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Cytochrome b

Component of the ubiquinol-cytochrome c reductase complex (complex III or cytochrome b-c1 complex) that is part of the mitochondrial respiratory chain. The b-c1 complex mediates electron transfer from ubiquinol to cytochrome c. Contributes to the generation of a proton gradient across the mitochondrial membrane that is then used for ATP synthesis.

AlphaFold DB , UniProt , Accession A0A077ZHW3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 200 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
1M81.3Confident93.6Very high111 Ų11146.9 Ų46.955%0.54726%0.261SS..  0-61.10-170.3-178.167.500112.9F3 G4 L5 L173 N177M1-F3 VanDerWaalsContact C-N 3.26Å; M1-F3 PolarHBondContact O-N 3.5Å; M1-G4 CarbonylContact O-C 3.58Å; M1-G4 WeakPolarHBondContact O-CA 3.34Å; M1-G4 PolarHBondContact O-N 3.32Å; M1-L5 PolarHBondContact O-N 2.84Å; M1-L173 HydrophobicContact CB-CD1 4.21Å; M1-L173 HydrophobicContact CE-CD1 3.86Å; M1-L173 HydrophobicContact CE-CD2 3.81Å; M1-L173 HydrophobicContact CE-CG 3.52Å; M1-L173 HydrophobicContact SD-CD1 3.63Å; M1-L173 HydrophobicContact SD-CD2 3.74Å; M1-L173 HydrophobicContact SD-CG 3.8Å; M1-N177 WeakPolarHBondContact CE-ND2 3.42Å; M1-N177 WeakPolarHBondContact CE-OD1 3.31Å
2I90.2Very high93.9Very high14 Ų1448.5 Ų48.57%0.07227%0.268CS..Hα-helixtrans-57.7-39-179.2-55.6-160.7000112.6G4 L5 Q6 L51 I52 L55I2-G4 VanDerWaalsContact C-N 3.29Å; I2-G4 PolarHBondContact O-N 3.34Å; I2-L5 WeakPolarHBondContact O-CB 3.4Å; I2-L5 PolarHBondContact O-N 3.25Å; I2-L5 VanDerWaalsContact O-N 3.12Å; I2-Q6 PolarHBondContact O-N 3.15Å; I2-L51 HydrophobicContact CD1-CB 4.45Å; I2-L51 HydrophobicContact CD1-CD2 3.21Å; I2-L51 HydrophobicContact CD1-CG 3.56Å; I2-I52 HydrophobicContact CB-CG1 4.43Å; I2-I52 HydrophobicContact CG2-CD1 4.32Å; I2-I52 HydrophobicContact CG2-CG1 3.71Å; I2-L55 HydrophobicContact CD1-CD1 3.69Å; I2-L55 HydrophobicContact CG1-CD1 4.34Å
3F93.6Very high94Very high57 Ų5746.5 Ų46.525%0.2526%0.256CS..Hα-helixtrans-57.6-41.1171.5-166.9-94000112.8M1 Q6 L7 I52 P127 I130 I131M1-F3 VanDerWaalsContact C-N 3.26Å; M1-F3 PolarHBondContact O-N 3.5Å; F3-Q6 WeakPolarHBondContact O-CB 3.42Å; F3-Q6 PolarHBondContact O-N 3.06Å; F3-Q6 VanDerWaalsContact O-N 3.16Å; F3-L7 HydrophobicContact CD1-CD1 3.93Å; F3-L7 HydrophobicContact CD1-CG 4.23Å; F3-L7 HydrophobicContact CE1-CD1 3.78Å; F3-L7 HydrophobicContact CE1-CD2 4.17Å; F3-L7 HydrophobicContact CE1-CG 3.99Å; F3-L7 WeakPolarHBondContact O-CG 3.47Å; F3-L7 PolarHBondContact O-N 3.09Å; F3-I52 HydrophobicContact CD2-CD1 4.13Å; F3-P127 HydrophobicContact CZ-CB 4.06Å; F3-P127 WeakPolarHBondContact CZ-O 3.27Å; F3-I130 HydrophobicContact CE2-CB 4.29Å; F3-I130 HydrophobicContact CE2-CD1 4.37Å; F3-I130 HydrophobicContact CE2-CG2 3.78Å; F3-I130 HydrophobicContact CZ-CB 3.9Å; F3-I130 HydrophobicContact CZ-CG2 3.74Å; F3-I131 HydrophobicContact CD1-CG1 4.35Å; F3-I131 HydrophobicContact CE1-CD1 4.22Å; F3-I131 HydrophobicContact CE1-CG1 3.58Å; F3-I131 HydrophobicContact CZ-CG1 4.42Å
4G94.1Very high94.1Very high37 Ų3746.5 Ų46.538%0.38126%0.258SS..Hα-helixtrans-65.3-37.9173.900000113.1M1 I2 Q6 L7 L8M1-G4 CarbonylContact O-C 3.58Å; M1-G4 WeakPolarHBondContact O-CA 3.34Å; M1-G4 PolarHBondContact O-N 3.32Å; I2-G4 VanDerWaalsContact C-N 3.29Å; I2-G4 PolarHBondContact O-N 3.34Å; G4-Q6 VanDerWaalsContact C-N 3.27Å; G4-Q6 PolarHBondContact O-N 3.37Å; G4-L7 PolarHBondContact O-N 3.27Å; G4-L8 WeakPolarHBondContact O-CB 3.5Å; G4-L8 PolarHBondContact O-N 3.41Å
5L93.7Very high94.2Very high47 Ų4753.4 Ų53.425%0.24629%0.285CS..Hα-helixtrans-61-37.2171-81.6166.8000111.6M1 I2 S9M1-L5 PolarHBondContact O-N 2.84Å; I2-L5 WeakPolarHBondContact O-CB 3.4Å; I2-L5 PolarHBondContact O-N 3.25Å; I2-L5 VanDerWaalsContact O-N 3.12Å; L5-S9 VanDerWaalsContact O-CB 3.3Å; L5-S9 WeakPolarHBondContact O-CB 3.35Å; L5-S9 PolarHBondContact O-N 3.39Å; L5-S9 PolarHBondContact O-OG 3.15Å
6Q95.4Very high94.2Very high21 Ų2156.9 Ų56.910%0.09829%0.294CS..Hα-helixtrans-68.4-41.7176-71.9-54.3-35.400113I2 F3 G4 S9 G10 I44 H45 A49 I52I2-Q6 PolarHBondContact O-N 3.15Å; F3-Q6 WeakPolarHBondContact O-CB 3.42Å; F3-Q6 PolarHBondContact O-N 3.06Å; F3-Q6 VanDerWaalsContact O-N 3.16Å; G4-Q6 VanDerWaalsContact C-N 3.27Å; G4-Q6 PolarHBondContact O-N 3.37Å; Q6-S9 WeakPolarHBondContact CA-OG 3.42Å; Q6-S9 PolarHBondContact O-OG 3.46Å; Q6-G10 WeakPolarHBondContact O-CA 3.26Å; Q6-G10 PolarHBondContact O-N 2.83Å; Q6-I44 PolarHBondContact NE2-O 2.91Å; Q6-H45 PolarHBondContact NE2-O 2.95Å; Q6-H45 PolarHBondContact O-CE1 3.45Å; Q6-H45 PolarHBondContact O-ND1 3.26Å; Q6-H45 PolarHBondContact OE1-CE1 3.01Å; Q6-H45 VanDerWaalsContact OE1-CE1 3.22Å; Q6-H45 PolarHBondContact OE1-ND1 3.34Å; Q6-H45 PolarHBondContact OE1-O 3.31Å; Q6-H45 VanDerWaalsContact OE1-O 3.04Å; Q6-A49 VanDerWaalsContact NE2-N 3.15Å; Q6-I52 HydrophobicContact CB-CD1 4.19Å; Q6-I52 HydrophobicContact CG-CD1 3.46Å; Q6-I52 VanDerWaalsContact CG-CD1 3.46Å; Q6-I52 HydrophobicContact CG-CG1 4.49Å
7L96.4Very high94.1Very high45 Ų4556.3 Ų56.324%0.23629%0.287CS..Hα-helixtrans-60.8-47.1173.6-67.1170.5000111.3F3 G4 L11 P127 I131F3-L7 HydrophobicContact CD1-CD1 3.93Å; F3-L7 HydrophobicContact CD1-CG 4.23Å; F3-L7 HydrophobicContact CE1-CD1 3.78Å; F3-L7 HydrophobicContact CE1-CD2 4.17Å; F3-L7 HydrophobicContact CE1-CG 3.99Å; F3-L7 WeakPolarHBondContact O-CG 3.47Å; F3-L7 PolarHBondContact O-N 3.09Å; G4-L7 PolarHBondContact O-N 3.27Å; L7-L11 VanDerWaalsContact O-CB 3.24Å; L7-L11 WeakPolarHBondContact O-CB 3.44Å; L7-L11 PolarHBondContact O-N 2.92Å; L7-P127 HydrophobicContact CD2-CB 3.56Å; L7-I131 HydrophobicContact CD1-CD1 3.64Å; L7-I131 HydrophobicContact CD1-CG1 4.42Å
8L96.6Very high94Very high97 Ų9755.7 Ų55.751%0.50829%0.287SS..Hα-helixtrans-66.7-49.9-178-177.763.4000111.8G4 G10 L11 L12G4-L8 WeakPolarHBondContact O-CB 3.5Å; G4-L8 PolarHBondContact O-N 3.41Å; L8-G10 VanDerWaalsContact C-N 3.35Å; L8-G10 PolarHBondContact O-N 3.4Å; L8-L11 PolarHBondContact O-N 2.96Å; L8-L12 HydrophobicContact CD1-CD1 4.31Å; L8-L12 HydrophobicContact CG-CD1 4.24Å; L8-L12 VanDerWaalsContact O-CG 3.31Å; L8-L12 WeakPolarHBondContact O-CG 3.38Å; L8-L12 PolarHBondContact O-N 3.19Å
9S96.5Very high93.6Very high7 Ų753.8 Ų53.85%0.04928%0.279CS..Hα-helixtrans-63.5-40.8177.654.50000111.7L5 Q6 L12 L13 L41 H45L5-S9 VanDerWaalsContact O-CB 3.3Å; L5-S9 WeakPolarHBondContact O-CB 3.35Å; L5-S9 PolarHBondContact O-N 3.39Å; L5-S9 PolarHBondContact O-OG 3.15Å; Q6-S9 WeakPolarHBondContact CA-OG 3.42Å; Q6-S9 PolarHBondContact O-OG 3.46Å; S9-L12 PolarHBondContact O-N 3.4Å; S9-L13 WeakPolarHBondContact O-CG 3.45Å; S9-L13 PolarHBondContact O-N 3.33Å; S9-L41 WeakPolarHBondContact O-CD2 3.48Å; S9-H45 PolarHBondContact OG-ND1 3.48Å
10G95.7Very high93.2Very high13 Ų1358.1 Ų58.113%0.13429%0.291CS..Hα-helixtrans-61.5-48.3176.200000112.1Q6 L8 L12 L13 V14 H45Q6-G10 WeakPolarHBondContact O-CA 3.26Å; Q6-G10 PolarHBondContact O-N 2.83Å; L8-G10 VanDerWaalsContact C-N 3.35Å; L8-G10 PolarHBondContact O-N 3.4Å; G10-L12 VanDerWaalsContact C-N 3.3Å; G10-L12 PolarHBondContact O-N 2.95Å; G10-L13 PolarHBondContact O-N 3.36Å; G10-L13 VanDerWaalsContact O-N 3.17Å; G10-V14 VanDerWaalsContact O-CG2 3.31Å; G10-V14 WeakPolarHBondContact O-CG2 3.03Å; G10-V14 PolarHBondContact O-N 3.48Å; G10-H45 WeakPolarHBondContact CA-CE1 3.35Å; G10-H45 PolarHBondContact N-CE1 3.41Å; G10-H45 PolarHBondContact N-ND1 3.01Å
11L96.3Very high92.6Very high67 Ų6761 Ų6135%0.35130%0.304SS..Hα-helixtrans-56.4-44.7176.6-17969.4000111.7L7 L8 V14 F15 Y124L7-L11 VanDerWaalsContact O-CB 3.24Å; L7-L11 WeakPolarHBondContact O-CB 3.44Å; L7-L11 PolarHBondContact O-N 2.92Å; L8-L11 PolarHBondContact O-N 2.96Å; L11-V14 PolarHBondContact O-N 3.33Å; L11-F15 HydrophobicContact CG-CE2 4.38Å; L11-F15 WeakPolarHBondContact O-CD2 3.41Å; L11-Y124 HydrophobicContact CD1-CE2 4.11Å; L11-Y124 WeakPolarHBondContact CD1-OH 3.34Å
12L96.8Very high92.9Very high66 Ų6661.9 Ų61.935%0.34632%0.315SS..Hα-helixtrans-67.6-35179.6-68.7172.9000112.6L8 S9 G10 V14 F15 Y16 L41L8-L12 HydrophobicContact CD1-CD1 4.31Å; L8-L12 HydrophobicContact CG-CD1 4.24Å; L8-L12 VanDerWaalsContact O-CG 3.31Å; L8-L12 WeakPolarHBondContact O-CG 3.38Å; L8-L12 PolarHBondContact O-N 3.19Å; S9-L12 PolarHBondContact O-N 3.4Å; G10-L12 VanDerWaalsContact C-N 3.3Å; G10-L12 PolarHBondContact O-N 2.95Å; L12-V14 VanDerWaalsContact C-N 3.35Å; L12-F15 HydrophobicContact CD2-CE2 4.47Å; L12-Y16 WeakPolarHBondContact O-CD2 3.25Å; L12-L41 HydrophobicContact CB-CD1 3.63Å; L12-L41 HydrophobicContact CB-CD2 4.09Å; L12-L41 HydrophobicContact CB-CG 4.44Å; L12-L41 HydrophobicContact CD1-CD1 3.69Å; L12-L41 HydrophobicContact CG-CD1 4.3Å
