VanDerWaalsContact O-CB 3.31Å; E436-S440 WeakPolarHBondContact O-CB 3.37Å; E436-S440 PolarHBondContact O-N 2.97Å; E436-S440 PolarHBondContact O-OG 3.13Å; L437-S440 WeakPolarHBondContact CA-OG 3.36Å; L437-S440 PolarHBondContact O-N 2.92Å; L437-S440 PolarHBondContact O-OG 3.44Å; S440-V442 PolarHBondContact O-N 2.94Å
441G59Low60.3Low55 Ų55125.4 Ų125.457%0.56764%0.639SS**THydrogen-bonded Turntrans72.225170.700000114.9L437 D438 R439 I443L437-G441 PolarHBondContact O-N 3.02Å; D438-G441 PolarHBondContact O-N 2.82Å; R439-G441 PolarHBondContact O-N 2.95Å; G441-I443 VanDerWaalsContact C-N 3.33Å
442V49.6Very low58Low109 Ų109130.5 Ų130.566%0.66166%0.656SS**  trans-88.46.9-177.5-178.70000113.3S440S440-V442 PolarHBondContact O-N 2.94Å
443I45.5Very low55.7Low138 Ų138131.8 Ų131.871%0.70867%0.668SS**  trans-129.882.6171-52-179.9000109.2G441G441-I443 VanDerWaalsContact C-N 3.33Å
444E40.6Very low53.7Low171 Ų171137 Ų13780%0.79969%0.692SS**  trans-69.9135.8150-78.1179.315800108.8
445E37.2Very low51.7Low169 Ų169134.3 Ų134.379%0.7970%0.697SS**  trans45.6110.6150.7-63-179.5165.500118.5
446D35.9Very low49.4Very low145 Ų145137.9 Ų137.978%0.77571%0.714SS**  -172.5118.4109.2-89.2-25.8000111.7
447T33.4Very low47.4Very low117 Ų117139.5 Ų139.572%0.71873%0.728SS**  trans30.3124.4140.7560000121.2
448E35.6Very low45.7Very low175 Ų175144.3 Ų144.382%0.81875%0.746SS**  29.8132.2120.8-65.6177.7166.800118.9
449D36.2Very low44.1Very low148 Ų148147.5 Ų147.579%0.79178%0.778SS**  trans89.883.1169.3-58-19.2000116.4
450D38.4Very low42.5Very low164 Ų164147.3 Ų147.388%0.87779%0.788SS**  trans-163.148.4141.1-89.1-27000110.3E452D450-E452 PolarHBondContact O-N 2.96Å
451E37.5Very low41Very low193 Ų193151.4 Ų151.490%0.90280%0.804SS**  trans-75.783.2151-80.9-168.3167.200107.6
452E41.8Very low40Very low169 Ų169156.7 Ų156.779%0.7982%0.817SS**SBendtrans161.986155.8-95.5176.3-169.700108.5D450D450-E452 PolarHBondContact O-N 2.96Å
453H40.3Very low39.4Very low181 Ų181159.5 Ų159.584%0.83883%0.826SS**SBendtrans178.539147.1-98.2-53.7000116.6
454I43Very low39.1Very low169 Ų169160.9 Ų160.987%0.86783%0.834SS**  trans-136.151.7159-42.2174.5000110.8
455S40.8Very low39Very low99 Ų99160.2 Ų160.269%0.69284%0.836SS**SBendtrans-102.332.4160.857.10000111.5
456H38.8Very low39.1Very low176 Ų176159.6 Ų159.682%0.81584%0.84SS**  trans-161.278.5172.9-87.5-60.3000113.1
457V40.8Very low39.3Very low114 Ų114160.7 Ų160.769%0.69184%0.844SS**SBendtrans-156.9134.2136.7-167.40000107.3
458F42.5Very low39.8Very low194 Ų194164.3 Ų164.385%0.85186%0.855SS**  trans90.957.6178.1-52.9-71.3000116.9
459S42.2Very low40.2Very low190 Ų190163.4 Ų163.4100%1.32986%0.858SS**  -73.80117-66.10000108.9

Retrieved 459 of 459 residues in 153.5 ms (Link to these results)

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