13L95.8Very high92.6Very high22 Ų2262.4 Ų62.412%0.11532%0.323CS..Hα-helixtrans-65.8-37174.1-72.2170.3000112.5S9 G10 F15 Y16 Y17 I31 L41 R42 H45S9-L13 WeakPolarHBondContact O-CG 3.45Å; S9-L13 PolarHBondContact O-N 3.33Å; G10-L13 PolarHBondContact O-N 3.36Å; G10-L13 VanDerWaalsContact O-N 3.17Å; L13-F15 PolarHBondContact O-N 3.37Å; L13-Y16 PolarHBondContact O-N 3.04Å; L13-Y17 PolarHBondContact O-N 3.12Å; L13-Y17 VanDerWaalsContact O-N 3.15Å; L13-I31 HydrophobicContact CD2-CD1 4.42Å; L13-I31 HydrophobicContact CD2-CG2 3.7Å; L13-L41 HydrophobicContact CB-CD2 4.38Å; L13-L41 HydrophobicContact CD1-CD2 4.17Å; L13-L41 HydrophobicContact CD2-CD2 3.38Å; L13-L41 HydrophobicContact CG-CD2 3.31Å; L13-R42 HydrophobicContact CD2-CB 4.45Å; L13-H45 HydrophobicContact CD1-CB 3.72Å
14V95Very high92.3Very high47 Ų4760.2 Ų60.229%0.28532%0.316SS..Hα-helixtrans-60.3-32-176.5164.30000112.1G10 L11 L12 Y16 Y17 F120 Y124G10-V14 VanDerWaalsContact O-CG2 3.31Å; G10-V14 WeakPolarHBondContact O-CG2 3.03Å; G10-V14 PolarHBondContact O-N 3.48Å; L11-V14 PolarHBondContact O-N 3.33Å; L12-V14 VanDerWaalsContact C-N 3.35Å; V14-Y16 PolarHBondContact O-N 2.94Å; V14-Y16 VanDerWaalsContact O-N 3.15Å; V14-Y17 PolarHBondContact O-N 3.08Å; V14-F120 HydrophobicContact CB-CZ 4.28Å; V14-F120 HydrophobicContact CG1-CZ 3.96Å; V14-F120 HydrophobicContact CG2-CE2 3.96Å; V14-F120 HydrophobicContact CG2-CZ 3.7Å; V14-Y124 HydrophobicContact CG2-CD2 4.06Å; V14-Y124 HydrophobicContact CG2-CE2 4.39Å
15F95Very high92Very high150 Ų15065.2 Ų65.266%0.65833%0.328SS*.THydrogen-bonded Turntrans-61.2-23.4176.9-69.8-59.9000114.1L11 L12 L13L11-F15 HydrophobicContact CG-CE2 4.38Å; L11-F15 WeakPolarHBondContact O-CD2 3.41Å; L12-F15 HydrophobicContact CD2-CE2 4.47Å; L13-F15 PolarHBondContact O-N 3.37Å
16Y94.3Very high91.9Very high109 Ų10967.7 Ų67.743%0.42734%0.341SS..THydrogen-bonded Turntrans-110.8-13.8-176.8-56.8-76.7000113.3L12 L13 V14 F30 I31 V35L12-Y16 WeakPolarHBondContact O-CD2 3.25Å; L13-Y16 PolarHBondContact O-N 3.04Å; V14-Y16 PolarHBondContact O-N 2.94Å; V14-Y16 VanDerWaalsContact O-N 3.15Å; Y16-F30 HydrophobicContact CD1-CE1 4.27Å; Y16-I31 VanDerWaalsContact CB-CG1 3.5Å; Y16-I31 HydrophobicContact CG-CG1 4.4Å; Y16-V35 HydrophobicContact CD1-CG1 4.37Å; Y16-V35 HydrophobicContact CD1-CG2 3.58Å; Y16-V35 HydrophobicContact CD2-CG1 4.16Å; Y16-V35 HydrophobicContact CD2-CG2 4.37Å; Y16-V35 HydrophobicContact CE1-CG1 3.96Å; Y16-V35 HydrophobicContact CE1-CG2 3.82Å; Y16-V35 HydrophobicContact CE2-CG1 3.74Å; Y16-V35 HydrophobicContact CG-CG1 4.45Å; Y16-V35 HydrophobicContact CG-CG2 3.87Å
17Y93.3Very high91.9Very high47 Ų4772.3 Ų72.318%0.18436%0.357CS..  trans-95.9139.1-175-176.1-103.7000112.3L13 V14 P19 A24 R27 I28 F120L13-Y17 PolarHBondContact O-N 3.12Å; L13-Y17 VanDerWaalsContact O-N 3.15Å; V14-Y17 PolarHBondContact O-N 3.08Å; Y17-P19 HydrophobicContact CE1-CB 3.99Å; Y17-A24 HydrophobicContact CE2-CB 4.26Å; Y17-R27 HydrophobicContact CD2-CB 4.28Å; Y17-I28 HydrophobicContact CD2-CG1 4.2Å; Y17-I28 HydrophobicContact CE2-CD1 4.3Å; Y17-I28 HydrophobicContact CE2-CG1 3.89Å; Y17-F120 AromaticContact CD1-CD2 3.78Å; Y17-F120 HydrophobicContact CD1-CD2 3.78Å; Y17-F120 AromaticContact CD1-CE2 3.42Å; Y17-F120 HydrophobicContact CD1-CE2 3.42Å; Y17-F120 VanDerWaalsContact CD1-CE2 3.42Å; Y17-F120 HydrophobicContact CD1-CZ 4.02Å; Y17-F120 AromaticContact CE1-CD2 3.72Å; Y17-F120 HydrophobicContact CE1-CD2 3.72Å; Y17-F120 AromaticContact CE1-CE2 3.89Å; Y17-F120 HydrophobicContact CE1-CE2 3.89Å; Y17-F120 HydrophobicContact CE1-CG 4.42Å
18V91.4Very high91.7Very high46 Ų4672.1 Ų72.128%0.27936%0.356SS..  trans-126.8115.7176.8-173.90000109.4R20 R27V18-R20 HydrophobicContact CG1-CG 3.97Å; V18-R20 PolarHBondContact O-N 3.14Å; V18-R27 HydrophobicContact CB-CG 4.23Å; V18-R27 HydrophobicContact CG2-CG 4.43Å
19P87.9Confident91.5Very high20 Ų2070.4 Ų70.413%0.1335%0.347CS..  trans-78.282.9-17932.1-36.6000111.2Y17 L116 Q117 F120Y17-P19 HydrophobicContact CE1-CB 3.99Å; P19-L116 HydrophobicContact CB-CD2 4.29Å; P19-L116 HydrophobicContact CB-CG 4.06Å; P19-Q117 HydrophobicContact CB-CG 4.38Å; P19-Q117 HydrophobicContact CG-CG 4.18Å; P19-Q117 WeakPolarHBondContact O-CG 3.39Å; P19-F120 HydrophobicContact CB-CB 3.85Å; P19-F120 HydrophobicContact CB-CD1 4.22Å; P19-F120 HydrophobicContact CB-CG 3.99Å; P19-F120 HydrophobicContact CG-CB 4.17Å; P19-F120 HydrophobicContact CG-CD1 3.65Å; P19-F120 HydrophobicContact CG-CE1 4.16Å; P19-F120 HydrophobicContact CG-CG 3.95Å
20R85.2Confident91.4Very high139 Ų13974.1 Ų74.153%0.52536%0.362SS..  trans-124.3143.9171.6-69.9176.4-157.7-165.67.2110.4V18 V22 A24 L116V18-R20 HydrophobicContact CG1-CG 3.97Å; V18-R20 PolarHBondContact O-N 3.14Å; R20-V22 VanDerWaalsContact C-N 3.3Å; R20-V22 WeakPolarHBondContact CB-O 3.34Å; R20-V22 PolarHBondContact O-N 2.84Å; R20-A24 WeakPolarHBondContact O-CB 3.26Å; R20-A24 PolarHBondContact O-N 2.9Å; R20-L116 WeakPolarHBondContact O-CD2 3.32Å
21E80.6Confident91.3Very high119 Ų11973.6 Ų73.656%0.55636%0.357SS*.THydrogen-bonded Turntrans-57-45.5179.1-172.9176.4165.200111.6R112 R113E21-R112 WeakPolarHBondContact OE2-CA 3.31Å; E21-R113 HydrophobicContact CB-CB 4.45Å; E21-R113 PolarHBondContact OE2-N 3.25Å
22V86.3Confident91.2Very high130 Ų13073.1 Ų73.179%0.78835%0.353SS*.THydrogen-bonded Turntrans-92.1125.3170.9-174.90000109.1R20R20-V22 VanDerWaalsContact C-N 3.3Å; R20-V22 WeakPolarHBondContact CB-O 3.34Å; R20-V22 PolarHBondContact O-N 2.84Å
23G85.3Confident91Very high24 Ų2478.8 Ų78.825%0.24737%0.37CS..THydrogen-bonded Turntrans87.7-0.4172.400000116.7F25 D26 R27G23-F25 VanDerWaalsContact C-N 3.27Å; G23-F25 PolarHBondContact O-N 3.2Å; G23-D26 WeakPolarHBondContact CA-OD2 3.43Å; G23-D26 PolarHBondContact O-N 3.42Å; G23-R27 WeakPolarHBondContact O-CG 3.5Å; G23-R27 PolarHBondContact O-N 3.17Å; G23-R27 VanDerWaalsContact O-N 3.09Å
24A86.6Confident90.9Very high11 Ų1184 Ų849%0.09139%0.394CS..Hα-helixtrans-58.8-41.2172.900000112Y17 R20 D26 R27 I28 L116Y17-A24 HydrophobicContact CE2-CB 4.26Å; R20-A24 WeakPolarHBondContact O-CB 3.26Å; R20-A24 PolarHBondContact O-N 2.9Å; A24-D26 VanDerWaalsContact C-N 3.32Å; A24-D26 PolarHBondContact O-N 3.49Å; A24-R27 PolarHBondContact O-N 3.34Å; A24-I28 WeakPolarHBondContact O-CG1 3.24Å; A24-I28 PolarHBondContact O-N 3.12Å; A24-I28 VanDerWaalsContact O-N 3.11Å; A24-L116 HydrophobicContact CB-CD2 3.97Å
25F88.1Confident90.9Very high143 Ų14382.7 Ų82.763%0.62739%0.386SS*.Hα-helixtrans-66.1-35.1176.8-169.7-107.8000112.3G23 R27 I28 I29G23-F25 VanDerWaalsContact C-N 3.27Å; G23-F25 PolarHBondContact O-N 3.2Å; F25-R27 VanDerWaalsContact C-N 3.31Å; F25-R27 PolarHBondContact O-N 3.35Å; F25-I28 HydrophobicContact CD2-CG2 4.43Å; F25-I28 HydrophobicContact CE2-CG2 4.45Å; F25-I28 WeakPolarHBondContact O-CA 3.5Å; F25-I28 VanDerWaalsContact O-CB 3.23Å; F25-I28 WeakPolarHBondContact O-CB 3.25Å; F25-I28 PolarHBondContact O-N 3Å; F25-I29 HydrophobicContact CD1-CD1 3.68Å; F25-I29 HydrophobicContact CD1-CG1 4.21Å; F25-I29 HydrophobicContact CE1-CD1 3.54Å; F25-I29 HydrophobicContact CE1-CG1 4Å; F25-I29 HydrophobicContact CZ-CD1 4.41Å; F25-I29 HydrophobicContact CZ-CG1 4.44Å; F25-I29 WeakPolarHBondContact O-CG1 3.31Å; F25-I29 PolarHBondContact O-N 3.34Å
26D92.6Very high90.8Very high99 Ų9983.6 Ų83.653%0.52939%0.39SS..Hα-helixtrans-66.2-36175.8-55.2-34.3000111.4G23 A24 I28 I29 F30G23-D26 WeakPolarHBondContact CA-OD2 3.43Å; G23-D26 PolarHBondContact O-N 3.42Å; A24-D26 VanDerWaalsContact C-N 3.32Å; A24-D26 PolarHBondContact O-N 3.49Å; D26-I28 VanDerWaalsContact C-N 3.29Å; D26-I28 PolarHBondContact O-N 3.06Å; D26-I29 PolarHBondContact O-N 3Å; D26-F30 WeakPolarHBondContact O-CB 3.23Å; D26-F30 PolarHBondContact O-N 3Å
27R93.6Very high90.7Very high117 Ų11786 Ų8644%0.44240%0.399SS..Hα-helixtrans-64.3-35.7171.4-62.3-60.1176.9-177.2-2.8112.1Y17 V18 G23 A24 F25 F30 I31Y17-R27 HydrophobicContact CD2-CB 4.28Å; V18-R27 HydrophobicContact CB-CG 4.23Å; V18-R27 HydrophobicContact CG2-CG 4.43Å; G23-R27 WeakPolarHBondContact O-CG 3.5Å; G23-R27 PolarHBondContact O-N 3.17Å; G23-R27 VanDerWaalsContact O-N 3.09Å; A24-R27 PolarHBondContact O-N 3.34Å; F25-R27 VanDerWaalsContact C-N 3.31Å; F25-R27 PolarHBondContact O-N 3.35Å; R27-F30 PolarHBondContact O-N 3.31Å; R27-I31 WeakPolarHBondContact O-CD1 3.37Å; R27-I31 VanDerWaalsContact O-CG1 3.26Å; R27-I31 WeakPolarHBondContact O-CG1 3.24Å; R27-I31 PolarHBondContact O-N 3.11Å
28I92.1Very high90.7Very high41 Ų4183.9 Ų83.921%0.2139%0.391CS..Hα-helixtrans-61.9-48172.4-70.4-174.2000110.8Y17 A24 F25 D26 F30 I31 M32Y17-I28 HydrophobicContact CD2-CG1 4.2Å; Y17-I28 HydrophobicContact CE2-CD1 4.3Å; Y17-I28 HydrophobicContact CE2-CG1 3.89Å; A24-I28 WeakPolarHBondContact O-CG1 3.24Å; A24-I28 PolarHBondContact O-N 3.12Å; A24-I28 VanDerWaalsContact O-N 3.11Å; F25-I28 HydrophobicContact CD2-CG2 4.43Å; F25-I28 HydrophobicContact CE2-CG2 4.45Å; F25-I28 WeakPolarHBondContact O-CA 3.5Å; F25-I28 VanDerWaalsContact O-CB 3.23Å; F25-I28 WeakPolarHBondContact O-CB 3.25Å; F25-I28 PolarHBondContact O-N 3Å; D26-I28 VanDerWaalsContact C-N 3.29Å; D26-I28 PolarHBondContact O-N 3.06Å; I28-F30 VanDerWaalsContact C-N 3.35Å; I28-I31 PolarHBondContact O-N 3.06Å; I28-M32 VanDerWaalsContact O-CG 3.27Å; I28-M32 WeakPolarHBondContact O-CG 3.5Å; I28-M32 PolarHBondContact O-N 3.21Å; I28-M32 VanDerWaalsContact O-N 3.12Å
29I93.2Very high90.7Very high62 Ų6284.5 Ų84.532%0.31839%0.39SS..Hα-helixtrans-61.3-45.2177.1-65.6168000110.5F25 D26 I31 M32 R33F25-I29 HydrophobicContact CD1-CD1 3.68Å; F25-I29 HydrophobicContact CD1-CG1 4.21Å; F25-I29 HydrophobicContact CE1-CD1 3.54Å; F25-I29 HydrophobicContact CE1-CG1 4Å; F25-I29 HydrophobicContact CZ-CD1 4.41Å; F25-I29 HydrophobicContact CZ-CG1 4.44Å; F25-I29 WeakPolarHBondContact O-CG1 3.31Å; F25-I29 PolarHBondContact O-N 3.34Å; D26-I29 PolarHBondContact O-N 3Å; I29-I31 VanDerWaalsContact C-N 3.33Å; I29-I31 PolarHBondContact O-N 2.93Å; I29-M32 WeakPolarHBondContact O-CA 3.48Å; I29-M32 WeakPolarHBondContact O-CB 3.32Å; I29-M32 PolarHBondContact O-N 2.98Å; I29-R33 HydrophobicContact CG2-CG 4.26Å; I29-R33 PolarHBondContact O-N 3.33Å
30F93.9Very high90.9Very high84 Ų8488.3 Ų88.337%0.36841%0.405SS..Hα-helixtrans-56-46.4177.1175.7-97000111.8Y16 D26 R27 I28 M32 R33 E34 V35Y16-F30 HydrophobicContact CD1-CE1 4.27Å; D26-F30 WeakPolarHBondContact O-CB 3.23Å; D26-F30 PolarHBondContact O-N 3Å; R27-F30 PolarHBondContact O-N 3.31Å; I28-F30 VanDerWaalsContact C-N 3.35Å; F30-M32 VanDerWaalsContact C-N 3.26Å; F30-M32 PolarHBondContact O-N 3.4Å; F30-R33 PolarHBondContact O-N 2.92Å; F30-E34 HydrophobicContact CD2-CB 3.59Å; F30-E34 HydrophobicContact CD2-CG 3.55Å; F30-E34 HydrophobicContact CE2-CB 3.48Å; F30-E34 VanDerWaalsContact CE2-CB 3.48Å; F30-E34 HydrophobicContact CE2-CG 3.82Å; F30-E34 HydrophobicContact CG-CB 4.29Å; F30-E34 HydrophobicContact CG-CG 4.4Å; F30-E34 HydrophobicContact CZ-CB 4.11Å; F30-E34 WeakPolarHBondContact O-CB 3.42Å; F30-E34 PolarHBondContact O-N 3.07Å; F30-V35 HydrophobicContact CD1-CG2 3.98Å; F30-V35 HydrophobicContact CE1-CG2 3.62Å; F30-V35 HydrophobicContact CZ-CG2 4.33Å; F30-V35 PolarHBondContact O-N 3.33Å
31I94.8Very high91.4Very high2 Ų283.6 Ų83.61%0.0139%0.39CS..Hα-helixtrans-58.9-40.3174.5-69.5164.1000111.4L13 Y16 R27 I28 I29 G38L13-I31 HydrophobicContact CD2-CD1 4.42Å; L13-I31 HydrophobicContact CD2-CG2 3.7Å; Y16-I31 VanDerWaalsContact CB-CG1 3.5Å; Y16-I31 HydrophobicContact CG-CG1 4.4Å; R27-I31 WeakPolarHBondContact O-CD1 3.37Å; R27-I31 VanDerWaalsContact O-CG1 3.26Å; R27-I31 WeakPolarHBondContact O-CG1 3.24Å; R27-I31 PolarHBondContact O-N 3.11Å; I28-I31 PolarHBondContact O-N 3.06Å; I29-I31 VanDerWaalsContact C-N 3.33Å; I29-I31 PolarHBondContact O-N 2.93Å; I31-G38 CarbonylContact O-C 3.39Å; I31-G38 VanDerWaalsContact O-CA 3.26Å; I31-G38 WeakPolarHBondContact O-CA 3.49Å
32M93.4Very high92Very high58 Ų5880.9 Ų80.929%0.28638%0.375SS..Hα-helixtrans-74.7-29.3-176-67.9-64.9-89.800113.5I28 I29 F30 F39 R42I28-M32 VanDerWaalsContact O-CG 3.27Å; I28-M32 WeakPolarHBondContact O-CG 3.5Å; I28-M32 PolarHBondContact O-N 3.21Å; I28-M32 VanDerWaalsContact O-N 3.12Å; I29-M32 WeakPolarHBondContact O-CA 3.48Å; I29-M32 WeakPolarHBondContact O-CB 3.32Å; I29-M32 PolarHBondContact O-N 2.98Å; F30-M32 VanDerWaalsContact C-N 3.26Å; F30-M32 PolarHBondContact O-N 3.4Å; M32-F39 HydrophobicContact CE-CD2 3.27Å; M32-F39 HydrophobicContact CE-CE2 3.59Å; M32-F39 HydrophobicContact CE-CG 4.43Å; M32-F39 HydrophobicContact SD-CD2 3.94Å; M32-R42 HydrophobicContact SD-CB 3.58Å; M32-R42 VanDerWaalsContact SD-CB 3.58Å; M32-R42 WeakPolarHBondContact SD-CD 3.45Å; M32-R42 HydrophobicContact SD-CG 4Å; M32-R42 PolarHBondContact SD-NE 3.03Å
33R92Very high92.3Very high185 Ų18575.5 Ų75.570%0.69834%0.341SS*.Hα-helixtrans-108.5-42.1-172.1-65.9-174.5177-104.40.3113.9I29 F30I29-R33 HydrophobicContact CG2-CG 4.26Å; I29-R33 PolarHBondContact O-N 3.33Å; F30-R33 PolarHBondContact O-N 2.92Å
34E94.6Very high92.7Very high132 Ų13276.6 Ų76.662%0.61734%0.341SS*.THydrogen-bonded Turntrans-102.3-29.1-167.3-53-54.2141.700113F30 K36F30-E34 HydrophobicContact CD2-CB 3.59Å; F30-E34 HydrophobicContact CD2-CG 3.55Å; F30-E34 HydrophobicContact CE2-CB 3.48Å; F30-E34 VanDerWaalsContact CE2-CB 3.48Å; F30-E34 HydrophobicContact CE2-CG 3.82Å; F30-E34 HydrophobicContact CG-CB 4.29Å; F30-E34 HydrophobicContact CG-CG 4.4Å; F30-E34 HydrophobicContact CZ-CB 4.11Å; F30-E34 WeakPolarHBondContact O-CB 3.42Å; F30-E34 PolarHBondContact O-N 3.07Å; E34-K36 PolarHBondContact O-N 3.44Å
35V94.5Very high93.1Very high18 Ų1877.9 Ų77.911%0.10935%0.345CS..SBendtrans-78.8126.2179.91790000109.9Y16 F30 Y37 G38Y16-V35 HydrophobicContact CD1-CG1 4.37Å; Y16-V35 HydrophobicContact CD1-CG2 3.58Å; Y16-V35 HydrophobicContact CD2-CG1 4.16Å; Y16-V35 HydrophobicContact CD2-CG2 4.37Å; Y16-V35 HydrophobicContact CE1-CG1 3.96Å; Y16-V35 HydrophobicContact CE1-CG2 3.82Å; Y16-V35 HydrophobicContact CE2-CG1 3.74Å; Y16-V35 HydrophobicContact CG-CG1 4.45Å; Y16-V35 HydrophobicContact CG-CG2 3.87Å; F30-V35 HydrophobicContact CD1-CG2 3.98Å; F30-V35 HydrophobicContact CE1-CG2 3.62Å; F30-V35 HydrophobicContact CZ-CG2 4.33Å; F30-V35 PolarHBondContact O-N 3.33Å; V35-Y37 PolarHBondContact O-N 2.99Å; V35-G38 PolarHBondContact O-N 3.4Å
36K93.6Very high93.4Very high170 Ų17076.4 Ų76.474%0.73934%0.343SS*.THydrogen-bonded Turntrans-55.9123176.2-167-175-176.9-179.50110.5E34 G38E34-K36 PolarHBondContact O-N 3.44Å; K36-G38 PolarHBondContact O-N 3.49Å; K36-G38 VanDerWaalsContact O-N 3.14Å
37Y92.3Very high93.4Very high159 Ų15973.2 Ų73.262%0.62433%0.326SS*.THydrogen-bonded Turntrans59.410-172.5-50.4-69.1000115.6V35 F39 F40 L41V35-Y37 PolarHBondContact O-N 2.99Å; Y37-F39 VanDerWaalsContact C-N 3.28Å; Y37-F39 PolarHBondContact O-N 3.43Å; Y37-F40 PolarHBondContact O-N 3.23Å; Y37-F40 VanDerWaalsContact O-N 3.14Å; Y37-L41 WeakPolarHBondContact O-CB 3.09Å; Y37-L41 PolarHBondContact O-N 3.19Å
38G93.3Very high93.4Very high2 Ų267.6 Ų67.62%0.02131%0.305CS..Hα-helixtrans-62.7-34.5-177.600000113I31 V35 K36 L41 R42I31-G38 CarbonylContact O-C 3.39Å; I31-G38 VanDerWaalsContact O-CA 3.26Å; I31-G38 WeakPolarHBondContact O-CA 3.49Å; V35-G38 PolarHBondContact O-N 3.4Å; K36-G38 PolarHBondContact O-N 3.49Å; K36-G38 VanDerWaalsContact O-N 3.14Å; G38-L41 PolarHBondContact O-N 2.63Å; G38-R42 PolarHBondContact O-N 2.89Å
39F91.5Very high93.5Very high59 Ų5967.4 Ų67.426%0.25931%0.309SS..Hα-helixtrans-55.5-54.5169.6179.6-114.4000113M32 Y37 L41 R42 L43 L188M32-F39 HydrophobicContact CE-CD2 3.27Å; M32-F39 HydrophobicContact CE-CE2 3.59Å; M32-F39 HydrophobicContact CE-CG 4.43Å; M32-F39 HydrophobicContact SD-CD2 3.94Å; Y37-F39 VanDerWaalsContact C-N 3.28Å; Y37-F39 PolarHBondContact O-N 3.43Å; F39-L41 VanDerWaalsContact C-N 3.3Å; F39-L41 PolarHBondContact O-N 3.14Å; F39-R42 PolarHBondContact O-N 2.99Å; F39-L43 HydrophobicContact CD1-CD1 3.82Å; F39-L43 HydrophobicContact CD2-CD1 4.42Å; F39-L43 HydrophobicContact CE1-CD1 3.42Å; F39-L43 VanDerWaalsContact CE1-CD1 3.42Å; F39-L43 HydrophobicContact CE2-CD1 4Å; F39-L43 HydrophobicContact CE2-CG 4.49Å; F39-L43 HydrophobicContact CG-CD1 4.32Å; F39-L43 HydrophobicContact CZ-CD1 3.48Å; F39-L43 VanDerWaalsContact CZ-CD1 3.48Å; F39-L43 HydrophobicContact CZ-CG 4.38Å; F39-L43 PolarHBondContact O-N 2.94Å; F39-L188 HydrophobicContact CD1-CD2 3.92Å; F39-L188 HydrophobicContact CE1-CD2 3.29Å; F39-L188 HydrophobicContact CZ-CD2 4.2Å
40F91.8Very high93.5Very high100 Ų10067.6 Ų67.644%0.43932%0.316SS..Hα-helixtrans-60.8-41.7178-78.7-90.7000111.6Y37 L43 I44 L188Y37-F40 PolarHBondContact O-N 3.23Å; Y37-F40 VanDerWaalsContact O-N 3.14Å; F40-L43 WeakPolarHBondContact O-CB 3.39Å; F40-L43 PolarHBondContact O-N 2.8Å; F40-I44 WeakPolarHBondContact O-CG1 3.23Å; F40-I44 PolarHBondContact O-N 2.93Å; F40-L188 HydrophobicContact CD1-CD1 4.01Å; F40-L188 HydrophobicContact CD1-CD2 4.17Å; F40-L188 HydrophobicContact CE1-CD1 3.27Å; F40-L188 HydrophobicContact CE1-CD2 3.77Å; F40-L188 HydrophobicContact CE1-CG 4.18Å; F40-L188 HydrophobicContact CZ-CD1 3.97Å; F40-L188 HydrophobicContact CZ-CD2 3.98Å
41L94.4Very high93.5Very high40 Ų4065 Ų6521%0.20931%0.306CS..Hα-helixtrans-65.2-41.9-178.2-163.6146.1000111.5S9 L12 L13 Y37 G38 F39 I44 H45S9-L41 WeakPolarHBondContact O-CD2 3.48Å; L12-L41 HydrophobicContact CB-CD1 3.63Å; L12-L41 HydrophobicContact CB-CD2 4.09Å; L12-L41 HydrophobicContact CB-CG 4.44Å; L12-L41 HydrophobicContact CD1-CD1 3.69Å; L12-L41 HydrophobicContact CG-CD1 4.3Å; L13-L41 HydrophobicContact CB-CD2 4.38Å; L13-L41 HydrophobicContact CD1-CD2 4.17Å; L13-L41 HydrophobicContact CD2-CD2 3.38Å; L13-L41 HydrophobicContact CG-CD2 3.31Å; Y37-L41 WeakPolarHBondContact O-CB 3.09Å; Y37-L41 PolarHBondContact O-N 3.19Å; G38-L41 PolarHBondContact O-N 2.63Å; F39-L41 VanDerWaalsContact C-N 3.3Å; F39-L41 PolarHBondContact O-N 3.14Å; L41-I44 PolarHBondContact O-N 3Å; L41-H45 PolarHBondContact O-N 3.31Å; L41-H45 VanDerWaalsContact O-N 3.08Å
42R93.1Very high93.5Very high62 Ų6265.9 Ų65.923%0.23431%0.31CS..Hα-helixtrans-64.3-43.6171.5-172.3-166.7-78.3-102.9-24.9111.6L13 M32 G38 F39 I44 H45 L46L13-R42 HydrophobicContact CD2-CB 4.45Å; M32-R42 HydrophobicContact SD-CB 3.58Å; M32-R42 VanDerWaalsContact SD-CB 3.58Å; M32-R42 WeakPolarHBondContact SD-CD 3.45Å; M32-R42 HydrophobicContact SD-CG 4Å; M32-R42 PolarHBondContact SD-NE 3.03Å; G38-R42 PolarHBondContact O-N 2.89Å; F39-R42 PolarHBondContact O-N 2.99Å; R42-I44 VanDerWaalsContact C-N 3.31Å; R42-I44 PolarHBondContact O-N 3.35Å; R42-H45 PolarHBondContact O-N 3.14Å; R42-L46 WeakPolarHBondContact O-CB 3.18Å; R42-L46 PolarHBondContact O-N 2.75Å
43L93.4Very high93.6Very high17 Ų1764.9 Ų64.99%0.08931%0.305CS..Hα-helixtrans-58.9-43179-87167.4000112F39 F40 N47 L184 I187 L188F39-L43 HydrophobicContact CD1-CD1 3.82Å; F39-L43 HydrophobicContact CD2-CD1 4.42Å; F39-L43 HydrophobicContact CE1-CD1 3.42Å; F39-L43 VanDerWaalsContact CE1-CD1 3.42Å; F39-L43 HydrophobicContact CE2-CD1 4Å; F39-L43 HydrophobicContact CE2-CG 4.49Å; F39-L43 HydrophobicContact CG-CD1 4.32Å; F39-L43 HydrophobicContact CZ-CD1 3.48Å; F39-L43 VanDerWaalsContact CZ-CD1 3.48Å; F39-L43 HydrophobicContact CZ-CG 4.38Å; F39-L43 PolarHBondContact O-N 2.94Å; F40-L43 WeakPolarHBondContact O-CB 3.39Å; F40-L43 PolarHBondContact O-N 2.8Å; L43-N47 VanDerWaalsContact O-CB 3.3Å; L43-N47 WeakPolarHBondContact O-CB 3.45Å; L43-N47 PolarHBondContact O-N 2.92Å; L43-N47 PolarHBondContact O-ND2 3.41Å; L43-L184 HydrophobicContact CB-CD2 4.12Å; L43-I187 HydrophobicContact CD2-CG2 3.61Å; L43-L188 HydrophobicContact CD1-CD2 3.45Å; L43-L188 VanDerWaalsContact CD1-CD2 3.45Å; L43-L188 HydrophobicContact CD1-CG 4.24Å
44I94.1Very high93.7Very high48 Ų4860.4 Ų60.425%0.24629%0.294CS..Hα-helixtrans-62.5-45.3175.2-69.2166.1000110.5Q6 F40 L41 R42 G48 L184Q6-I44 PolarHBondContact NE2-O 2.91Å; F40-I44 WeakPolarHBondContact O-CG1 3.23Å; F40-I44 PolarHBondContact O-N 2.93Å; L41-I44 PolarHBondContact O-N 3Å; R42-I44 VanDerWaalsContact C-N 3.31Å; R42-I44 PolarHBondContact O-N 3.35Å; I44-G48 WeakPolarHBondContact O-CA 3.4Å; I44-G48 PolarHBondContact O-N 3.21Å; I44-L184 HydrophobicContact CG1-CD1 3.99Å
45H95Very high93.8Very high38 Ų3856.1 Ų56.118%0.17628%0.275CS..Hα-helixtrans-61.7-53.2179.7-160.670.6000111.1Q6 S9 G10 L13 L41 R42 A49Q6-H45 PolarHBondContact NE2-O 2.95Å; Q6-H45 PolarHBondContact O-CE1 3.45Å; Q6-H45 PolarHBondContact O-ND1 3.26Å; Q6-H45 PolarHBondContact OE1-CE1 3.01Å; Q6-H45 VanDerWaalsContact OE1-CE1 3.22Å; Q6-H45 PolarHBondContact OE1-ND1 3.34Å; Q6-H45 PolarHBondContact OE1-O 3.31Å; Q6-H45 VanDerWaalsContact OE1-O 3.04Å; S9-H45 PolarHBondContact OG-ND1 3.48Å; G10-H45 WeakPolarHBondContact CA-CE1 3.35Å; G10-H45 PolarHBondContact N-CE1 3.41Å; G10-H45 PolarHBondContact N-ND1 3.01Å; L13-H45 HydrophobicContact CD1-CB 3.72Å; L41-H45 PolarHBondContact O-N 3.31Å; L41-H45 VanDerWaalsContact O-N 3.08Å; R42-H45 PolarHBondContact O-N 3.14Å; H45-A49 PolarHBondContact O-N 2.96Å; H45-A49 VanDerWaalsContact O-N 3.08Å
46L93.2Very high93.9Very high112 Ų11256.8 Ų56.859%0.58628%0.277SS*.Hα-helixtrans-61.5-52.9-178.9-176.668.4000112.4R42 A49 S50R42-L46 WeakPolarHBondContact O-CB 3.18Å; R42-L46 PolarHBondContact O-N 2.75Å; L46-A49 WeakPolarHBondContact O-CB 3.47Å; L46-A49 PolarHBondContact O-N 3.38Å; L46-S50 PolarHBondContact O-N 3.32Å
47N93.4Very high94Very high31 Ų3154.9 Ų54.917%0.16627%0.266CS..Hα-helixtrans-73.6-33.2-176.1-70.2-73.9000112.2L43 A49 S50 L51 F180 L184 I187L43-N47 VanDerWaalsContact O-CB 3.3Å; L43-N47 WeakPolarHBondContact O-CB 3.45Å; L43-N47 PolarHBondContact O-N 2.92Å; L43-N47 PolarHBondContact O-ND2 3.41Å; N47-A49 VanDerWaalsContact C-N 3.27Å; N47-A49 PolarHBondContact O-N 3.46Å; N47-S50 WeakPolarHBondContact O-CB 3.47Å; N47-S50 PolarHBondContact O-N 2.66Å; N47-L51 PolarHBondContact O-N 2.89Å; N47-F180 HydrophobicContact CB-CE2 3.87Å; N47-F180 HydrophobicContact CB-CZ 4.35Å; N47-L184 HydrophobicContact CB-CD2 4.01Å; N47-I187 VanDerWaalsContact OD1-CD1 3.27Å; N47-I187 WeakPolarHBondContact OD1-CD1 3.4Å
48G94.6Very high94.2Very high0 Ų052.3 Ų52.30%026%0.262CS..Hα-helixtrans-70.2-26.4177.300000112I44 L51 I52I44-G48 WeakPolarHBondContact O-CA 3.4Å; I44-G48 PolarHBondContact O-N 3.21Å; G48-L51 PolarHBondContact O-N 3.42Å; G48-I52 WeakPolarHBondContact O-CG1 3.29Å; G48-I52 PolarHBondContact O-N 3.22Å
49A94Very high94.2Very high36 Ų3657.2 Ų57.230%0.29828%0.284SS..Hα-helixtrans-61.8-46.9169.600000110.8Q6 H45 L46 N47 L51 I52 F53Q6-A49 VanDerWaalsContact NE2-N 3.15Å; H45-A49 PolarHBondContact O-N 2.96Å; H45-A49 VanDerWaalsContact O-N 3.08Å; L46-A49 WeakPolarHBondContact O-CB 3.47Å; L46-A49 PolarHBondContact O-N 3.38Å; N47-A49 VanDerWaalsContact C-N 3.27Å; N47-A49 PolarHBondContact O-N 3.46Å; A49-L51 VanDerWaalsContact C-N 3.3Å; A49-L51 PolarHBondContact O-N 3.48Å; A49-I52 WeakPolarHBondContact O-CB 3.49Å; A49-I52 PolarHBondContact O-N 2.89Å; A49-F53 WeakPolarHBondContact O-CD2 3.3Å; A49-F53 PolarHBondContact O-N 2.84Å
50S93.2Very high94.4Very high66 Ų6655.8 Ų55.846%0.46228%0.279SS..Hα-helixtrans-58.2-42173.7-56.80000112.2L46 N47 I52 F53 I54L46-S50 PolarHBondContact O-N 3.32Å; N47-S50 WeakPolarHBondContact O-CB 3.47Å; N47-S50 PolarHBondContact O-N 2.66Å; S50-I52 VanDerWaalsContact C-N 3.34Å; S50-I52 PolarHBondContact O-N 3.37Å; S50-F53 PolarHBondContact O-N 2.92Å; S50-I54 WeakPolarHBondContact O-CG1 3.33Å; S50-I54 PolarHBondContact O-N 3.5Å; S50-I54 VanDerWaalsContact O-N 3.1Å
51L93.4Very high94.6Very high29 Ų2953.3 Ų53.315%0.15228%0.277CS..Hα-helixtrans-67.5-32.3179.1-173.554000112.9I2 N47 G48 A49 F53 I54 L55 F180I2-L51 HydrophobicContact CD1-CB 4.45Å; I2-L51 HydrophobicContact CD1-CD2 3.21Å; I2-L51 HydrophobicContact CD1-CG 3.56Å; N47-L51 PolarHBondContact O-N 2.89Å; G48-L51 PolarHBondContact O-N 3.42Å; A49-L51 VanDerWaalsContact C-N 3.3Å; A49-L51 PolarHBondContact O-N 3.48Å; L51-F53 VanDerWaalsContact C-N 3.34Å; L51-I54 HydrophobicContact CD1-CB 4.42Å; L51-I54 PolarHBondContact O-N 2.97Å; L51-L55 HydrophobicContact CD1-CG 4.28Å; L51-L55 HydrophobicContact CG-CD1 4.36Å; L51-L55 HydrophobicContact CG-CG 4.48Å; L51-L55 WeakPolarHBondContact O-CB 3.49Å; L51-L55 VanDerWaalsContact O-CG 3.29Å; L51-L55 WeakPolarHBondContact O-CG 3.32Å; L51-L55 PolarHBondContact O-N 3.23Å; L51-F180 HydrophobicContact CB-CD2 4.38Å; L51-F180 HydrophobicContact CD2-CB 3.72Å; L51-F180 HydrophobicContact CD2-CD2 3.36Å; L51-F180 HydrophobicContact CD2-CE2 4.14Å; L51-F180 HydrophobicContact CD2-CG 3.7Å
52I95.1Very high94.5Very high21 Ų2156 Ų5611%0.10829%0.287CS..Hα-helixtrans-59-46.3171.1-73.7176.3000110.5I2 F3 Q6 G48 A49 S50 L55 I56 T85I2-I52 HydrophobicContact CB-CG1 4.43Å; I2-I52 HydrophobicContact CG2-CD1 4.32Å; I2-I52 HydrophobicContact CG2-CG1 3.71Å; F3-I52 HydrophobicContact CD2-CD1 4.13Å; Q6-I52 HydrophobicContact CB-CD1 4.19Å; Q6-I52 HydrophobicContact CG-CD1 3.46Å; Q6-I52 VanDerWaalsContact CG-CD1 3.46Å; Q6-I52 HydrophobicContact CG-CG1 4.49Å; G48-I52 WeakPolarHBondContact O-CG1 3.29Å; G48-I52 PolarHBondContact O-N 3.22Å; A49-I52 WeakPolarHBondContact O-CB 3.49Å; A49-I52 PolarHBondContact O-N 2.89Å; S50-I52 VanDerWaalsContact C-N 3.34Å; S50-I52 PolarHBondContact O-N 3.37Å; I52-L55 PolarHBondContact O-N 3.35Å; I52-I56 HydrophobicContact CG2-CD1 3.59Å; I52-I56 HydrophobicContact CG2-CG1 4.24Å; I52-I56 WeakPolarHBondContact O-CB 3.38Å; I52-I56 VanDerWaalsContact O-CG1 3.32Å; I52-I56 WeakPolarHBondContact O-CG1 3.35Å; I52-I56 PolarHBondContact O-N 2.96Å; I52-T85 HydrophobicContact CG2-CG2 3.82Å
53F95.2Very high94.4Very high38 Ų3853.6 Ų53.617%0.16728%0.28CS..Hα-helixtrans-61.8-45.7177.8-80.3-77.1000112.5A49 S50 L51 L55 I56 Y57 T85 I86 A89A49-F53 WeakPolarHBondContact O-CD2 3.3Å; A49-F53 PolarHBondContact O-N 2.84Å; S50-F53 PolarHBondContact O-N 2.92Å; L51-F53 VanDerWaalsContact C-N 3.34Å; F53-L55 VanDerWaalsContact C-N 3.29Å; F53-L55 PolarHBondContact O-N 3.22Å; F53-I56 PolarHBondContact O-N 3.49Å; F53-Y57 HydrophobicContact CB-CD2 4.48Å; F53-Y57 HydrophobicContact CB-CE2 4Å; F53-Y57 HydrophobicContact CD1-CE1 4.45Å; F53-Y57 HydrophobicContact CD1-CE2 4.36Å; F53-Y57 AromaticContact CD1-CZ 3.9Å; F53-Y57 WeakPolarHBondContact O-CD2 3.27Å; F53-Y57 PolarHBondContact O-N 3.08Å; F53-T85 HydrophobicContact CE1-CG2 4.43Å; F53-T85 HydrophobicContact CZ-CG2 4.14Å; F53-I86 HydrophobicContact CE1-CG1 3.77Å; F53-I86 HydrophobicContact CZ-CG1 4.41Å; F53-A89 HydrophobicContact CE2-CB 3.45Å; F53-A89 VanDerWaalsContact CE2-CB 3.45Å; F53-A89 HydrophobicContact CZ-CB 3.48Å; F53-A89 VanDerWaalsContact CZ-CB 3.48Å
54I94.8Very high94.3Very high91 Ų9157.1 Ų57.147%0.46730%0.299SS..Hα-helixtrans-56.3-46.7176.4-65.9168.4000110.5S50 L51 Y57 I58S50-I54 WeakPolarHBondContact O-CG1 3.33Å; S50-I54 PolarHBondContact O-N 3.5Å; S50-I54 VanDerWaalsContact O-N 3.1Å; L51-I54 HydrophobicContact CD1-CB 4.42Å; L51-I54 PolarHBondContact O-N 2.97Å; I54-Y57 PolarHBondContact O-N 3.32Å; I54-I58 HydrophobicContact CG2-CD1 3.9Å; I54-I58 VanDerWaalsContact O-CG1 3.32Å; I54-I58 WeakPolarHBondContact O-CG1 3.49Å; I54-I58 PolarHBondContact O-N 3.05Å
55L95.3Very high94.2Very high42 Ų4261.7 Ų61.722%0.2232%0.323CS..Hα-helixtrans-67.5-38.4-179.9-70.1178.6000113I2 L51 I52 F53 H59 K176I2-L55 HydrophobicContact CD1-CD1 3.69Å; I2-L55 HydrophobicContact CG1-CD1 4.34Å; L51-L55 HydrophobicContact CD1-CG 4.28Å; L51-L55 HydrophobicContact CG-CD1 4.36Å; L51-L55 HydrophobicContact CG-CG 4.48Å; L51-L55 WeakPolarHBondContact O-CB 3.49Å; L51-L55 VanDerWaalsContact O-CG 3.29Å; L51-L55 WeakPolarHBondContact O-CG 3.32Å; L51-L55 PolarHBondContact O-N 3.23Å; I52-L55 PolarHBondContact O-N 3.35Å; F53-L55 VanDerWaalsContact C-N 3.29Å; F53-L55 PolarHBondContact O-N 3.22Å; L55-H59 VanDerWaalsContact O-CB 3.32Å; L55-H59 WeakPolarHBondContact O-CB 3.47Å; L55-H59 PolarHBondContact O-N 2.92Å; L55-K176 HydrophobicContact CD1-CD 4.48Å; L55-K176 HydrophobicContact CD2-CD 3.9Å; L55-K176 HydrophobicContact CD2-CG 4.49Å
56I96.5Very high93.9Very high31 Ų3160.9 Ų60.916%0.15932%0.32CS..Hα-helixtrans-65.2-43.1175.1-70.6173.4000109.9I52 F53 I58 H59 M60 L82 T85I52-I56 HydrophobicContact CG2-CD1 3.59Å; I52-I56 HydrophobicContact CG2-CG1 4.24Å; I52-I56 WeakPolarHBondContact O-CB 3.38Å; I52-I56 VanDerWaalsContact O-CG1 3.32Å; I52-I56 WeakPolarHBondContact O-CG1 3.35Å; I52-I56 PolarHBondContact O-N 2.96Å; F53-I56 PolarHBondContact O-N 3.49Å; I56-I58 PolarHBondContact O-N 2.92Å; I56-H59 CarbonylContact O-C 3.6Å; I56-H59 WeakPolarHBondContact O-CA 2.99Å; I56-H59 WeakPolarHBondContact O-CB 3.18Å; I56-H59 PolarHBondContact O-N 3.38Å; I56-H59 VanDerWaalsContact O-N 3.13Å; I56-M60 HydrophobicContact CG2-CG 4.25Å; I56-M60 VanDerWaalsContact O-CG 3.32Å; I56-M60 WeakPolarHBondContact O-CG 3.43Å; I56-M60 PolarHBondContact O-N 3.45Å; I56-L82 HydrophobicContact CG2-CB 4.48Å; I56-L82 HydrophobicContact CG2-CD1 3.59Å; I56-T85 HydrophobicContact CD1-CG2 3.75Å
57Y96.5Very high93.7Very high130 Ų13057.4 Ų57.451%0.5130%0.304SS..Hα-helixtrans-64.1-42.8177.8-62.9-33.2000112.6F53 I54 H59 M60 A61 L82F53-Y57 HydrophobicContact CB-CD2 4.48Å; F53-Y57 HydrophobicContact CB-CE2 4Å; F53-Y57 HydrophobicContact CD1-CE1 4.45Å; F53-Y57 HydrophobicContact CD1-CE2 4.36Å; F53-Y57 AromaticContact CD1-CZ 3.9Å; F53-Y57 WeakPolarHBondContact O-CD2 3.27Å; F53-Y57 PolarHBondContact O-N 3.08Å; I54-Y57 PolarHBondContact O-N 3.32Å; Y57-H59 VanDerWaalsContact C-N 3.27Å; Y57-H59 PolarHBondContact O-N 2.83Å; Y57-M60 PolarHBondContact O-N 3.11Å; Y57-A61 WeakPolarHBondContact O-CB 3.44Å; Y57-A61 PolarHBondContact O-N 3.18Å; Y57-L82 HydrophobicContact CE1-CD1 4.37Å
58I95.5Very high93.4Very high105 Ų10556.9 Ų56.954%0.53830%0.303SS..Hα-helixtrans-60.8-39.9172.7-67.2167.5000110.6I54 I56 K62I54-I58 HydrophobicContact CG2-CD1 3.9Å; I54-I58 VanDerWaalsContact O-CG1 3.32Å; I54-I58 WeakPolarHBondContact O-CG1 3.49Å; I54-I58 PolarHBondContact O-N 3.05Å; I56-I58 PolarHBondContact O-N 2.92Å; I58-K62 WeakPolarHBondContact O-CB 3.48Å; I58-K62 PolarHBondContact O-N 2.89Å
59H94.5Very high93.2Very high105 Ų10561.5 Ų61.549%0.48632%0.321SS..Hα-helixtrans-63.4-45.2176.9-173.288000111.9L55 I56 Y57 K62 A63L55-H59 VanDerWaalsContact O-CB 3.32Å; L55-H59 WeakPolarHBondContact O-CB 3.47Å; L55-H59 PolarHBondContact O-N 2.92Å; I56-H59 CarbonylContact O-C 3.6Å; I56-H59 WeakPolarHBondContact O-CA 2.99Å; I56-H59 WeakPolarHBondContact O-CB 3.18Å; I56-H59 PolarHBondContact O-N 3.38Å; I56-H59 VanDerWaalsContact O-N 3.13Å; Y57-H59 VanDerWaalsContact C-N 3.27Å; Y57-H59 PolarHBondContact O-N 2.83Å; H59-K62 PolarHBondContact O-N 3.09Å; H59-A63 WeakPolarHBondContact O-CB 3.49Å; H59-A63 PolarHBondContact O-N 3.08Å
60M95.6Very high92.8Very high30 Ų3068.3 Ų68.315%0.14834%0.339CS..Hα-helixtrans-64-45.5177-68.8-59.1-74.200111.6I56 Y57 K62 A63 L64 W75 N79 L82I56-M60 HydrophobicContact CG2-CG 4.25Å; I56-M60 VanDerWaalsContact O-CG 3.32Å; I56-M60 WeakPolarHBondContact O-CG 3.43Å; I56-M60 PolarHBondContact O-N 3.45Å; Y57-M60 PolarHBondContact O-N 3.11Å; M60-K62 PolarHBondContact O-N 2.78Å; M60-A63 PolarHBondContact O-N 3.44Å; M60-A63 VanDerWaalsContact O-N 3.14Å; M60-L64 WeakPolarHBondContact O-CG 3.1Å; M60-L64 PolarHBondContact O-N 2.93Å; M60-W75 HydrophobicContact CE-CH2 3.3Å; M60-W75 HydrophobicContact CE-CZ2 3.83Å; M60-W75 HydrophobicContact CE-CZ3 3.77Å; M60-W75 HydrophobicContact SD-CH2 4.29Å; M60-W75 HydrophobicContact SD-CZ3 4.21Å; M60-N79 VanDerWaalsContact CE-OD1 3.28Å; M60-N79 WeakPolarHBondContact CE-OD1 3.43Å; M60-L82 HydrophobicContact CE-CD2 4.26Å
61A95.1Very high92.7Very high48 Ų4867 Ų6740%0.39733%0.327SS..Hα-helixtrans-58.1-47.7176.400000111.4Y57 A63 L64 L65Y57-A61 WeakPolarHBondContact O-CB 3.44Å; Y57-A61 PolarHBondContact O-N 3.18Å; A61-A63 VanDerWaalsContact C-N 3.32Å; A61-A63 PolarHBondContact O-N 3.35Å; A61-L64 PolarHBondContact O-N 3.07Å; A61-L65 VanDerWaalsContact O-CG 3.29Å; A61-L65 WeakPolarHBondContact O-CG 3.24Å; A61-L65 PolarHBondContact O-N 2.66Å
62K92Very high92.6Very high96 Ų9671 Ų7142%0.41735%0.347SS..Hα-helixtrans-60.5-40.9175.4179.2-176.3171.7-172.30112.4I58 H59 M60 L64 L65 N66I58-K62 WeakPolarHBondContact O-CB 3.48Å; I58-K62 PolarHBondContact O-N 2.89Å; H59-K62 PolarHBondContact O-N 3.09Å; M60-K62 PolarHBondContact O-N 2.78Å; K62-L64 VanDerWaalsContact C-N 3.34Å; K62-L65 PolarHBondContact O-N 3.2Å; K62-N66 WeakPolarHBondContact O-CB 3.39Å; K62-N66 PolarHBondContact O-N 3.43Å
63A91.8Very high92.4Very high12 Ų1273 Ų7310%0.09936%0.361CS..Hα-helixtrans-65.3-38.6179.200000111.7H59 M60 A61 C67 S68 W75H59-A63 WeakPolarHBondContact O-CB 3.49Å; H59-A63 PolarHBondContact O-N 3.08Å; M60-A63 PolarHBondContact O-N 3.44Å; M60-A63 VanDerWaalsContact O-N 3.14Å; A61-A63 VanDerWaalsContact C-N 3.32Å; A61-A63 PolarHBondContact O-N 3.35Å; A63-C67 PolarHBondContact O-N 2.87Å; A63-S68 VanDerWaalsContact O-CB 3.31Å; A63-S68 WeakPolarHBondContact O-CB 3.37Å; A63-S68 PolarHBondContact O-N 3.16Å; A63-S68 PolarHBondContact O-OG 2.77Å; A63-W75 HydrophobicContact CB-CE3 4.47Å; A63-W75 HydrophobicContact CB-CZ3 3.77Å
64L92.2Very high92.3Very high91 Ų9172 Ų7248%0.47636%0.356SS..Hα-helixtrans-65.9-48.9173.7-69.1171.8000111.8M60 A61 K62 N66 C67 Y69 W75M60-L64 WeakPolarHBondContact O-CG 3.1Å; M60-L64 PolarHBondContact O-N 2.93Å; A61-L64 PolarHBondContact O-N 3.07Å; K62-L64 VanDerWaalsContact C-N 3.34Å; L64-N66 VanDerWaalsContact C-N 3.27Å; L64-N66 PolarHBondContact O-N 3.41Å; L64-C67 PolarHBondContact O-N 3.14Å; L64-Y69 HydrophobicContact CD2-CD1 4.08Å; L64-W75 HydrophobicContact CD2-CH2 3.62Å; L64-W75 HydrophobicContact CD2-CZ2 4Å; L64-W75 HydrophobicContact CD2-CZ3 4.49Å; L64-W75 HydrophobicContact CG-CH2 3.98Å
65L92.3Very high92.2Very high143 Ų14370.6 Ų70.675%0.74935%0.345SS*.Hα-helixtrans-58.7-38.1179-70.4171.6000112.3A61 K62 C67A61-L65 VanDerWaalsContact O-CG 3.29Å; A61-L65 WeakPolarHBondContact O-CG 3.24Å; A61-L65 PolarHBondContact O-N 2.66Å; K62-L65 PolarHBondContact O-N 3.2Å; L65-C67 VanDerWaalsContact C-N 3.27Å; L65-C67 PolarHBondContact O-N 2.69Å
66N88.6Confident92.2Very high22 Ų2273.1 Ų73.112%0.11836%0.358CS..THydrogen-bonded Turntrans-87.713.6178.9-64.4-11.5000113.5K62 L64 S68K62-N66 WeakPolarHBondContact O-CB 3.39Å; K62-N66 PolarHBondContact O-N 3.43Å; L64-N66 VanDerWaalsContact C-N 3.27Å; L64-N66 PolarHBondContact O-N 3.41Å; N66-S68 PolarHBondContact O-N 3.42Å
67C88.9Confident92.3Very high38 Ų3872.2 Ų72.226%0.25735%0.354SS..THydrogen-bonded Turntrans49.432.3-175.4-67.70000114.3A63 L64 L65 Y69 R70A63-C67 PolarHBondContact O-N 2.87Å; L64-C67 PolarHBondContact O-N 3.14Å; L65-C67 VanDerWaalsContact C-N 3.27Å; L65-C67 PolarHBondContact O-N 2.69Å; C67-Y69 HydrophobicContact CB-CE1 4.18Å; C67-Y69 PolarHBondContact O-N 2.88Å; C67-R70 WeakPolarHBondContact O-CG 3.36Å; C67-R70 PolarHBondContact O-N 3.41Å
68S87.1Confident92.3Very high20 Ų2066.7 Ų66.714%0.1434%0.336CS..G310 helixtrans-71.7-15.7-173-58.40000112.9A63 N66 R70 L71 S147A63-S68 VanDerWaalsContact O-CB 3.31Å; A63-S68 WeakPolarHBondContact O-CB 3.37Å; A63-S68 PolarHBondContact O-N 3.16Å; A63-S68 PolarHBondContact O-OG 2.77Å; N66-S68 PolarHBondContact O-N 3.42Å; S68-R70 PolarHBondContact O-N 3.17Å; S68-L71 PolarHBondContact O-N 2.98Å; S68-S147 PolarHBondContact OG-OG 3.18Å
69Y88.6Confident92.4Very high98 Ų9863.6 Ų63.638%0.38432%0.321SS..G310 helixtrans-62-18.4173.959.5-99.7000113.6L64 C67 L71L64-Y69 HydrophobicContact CD2-CD1 4.08Å; C67-Y69 HydrophobicContact CB-CE1 4.18Å; C67-Y69 PolarHBondContact O-N 2.88Å; Y69-L71 PolarHBondContact O-N 3.4Å
70R87.4Confident92.5Very high178 Ų17862.3 Ų62.367%0.67232%0.317SS*.G310 helixtrans-59.5-26.6174.9-68.4-179.9179.2-152.60.6112.8C67 S68 I72C67-R70 WeakPolarHBondContact O-CG 3.36Å; C67-R70 PolarHBondContact O-N 3.41Å; S68-R70 PolarHBondContact O-N 3.17Å; R70-I72 PolarHBondContact O-N 3.48Å
71L89.4Confident92.6Very high38 Ų3862.2 Ų62.220%0.19932%0.316CS..SBendtrans-91.785.6172-78.2166000109.8S68 Y69 T73 R74 W75 N144 H153S68-L71 PolarHBondContact O-N 2.98Å; Y69-L71 PolarHBondContact O-N 3.4Å; L71-T73 VanDerWaalsContact C-N 3.32Å; L71-T73 PolarHBondContact O-N 2.9Å; L71-R74 HydrophobicContact CB-CB 4.45Å; L71-R74 HydrophobicContact CB-CG 4.49Å; L71-R74 WeakPolarHBondContact O-CB 3.42Å; L71-R74 PolarHBondContact O-N 3.3Å; L71-R74 VanDerWaalsContact O-N 3.08Å; L71-W75 PolarHBondContact O-N 3.49Å; L71-N144 HydrophobicContact CD1-CB 3.77Å; L71-N144 HydrophobicContact CD2-CB 4.12Å; L71-H153 WeakPolarHBondContact CD1-CE1 3.29Å; L71-H153 WeakPolarHBondContact CD1-NE2 3.27Å
72I91.4Very high92.7Very high114 Ų11461.3 Ų61.359%0.58531%0.305SS*.Hα-helixtrans-53.3-44.3-169.2-64.2166.3000112.1R70 R74 W75 L76R70-I72 PolarHBondContact O-N 3.48Å; I72-R74 PolarHBondContact O-N 3.43Å; I72-W75 PolarHBondContact O-N 2.95Å; I72-L76 HydrophobicContact CG2-CD1 3.6Å; I72-L76 HydrophobicContact CG2-CG 4.02Å; I72-L76 WeakPolarHBondContact O-CB 3.47Å; I72-L76 VanDerWaalsContact O-CG 3.27Å; I72-L76 WeakPolarHBondContact O-CG 3.27Å; I72-L76 PolarHBondContact O-N 3.19Å
73T92.2Very high93Very high64 Ų6462.2 Ų62.239%0.39331%0.314SS..Hα-helixtrans-63.4-39.5-179.353.20000113L71 T77L71-T73 VanDerWaalsContact C-N 3.32Å; L71-T73 PolarHBondContact O-N 2.9Å; T73-T77 WeakPolarHBondContact O-CG2 3.38Å; T73-T77 PolarHBondContact O-N 3.07Å; T73-T77 PolarHBondContact O-OG1 3.16Å
74R91.5Very high93.2Very high17 Ų1763.3 Ų63.36%0.06432%0.318CS..Hα-helixtrans-68.9-43.1174.2-65.2-169.1-53.9170.12.9111.4L71 I72 T77 G78 H137 F140 G145L71-R74 HydrophobicContact CB-CB 4.45Å; L71-R74 HydrophobicContact CB-CG 4.49Å; L71-R74 WeakPolarHBondContact O-CB 3.42Å; L71-R74 PolarHBondContact O-N 3.3Å; L71-R74 VanDerWaalsContact O-N 3.08Å; I72-R74 PolarHBondContact O-N 3.43Å; R74-T77 PolarHBondContact O-OG1 2.96Å; R74-G78 PolarHBondContact O-N 3.45Å; R74-H137 PolarHBondContact O-CE1 3.31Å; R74-H137 PolarHBondContact O-ND1 2.98Å; R74-H137 VanDerWaalsContact O-ND1 3.1Å; R74-F140 WeakPolarHBondContact CD-O 3.5Å; R74-F140 HydrophobicContact CG-CB 3.54Å; R74-G145 PolarHBondContact NH1-O 3.16Å
75W93.8Very high93.4Very high60 Ų6059.5 Ų59.523%0.22730%0.298CS..Hα-helixtrans-63.8-46.1179.8-175-114.5000112M60 A63 L64 L71 I72 G78 N79M60-W75 HydrophobicContact CE-CH2 3.3Å; M60-W75 HydrophobicContact CE-CZ2 3.83Å; M60-W75 HydrophobicContact CE-CZ3 3.77Å; M60-W75 HydrophobicContact SD-CH2 4.29Å; M60-W75 HydrophobicContact SD-CZ3 4.21Å; A63-W75 HydrophobicContact CB-CE3 4.47Å; A63-W75 HydrophobicContact CB-CZ3 3.77Å; L64-W75 HydrophobicContact CD2-CH2 3.62Å; L64-W75 HydrophobicContact CD2-CZ2 4Å; L64-W75 HydrophobicContact CD2-CZ3 4.49Å; L64-W75 HydrophobicContact CG-CH2 3.98Å; L71-W75 PolarHBondContact O-N 3.49Å; I72-W75 PolarHBondContact O-N 2.95Å; W75-G78 PolarHBondContact O-N 3.12Å; W75-N79 VanDerWaalsContact CD1-ND2 3.26Å; W75-N79 PolarHBondContact NE1-ND2 2.86Å; W75-N79 PolarHBondContact O-N 2.96Å; W75-N79 PolarHBondContact O-ND2 3.41Å
76L96.2Very high93.5Very high95 Ų9556 Ų5650%0.49728%0.28SS..Hα-helixtrans-60.6-47.8178.2-74.6173.6000111.8I72 G78 N79 I80I72-L76 HydrophobicContact CG2-CD1 3.6Å; I72-L76 HydrophobicContact CG2-CG 4.02Å; I72-L76 WeakPolarHBondContact O-CB 3.47Å; I72-L76 VanDerWaalsContact O-CG 3.27Å; I72-L76 WeakPolarHBondContact O-CG 3.27Å; I72-L76 PolarHBondContact O-N 3.19Å; L76-G78 VanDerWaalsContact C-N 3.29Å; L76-G78 PolarHBondContact O-N 2.95Å; L76-N79 PolarHBondContact O-N 3.18Å; L76-I80 VanDerWaalsContact O-CG1 3.3Å; L76-I80 WeakPolarHBondContact O-CG1 3.25Å; L76-I80 PolarHBondContact O-N 2.95Å
77T97.1Very high93.7Very high13 Ų1357.9 Ų57.98%0.0829%0.289CS..Hα-helixtrans-61.8-37.4176.346.90000112.3T73 R74 I80 I81 I136 H137 F140T73-T77 WeakPolarHBondContact O-CG2 3.38Å; T73-T77 PolarHBondContact O-N 3.07Å; T73-T77 PolarHBondContact O-OG1 3.16Å; R74-T77 PolarHBondContact O-OG1 2.96Å; T77-I80 PolarHBondContact O-N 3.37Å; T77-I81 WeakPolarHBondContact O-CG1 3.38Å; T77-I81 PolarHBondContact O-N 2.87Å; T77-I81 VanDerWaalsContact O-N 3.07Å; T77-I136 HydrophobicContact CG2-CG2 4.12Å; T77-H137 PolarHBondContact OG1-ND1 2.85Å; T77-F140 HydrophobicContact CG2-CD2 3.79Å; T77-F140 HydrophobicContact CG2-CE2 3.65Å
78G96.5Very high93.9Very high13 Ų1357 Ų5713%0.13428%0.283CS..Hα-helixtrans-63-43.7173.500000113R74 W75 L76 I80 I81 L82 H137R74-G78 PolarHBondContact O-N 3.45Å; W75-G78 PolarHBondContact O-N 3.12Å; L76-G78 VanDerWaalsContact C-N 3.29Å; L76-G78 PolarHBondContact O-N 2.95Å; G78-I80 PolarHBondContact O-N 3.25Å; G78-I81 PolarHBondContact O-N 3.17Å; G78-L82 PolarHBondContact O-N 2.87Å; G78-H137 PolarHBondContact N-ND1 3.23Å
79N97.2Very high94Very high40 Ų4057.6 Ų57.621%0.21429%0.289CS..Hα-helixtrans-64.6-38.7175.8-71.1-39.2000112.2M60 W75 L76 I81 L82 L83M60-N79 VanDerWaalsContact CE-OD1 3.28Å; M60-N79 WeakPolarHBondContact CE-OD1 3.43Å; W75-N79 VanDerWaalsContact CD1-ND2 3.26Å; W75-N79 PolarHBondContact NE1-ND2 2.86Å; W75-N79 PolarHBondContact O-N 2.96Å; W75-N79 PolarHBondContact O-ND2 3.41Å; L76-N79 PolarHBondContact O-N 3.18Å; N79-I81 VanDerWaalsContact C-N 3.33Å; N79-I81 PolarHBondContact O-N 2.85Å; N79-L82 WeakPolarHBondContact O-CB 3.22Å; N79-L82 PolarHBondContact O-N 3.32Å; N79-L83 WeakPolarHBondContact O-CG 3.34Å; N79-L83 PolarHBondContact O-N 3.27Å
80I98Very high93.8Very high78 Ų7854.6 Ų54.640%0.428%0.278SS..Hα-helixtrans-62.3-42.7175.3-66.1164.1000110.4L76 T77 G78 L82 L83 L84 I133L76-I80 VanDerWaalsContact O-CG1 3.3Å; L76-I80 WeakPolarHBondContact O-CG1 3.25Å; L76-I80 PolarHBondContact O-N 2.95Å; T77-I80 PolarHBondContact O-N 3.37Å; G78-I80 PolarHBondContact O-N 3.25Å; I80-L82 PolarHBondContact O-N 3Å; I80-L83 PolarHBondContact O-N 3.18Å; I80-L84 HydrophobicContact CG2-CD1 4.14Å; I80-L84 HydrophobicContact CG2-CG 4.37Å; I80-L84 WeakPolarHBondContact O-CB 3.5Å; I80-L84 WeakPolarHBondContact O-CG 3.39Å; I80-L84 PolarHBondContact O-N 3.41Å; I80-I133 HydrophobicContact CG2-CD1 3.53Å; I80-I133 HydrophobicContact CG2-CG2 4.27Å
81I98Very high93.7Very high28 Ų2847.1 Ų47.114%0.14425%0.251CS..Hα-helixtrans-60.4-45.1174.9-67.9164.3000111T77 G78 N79 L84 T85 I130 I133 A134 H137T77-I81 WeakPolarHBondContact O-CG1 3.38Å; T77-I81 PolarHBondContact O-N 2.87Å; T77-I81 VanDerWaalsContact O-N 3.07Å; G78-I81 PolarHBondContact O-N 3.17Å; N79-I81 VanDerWaalsContact C-N 3.33Å; N79-I81 PolarHBondContact O-N 2.85Å; I81-L84 PolarHBondContact O-N 3Å; I81-T85 WeakPolarHBondContact O-CB 3.33Å; I81-T85 PolarHBondContact O-N 3.44Å; I81-T85 PolarHBondContact O-OG1 3.41Å; I81-I130 HydrophobicContact CG2-CG2 4.16Å; I81-I133 HydrophobicContact CD1-CG2 4.16Å; I81-I133 HydrophobicContact CG1-CB 4.19Å; I81-I133 HydrophobicContact CG1-CG2 3.68Å; I81-A134 HydrophobicContact CD1-CB 4.25Å; I81-H137 HydrophobicContact CD1-CB 3.78Å
82L97.1Very high93.2Very high30 Ų3048.6 Ų48.616%0.15727%0.269CS..Hα-helixtrans-58.4-50.1176.3170.964.6000111.2I56 Y57 M60 G78 N79 I80 L84 T85 I86I56-L82 HydrophobicContact CG2-CB 4.48Å; I56-L82 HydrophobicContact CG2-CD1 3.59Å; Y57-L82 HydrophobicContact CE1-CD1 4.37Å; M60-L82 HydrophobicContact CE-CD2 4.26Å; G78-L82 PolarHBondContact O-N 2.87Å; N79-L82 WeakPolarHBondContact O-CB 3.22Å; N79-L82 PolarHBondContact O-N 3.32Å; I80-L82 PolarHBondContact O-N 3Å; L82-L84 PolarHBondContact O-N 3.34Å; L82-T85 PolarHBondContact O-N 3.23Å; L82-I86 HydrophobicContact CD1-CD1 3.88Å; L82-I86 HydrophobicContact CD1-CG1 4.23Å; L82-I86 HydrophobicContact CG-CD1 3.96Å; L82-I86 WeakPolarHBondContact O-CG1 3.45Å; L82-I86 PolarHBondContact O-N 3.1Å
83L97.1Very high92.2Very high115 Ų11545 Ų4560%0.60226%0.256SS*.Hα-helixtrans-62.5-43.5-179-71.5172000112.2N79 I80 T85 I86 L87N79-L83 WeakPolarHBondContact O-CG 3.34Å; N79-L83 PolarHBondContact O-N 3.27Å; I80-L83 PolarHBondContact O-N 3.18Å; L83-T85 VanDerWaalsContact C-N 3.32Å; L83-T85 PolarHBondContact O-N 3.04Å; L83-I86 PolarHBondContact O-N 3.02Å; L83-L87 WeakPolarHBondContact O-CB 3.4Å; L83-L87 PolarHBondContact O-N 3.07Å
84L97.3Very high90.8Very high34 Ų3447.1 Ų47.118%0.17827%0.269CS..Hα-helixtrans-65-37.3175.2-71.2179.5000112.1I80 I81 L82 L87 V88 I126 V129 I130 I133I80-L84 HydrophobicContact CG2-CD1 4.14Å; I80-L84 HydrophobicContact CG2-CG 4.37Å; I80-L84 WeakPolarHBondContact O-CB 3.5Å; I80-L84 WeakPolarHBondContact O-CG 3.39Å; I80-L84 PolarHBondContact O-N 3.41Å; I81-L84 PolarHBondContact O-N 3Å; L82-L84 PolarHBondContact O-N 3.34Å; L84-L87 HydrophobicContact CD2-CD2 4.47Å; L84-L87 WeakPolarHBondContact O-CB 3.28Å; L84-L87 PolarHBondContact O-N 3.41Å; L84-V88 WeakPolarHBondContact O-CG2 3.48Å; L84-V88 PolarHBondContact O-N 2.8Å; L84-I126 HydrophobicContact CB-CG2 4.1Å; L84-I126 HydrophobicContact CD2-CG2 4.09Å; L84-V129 HydrophobicContact CD1-CG1 4.11Å; L84-I130 HydrophobicContact CB-CD1 3.93Å; L84-I130 HydrophobicContact CB-CG1 3.66Å; L84-I130 HydrophobicContact CD1-CG1 4.06Å; L84-I133 HydrophobicContact CD1-CD1 3.5Å
85T96.4Very high89.1Confident12 Ų1251.4 Ų51.47%0.07430%0.297CS..Hα-helixtrans-66.8-40.3177.3-53.70000111.3I52 F53 I56 I81 L82 L83 V88 A89I52-T85 HydrophobicContact CG2-CG2 3.82Å; F53-T85 HydrophobicContact CE1-CG2 4.43Å; F53-T85 HydrophobicContact CZ-CG2 4.14Å; I56-T85 HydrophobicContact CD1-CG2 3.75Å; I81-T85 WeakPolarHBondContact O-CB 3.33Å; I81-T85 PolarHBondContact O-N 3.44Å; I81-T85 PolarHBondContact O-OG1 3.41Å; L82-T85 PolarHBondContact O-N 3.23Å; L83-T85 VanDerWaalsContact C-N 3.32Å; L83-T85 PolarHBondContact O-N 3.04Å; T85-V88 PolarHBondContact O-N 3.08Å; T85-A89 PolarHBondContact O-N 2.83Å; T85-A89 VanDerWaalsContact O-N 3.13Å
86I94.2Very high87.5Confident70 Ų7052.1 Ų52.136%0.35930%0.304SS..Hα-helixtrans-60.1-46.3170.8-67.3164.8000110.2F53 L82 L83 V88 A89 F90F53-I86 HydrophobicContact CE1-CG1 3.77Å; F53-I86 HydrophobicContact CZ-CG1 4.41Å; L82-I86 HydrophobicContact CD1-CD1 3.88Å; L82-I86 HydrophobicContact CD1-CG1 4.23Å; L82-I86 HydrophobicContact CG-CD1 3.96Å; L82-I86 WeakPolarHBondContact O-CG1 3.45Å; L82-I86 PolarHBondContact O-N 3.1Å; L83-I86 PolarHBondContact O-N 3.02Å; I86-V88 PolarHBondContact O-N 3.25Å; I86-A89 PolarHBondContact O-N 3.43Å; I86-F90 WeakPolarHBondContact O-CB 3.3Å; I86-F90 PolarHBondContact O-N 2.95Å
87L91.9Very high85.8Confident60 Ų6048.1 Ų48.131%0.31428%0.284SS..Hα-helixtrans-60.3-42.7-179.8-177.261.4000112.4L83 L84 F90 M91 I126L83-L87 WeakPolarHBondContact O-CB 3.4Å; L83-L87 PolarHBondContact O-N 3.07Å; L84-L87 HydrophobicContact CD2-CD2 4.47Å; L84-L87 WeakPolarHBondContact O-CB 3.28Å; L84-L87 PolarHBondContact O-N 3.41Å; L87-F90 WeakPolarHBondContact O-CB 3.41Å; L87-F90 PolarHBondContact O-N 3.25Å; L87-M91 HydrophobicContact CD1-CE 3.85Å; L87-M91 HydrophobicContact CD2-CE 4.28Å; L87-M91 HydrophobicContact CG-CE 3.87Å; L87-M91 WeakPolarHBondContact O-CG 3.5Å; L87-M91 PolarHBondContact O-N 2.91Å; L87-M91 VanDerWaalsContact O-N 3.07Å; L87-I126 HydrophobicContact CD2-CD1 3.79Å; L87-I126 HydrophobicContact CG-CD1 4.07Å
88V93.6Very high84.3Confident20 Ų2050.1 Ų50.112%0.12130%0.298CS..Hα-helixtrans-60.8-48.8175.4171.40000111L84 T85 I86 F90 M91 H123 I126 P127 I130L84-V88 WeakPolarHBondContact O-CG2 3.48Å; L84-V88 PolarHBondContact O-N 2.8Å; T85-V88 PolarHBondContact O-N 3.08Å; I86-V88 PolarHBondContact O-N 3.25Å; V88-F90 VanDerWaalsContact C-N 3.31Å; V88-F90 PolarHBondContact O-N 3.32Å; V88-M91 PolarHBondContact O-N 3.47Å; V88-H123 WeakPolarHBondContact CG1-ND1 3.38Å; V88-H123 PolarHBondContact O-CE1 3.07Å; V88-H123 PolarHBondContact O-ND1 2.81Å; V88-I126 HydrophobicContact CG2-CB 3.58Å; V88-I126 HydrophobicContact CG2-CD1 4.5Å; V88-I126 HydrophobicContact CG2-CG2 3.34Å; V88-P127 HydrophobicContact CG1-CG 4.19Å; V88-P127 HydrophobicContact CG2-CG 4.21Å; V88-I130 HydrophobicContact CG2-CD1 4.13Å
89A89.8Confident82.9Confident33 Ų3356.8 Ų56.827%0.27332%0.324SS..Hα-helixtrans-65.5-37.7-179.900000112.1F53 T85 I86 M91 A92 A93F53-A89 HydrophobicContact CE2-CB 3.45Å; F53-A89 VanDerWaalsContact CE2-CB 3.45Å; F53-A89 HydrophobicContact CZ-CB 3.48Å; F53-A89 VanDerWaalsContact CZ-CB 3.48Å; T85-A89 PolarHBondContact O-N 2.83Å; T85-A89 VanDerWaalsContact O-N 3.13Å; I86-A89 PolarHBondContact O-N 3.43Å; A89-M91 VanDerWaalsContact C-N 3.34Å; A89-M91 PolarHBondContact O-N 3.48Å; A89-A92 WeakPolarHBondContact O-CB 3.5Å; A89-A92 PolarHBondContact O-N 2.97Å; A89-A92 VanDerWaalsContact O-N 3.08Å; A89-A93 PolarHBondContact O-N 3.45Å
90F84.4Confident81.4Confident35 Ų3557 Ų5715%0.15432%0.324CS..Hα-helixtrans-58.6-44.9175.6176.5-77.1000111.7I86 L87 V88 A92 A93 I96 T97 L100I86-F90 WeakPolarHBondContact O-CB 3.3Å; I86-F90 PolarHBondContact O-N 2.95Å; L87-F90 WeakPolarHBondContact O-CB 3.41Å; L87-F90 PolarHBondContact O-N 3.25Å; V88-F90 VanDerWaalsContact C-N 3.31Å; V88-F90 PolarHBondContact O-N 3.32Å; F90-A92 PolarHBondContact O-N 2.92Å; F90-A92 VanDerWaalsContact O-N 3.09Å; F90-A93 PolarHBondContact O-N 3.01Å; F90-I96 HydrophobicContact CD2-CB 3.82Å; F90-I96 HydrophobicContact CD2-CD1 4.29Å; F90-I96 HydrophobicContact CD2-CG2 3.75Å; F90-I96 HydrophobicContact CE2-CB 3.41Å; F90-I96 VanDerWaalsContact CE2-CB 3.41Å; F90-I96 HydrophobicContact CE2-CG2 2.99Å; F90-I96 VanDerWaalsContact CZ-C 3.45Å; F90-I96 HydrophobicContact CZ-CB 3.76Å; F90-I96 HydrophobicContact CZ-CG2 3.55Å; F90-I96 WeakPolarHBondContact CZ-O 3.46Å; F90-T97 WeakPolarHBondContact O-CG2 3.42Å; F90-L100 HydrophobicContact CD1-CD2 4.42Å; F90-L100 HydrophobicContact CE1-CB 3.79Å; F90-L100 HydrophobicContact CE1-CD1 3.52Å; F90-L100 HydrophobicContact CE1-CD2 3.77Å; F90-L100 HydrophobicContact CE1-CG 3.86Å; F90-L100 HydrophobicContact CE2-CD1 4.09Å; F90-L100 HydrophobicContact CZ-CB 3.99Å; F90-L100 HydrophobicContact CZ-CD1 3.25Å; F90-L100 HydrophobicContact CZ-CD2 4.39Å; F90-L100 HydrophobicContact CZ-CG 4.03Å
91M85.5Confident79.7Confident20 Ų2053.3 Ų53.310%0.09931%0.306CS..Hα-helixtrans-62.1-17.3178.2-72.7175.218000113.2L87 V88 A89 F119 F122 H123 I126L87-M91 HydrophobicContact CD1-CE 3.85Å; L87-M91 HydrophobicContact CD2-CE 4.28Å; L87-M91 HydrophobicContact CG-CE 3.87Å; L87-M91 WeakPolarHBondContact O-CG 3.5Å; L87-M91 PolarHBondContact O-N 2.91Å; L87-M91 VanDerWaalsContact O-N 3.07Å; V88-M91 PolarHBondContact O-N 3.47Å; A89-M91 VanDerWaalsContact C-N 3.34Å; A89-M91 PolarHBondContact O-N 3.48Å; M91-F119 HydrophobicContact CB-CB 4.19Å; M91-F119 HydrophobicContact CG-CB 4.37Å; M91-F119 HydrophobicContact CG-CD1 4.07Å; M91-F119 HydrophobicContact CG-CG 4.34Å; M91-F122 HydrophobicContact CE-CB 3.64Å; M91-F122 HydrophobicContact CE-CG 4.35Å; M91-F122 HydrophobicContact SD-CB 3.49Å; M91-F122 WeakPolarHBondContact SD-CB 3.42Å; M91-H123 HydrophobicContact CB-CB 4.25Å; M91-I126 HydrophobicContact CE-CD1 3.76Å; M91-I126 HydrophobicContact SD-CD1 3.93Å
92A79Confident78.3Confident70 Ų7054.1 Ų54.158%0.57932%0.317SS*.THydrogen-bonded Turntrans-92.6-9.3176.200000114.1A89 F90A89-A92 WeakPolarHBondContact O-CB 3.5Å; A89-A92 PolarHBondContact O-N 2.97Å; A89-A92 VanDerWaalsContact O-N 3.08Å; F90-A92 PolarHBondContact O-N 2.92Å; F90-A92 VanDerWaalsContact O-N 3.09Å
93A70.5Confident77.1Confident37 Ų3756.2 Ų56.231%0.30633%0.327SS..  trans-101.8112.8-174.200000112.5A89 F90 V95 I96 T97A89-A93 PolarHBondContact O-N 3.45Å; F90-A93 PolarHBondContact O-N 3.01Å; A93-V95 PolarHBondContact O-N 3.33Å; A93-I96 HydrophobicContact CB-CG1 4.37Å; A93-I96 PolarHBondContact O-N 3.28Å; A93-T97 VanDerWaalsContact O-CG2 3.27Å; A93-T97 WeakPolarHBondContact O-CG2 3.45Å; A93-T97 PolarHBondContact O-N 3Å; A93-T97 PolarHBondContact O-OG1 2.88Å
94T62.9Low75.7Confident110 Ų11055.8 Ų55.868%0.67533%0.332SS*.Hα-helixtrans-55-44.4-174.348.50000114I96 T97 S98T94-I96 PolarHBondContact O-N 3.22Å; T94-T97 WeakPolarHBondContact CA-OG1 3.38Å; T94-T97 PolarHBondContact O-OG1 2.85Å; T94-S98 PolarHBondContact O-N 3.37Å
95V55.6Low74.4Confident107 Ų10759.7 Ų59.765%0.64835%0.351SS*.Hα-helixtrans-62.4-43.6-178.6177.70000111.5A93 S98A93-V95 PolarHBondContact O-N 3.33Å; V95-S98 WeakPolarHBondContact O-CB 3.38Å; V95-S98 PolarHBondContact O-OG 2.59Å
96I59.4Low73.1Confident74 Ų7460.6 Ų60.638%0.37935%0.354SS..Hα-helixtrans-87-28.2-173.7-24.6179.7000112.3F90 A93 T94 S98 F99 L100F90-I96 HydrophobicContact CD2-CB 3.82Å; F90-I96 HydrophobicContact CD2-CD1 4.29Å; F90-I96 HydrophobicContact CD2-CG2 3.75Å; F90-I96 HydrophobicContact CE2-CB 3.41Å; F90-I96 VanDerWaalsContact CE2-CB 3.41Å; F90-I96 HydrophobicContact CE2-CG2 2.99Å; F90-I96 VanDerWaalsContact CZ-C 3.45Å; F90-I96 HydrophobicContact CZ-CB 3.76Å; F90-I96 HydrophobicContact CZ-CG2 3.55Å; F90-I96 WeakPolarHBondContact CZ-O 3.46Å; A93-I96 HydrophobicContact CB-CG1 4.37Å; A93-I96 PolarHBondContact O-N 3.28Å; T94-I96 PolarHBondContact O-N 3.22Å; I96-S98 PolarHBondContact O-N 3.22Å; I96-S98 VanDerWaalsContact O-N 3.11Å; I96-F99 HydrophobicContact CG2-CD2 3.96Å; I96-F99 WeakPolarHBondContact O-CB 3.49Å; I96-F99 PolarHBondContact O-N 3.3Å; I96-L100 PolarHBondContact O-N 3.34Å
97T60.8Low71.4Confident11 Ų1157.9 Ų57.97%0.06734%0.344CS..Hα-helixtrans-55.5-28.1168.356.70000112.8F90 A93 T94 L100 S101 F119F90-T97 WeakPolarHBondContact O-CG2 3.42Å; A93-T97 VanDerWaalsContact O-CG2 3.27Å; A93-T97 WeakPolarHBondContact O-CG2 3.45Å; A93-T97 PolarHBondContact O-N 3Å; A93-T97 PolarHBondContact O-OG1 2.88Å; T94-T97 WeakPolarHBondContact CA-OG1 3.38Å; T94-T97 PolarHBondContact O-OG1 2.85Å; T97-L100 PolarHBondContact O-N 3.48Å; T97-S101 WeakPolarHBondContact O-CB 3.21Å; T97-S101 PolarHBondContact O-N 3.28Å; T97-F119 HydrophobicContact CG2-CD2 3.56Å; T97-F119 HydrophobicContact CG2-CE2 3.68Å; T97-F119 HydrophobicContact CG2-CG 4.49Å
98S64.5Low70Confident55 Ų5556 Ų5639%0.38534%0.339SS..Hα-helixtrans-63.6-37.7172.980.30000113T94 V95 I96 S101T94-S98 PolarHBondContact O-N 3.37Å; V95-S98 WeakPolarHBondContact O-CB 3.38Å; V95-S98 PolarHBondContact O-OG 2.59Å; I96-S98 PolarHBondContact O-N 3.22Å; I96-S98 VanDerWaalsContact O-N 3.11Å; S98-S101 WeakPolarHBondContact CA-OG 3.49Å; S98-S101 PolarHBondContact O-N 2.98Å; S98-S101 PolarHBondContact O-OG 3.23Å
99F67.9Low68.7Low153 Ų15363.8 Ų63.867%0.67137%0.371SS*.Hα-helixtrans-65.8-45.9174.9-80.1-72.6000111.7I96 S101 A102I96-F99 HydrophobicContact CG2-CD2 3.96Å; I96-F99 WeakPolarHBondContact O-CB 3.49Å; I96-F99 PolarHBondContact O-N 3.3Å; F99-S101 VanDerWaalsContact C-N 3.29Å; F99-S101 PolarHBondContact O-N 3.43Å; F99-A102 WeakPolarHBondContact O-CB 3.48Å; F99-A102 PolarHBondContact O-N 3Å
100L65.8Low67.6Low44 Ų4471.5 Ų71.523%0.2339%0.393CS..Hα-helixtrans-66.1-35.6177.5-115.276.7000111F90 I96 T97 A102 I103 F106 F119F90-L100 HydrophobicContact CD1-CD2 4.42Å; F90-L100 HydrophobicContact CE1-CB 3.79Å; F90-L100 HydrophobicContact CE1-CD1 3.52Å; F90-L100 HydrophobicContact CE1-CD2 3.77Å; F90-L100 HydrophobicContact CE1-CG 3.86Å; F90-L100 HydrophobicContact CE2-CD1 4.09Å; F90-L100 HydrophobicContact CZ-CB 3.99Å; F90-L100 HydrophobicContact CZ-CD1 3.25Å; F90-L100 HydrophobicContact CZ-CD2 4.39Å; F90-L100 HydrophobicContact CZ-CG 4.03Å; I96-L100 PolarHBondContact O-N 3.34Å; T97-L100 PolarHBondContact O-N 3.48Å; L100-A102 PolarHBondContact O-N 3.49Å; L100-A102 VanDerWaalsContact O-N 3.07Å; L100-I103 HydrophobicContact CG-CD1 4.46Å; L100-I103 WeakPolarHBondContact O-CB 3.44Å; L100-I103 PolarHBondContact O-N 3.5Å; L100-F106 HydrophobicContact CB-CD2 4.42Å; L100-F106 HydrophobicContact CD2-CD2 4.47Å; L100-F106 HydrophobicContact CD2-CE2 3.9Å; L100-F106 HydrophobicContact CD2-CZ 4.33Å; L100-F106 HydrophobicContact CG-CD2 4.47Å; L100-F106 HydrophobicContact CG-CE2 4.08Å; L100-F106 VanDerWaalsContact O-CD2 3.27Å; L100-F106 WeakPolarHBondContact O-CD2 3.08Å; L100-F119 HydrophobicContact CB-CZ 3.88Å; L100-F119 HydrophobicContact CD2-CE1 4.16Å; L100-F119 HydrophobicContact CD2-CZ 4.35Å
101S62.3Low66.8Low2 Ų272.9 Ų72.91%0.01440%0.402CS..Hα-helixtrans-58.2-24.3178.8750000113.5T97 S98 F99 I103 G108T97-S101 WeakPolarHBondContact O-CB 3.21Å; T97-S101 PolarHBondContact O-N 3.28Å; S98-S101 WeakPolarHBondContact CA-OG 3.49Å; S98-S101 PolarHBondContact O-N 2.98Å; S98-S101 PolarHBondContact O-OG 3.23Å; F99-S101 VanDerWaalsContact C-N 3.29Å; F99-S101 PolarHBondContact O-N 3.43Å; S101-I103 PolarHBondContact O-N 2.9Å; S101-I103 VanDerWaalsContact O-N 3.14Å; S101-G108 CarbonylContact C-O 3.54Å; S101-G108 CarbonylContact O-C 3.14Å
102A69.3Low66.3Low44 Ų4479.2 Ų79.236%0.36442%0.424SS..THydrogen-bonded Turntrans-60.7-21.5173.700000113.5F99 L100 F109F99-A102 WeakPolarHBondContact O-CB 3.48Å; F99-A102 PolarHBondContact O-N 3Å; L100-A102 PolarHBondContact O-N 3.49Å; L100-A102 VanDerWaalsContact O-N 3.07Å; A102-F109 HydrophobicContact CB-CD1 4.41Å
103I71.1Confident66.4Low75 Ų7582.1 Ų82.139%0.38542%0.421SS..SBendtrans-76.9124.2175.7-59167.1000108.9L100 S101 I105 F106L100-I103 HydrophobicContact CG-CD1 4.46Å; L100-I103 WeakPolarHBondContact O-CB 3.44Å; L100-I103 PolarHBondContact O-N 3.5Å; S101-I103 PolarHBondContact O-N 2.9Å; S101-I103 VanDerWaalsContact O-N 3.14Å; I103-I105 HydrophobicContact CG2-CB 4.24Å; I103-I105 HydrophobicContact CG2-CD1 4.29Å; I103-I105 HydrophobicContact CG2-CG1 4.24Å; I103-I105 PolarHBondContact O-N 2.87Å; I103-F106 HydrophobicContact CB-CD2 3.82Å; I103-F106 HydrophobicContact CB-CE2 3.98Å; I103-F106 HydrophobicContact CD1-CD2 4.48Å; I103-F106 HydrophobicContact CD1-CE2 3.94Å; I103-F106 HydrophobicContact CG2-CD2 4.26Å; I103-F106 HydrophobicContact CG2-CE2 4.16Å; I103-F106 PolarHBondContact O-N 3.49Å
104P67.6Low66.9Low106 Ų10688.2 Ų88.269%0.68844%0.436SS*.G310 helixtrans-54-32.5-171.8-27.132.6000114.6F106 G107P104-F106 PolarHBondContact O-N 3.4Å; P104-F106 VanDerWaalsContact O-N 3.14Å; P104-G107 PolarHBondContact O-N 3.44Å
105I69.7Low67.8Low115 Ų11583 Ų8359%0.5940%0.403SS*.G310 helixtrans-55.3-32.8-179.6-58.9172.8000111.6I103I103-I105 HydrophobicContact CG2-CB 4.24Å; I103-I105 HydrophobicContact CG2-CD1 4.29Å; I103-I105 HydrophobicContact CG2-CG1 4.24Å; I103-I105 PolarHBondContact O-N 2.87Å
106F69Low69.1Low31 Ų3179.9 Ų79.914%0.13638%0.383CS..G310 helixtrans-93.83.5-174-53.6-51.9000114.5L100 I103 P104 T115 F118 F119L100-F106 HydrophobicContact CB-CD2 4.42Å; L100-F106 HydrophobicContact CD2-CD2 4.47Å; L100-F106 HydrophobicContact CD2-CE2 3.9Å; L100-F106 HydrophobicContact CD2-CZ 4.33Å; L100-F106 HydrophobicContact CG-CD2 4.47Å; L100-F106 HydrophobicContact CG-CE2 4.08Å; L100-F106 VanDerWaalsContact O-CD2 3.27Å; L100-F106 WeakPolarHBondContact O-CD2 3.08Å; I103-F106 HydrophobicContact CB-CD2 3.82Å; I103-F106 HydrophobicContact CB-CE2 3.98Å; I103-F106 HydrophobicContact CD1-CD2 4.48Å; I103-F106 HydrophobicContact CD1-CE2 3.94Å; I103-F106 HydrophobicContact CG2-CD2 4.26Å; I103-F106 HydrophobicContact CG2-CE2 4.16Å; I103-F106 PolarHBondContact O-N 3.49Å; P104-F106 PolarHBondContact O-N 3.4Å; P104-F106 VanDerWaalsContact O-N 3.14Å; F106-T115 HydrophobicContact CB-CG2 4.37Å; F106-T115 WeakPolarHBondContact O-CA 3.34Å; F106-T115 WeakPolarHBondContact O-CB 3.15Å; F106-T115 PolarHBondContact O-N 2.88Å; F106-T115 PolarHBondContact O-OG1 2.95Å; F106-F118 AromaticContact CD1-CD1 3.56Å; F106-F118 HydrophobicContact CD1-CD1 3.56Å; F106-F118 HydrophobicContact CD1-CD2 4.41Å; F106-F118 AromaticContact CD1-CE1 3.33Å; F106-F118 HydrophobicContact CD1-CE1 3.33Å; F106-F118 HydrophobicContact CD1-CE2 4.19Å; F106-F118 HydrophobicContact CD1-CG 4.13Å; F106-F118 AromaticContact CD1-CZ 3.68Å; F106-F118 HydrophobicContact CD1-CZ 3.68Å; F106-F118 AromaticContact CE1-CD1 3.92Å; F106-F118 HydrophobicContact CE1-CD1 3.92Å; F106-F118 AromaticContact CE1-CE1 3.18Å; F106-F118 HydrophobicContact CE1-CE1 3.18Å; F106-F118 HydrophobicContact CE1-CE2 4.19Å; F106-F118 AromaticContact CE1-CZ 3.35Å; F106-F118 HydrophobicContact CE1-CZ 3.35Å; F106-F118 HydrophobicContact CZ-CE1 4.29Å; F106-F119 HydrophobicContact CB-CZ 4.41Å; F106-F119 HydrophobicContact CD1-CE1 4.3Å; F106-F119 HydrophobicContact CG-CE1 4.2Å; F106-F119 HydrophobicContact CG-CZ 4.42Å
107G58.5Low70.3Confident14 Ų1479.9 Ų79.914%0.14438%0.381CS..THydrogen-bonded Turntrans117.88.1175.100000116.1P104P104-G107 PolarHBondContact O-N 3.44Å
108G63.1Low71.6Confident20 Ų2082.1 Ų82.121%0.20639%0.39CS..SBendtrans86.9178.3174.800000114S101 R110S101-G108 CarbonylContact C-O 3.54Å; S101-G108 CarbonylContact O-C 3.14Å; G108-R110 PolarHBondContact O-N 2.94Å; G108-R110 VanDerWaalsContact O-O 3.13Å
109F66.7Low72.7Confident183 Ų18379.8 Ų79.880%0.80337%0.373SS*.SBendtrans-55.3-0.8-168.3-61-78000118.3A102A102-F109 HydrophobicContact CB-CD1 4.41Å
110R66.7Low73.8Confident196 Ų19674.9 Ų74.974%0.7435%0.352SS*.SBendtrans-131.2143174.7-64.3-173.7-179.5-171.4-0109.1G108 R112G108-R110 PolarHBondContact O-N 2.94Å; G108-R110 VanDerWaalsContact O-O 3.13Å; R110-R112 PolarHBondContact O-N 3.35Å
111I67.6Low75Confident64 Ų6476.1 Ų76.133%0.32836%0.361SS..  trans-63.1102.2174.3-58.6173.2000107.9T115I111-T115 HydrophobicContact CG2-CG2 4.47Å
112R74.9Confident76.4Confident152 Ų15279.6 Ų79.657%0.57438%0.376SS*.  trans-102.1169.7176.7-73.9179.5174-179-1.4110.1E21 R110 R114 T115 L116E21-R112 WeakPolarHBondContact OE2-CA 3.31Å; R110-R112 PolarHBondContact O-N 3.35Å; R112-R114 PolarHBondContact O-N 3.24Å; R112-R114 VanDerWaalsContact O-N 3.08Å; R112-T115 PolarHBondContact N-OG1 3.48Å; R112-T115 WeakPolarHBondContact O-CB 3.42Å; R112-T115 PolarHBondContact O-N 3.29Å; R112-L116 PolarHBondContact O-N 2.99Å; R112-L116 VanDerWaalsContact O-N 3.12Å
113R79.8Confident77.6Confident132 Ų13279.7 Ų79.750%0.49837%0.369SS..Hα-helixtrans-43.5-43.7170.2-178.9179.6176-177.4-0.3113.5E21 T115 L116 Q117E21-R113 HydrophobicContact CB-CB 4.45Å; E21-R113 PolarHBondContact OE2-N 3.25Å; R113-T115 PolarHBondContact O-N 2.95Å; R113-L116 PolarHBondContact O-N 2.88Å; R113-Q117 HydrophobicContact CG-CG 4.32Å; R113-Q117 WeakPolarHBondContact O-CB 3.02Å; R113-Q117 WeakPolarHBondContact O-CG 2.84Å; R113-Q117 PolarHBondContact O-N 3.21Å
114R81Confident78.6Confident165 Ų16580.2 Ų80.262%0.62337%0.367SS*.Hα-helixtrans-60.1-44.3178.9-175.5177.8-179.5172.31.2112R112 F118R112-R114 PolarHBondContact O-N 3.24Å; R112-R114 VanDerWaalsContact O-N 3.08Å; R114-F118 VanDerWaalsContact O-CB 3.25Å; R114-F118 WeakPolarHBondContact O-CB 3.42Å; R114-F118 PolarHBondContact O-N 3.36Å
115T82.5Confident80Confident0 Ų079.2 Ų79.20%036%0.355CS..Hα-helixtrans-61.8-47.2178.2-43.30000111.1F106 I111 R112 R113 F118 F119F106-T115 HydrophobicContact CB-CG2 4.37Å; F106-T115 WeakPolarHBondContact O-CA 3.34Å; F106-T115 WeakPolarHBondContact O-CB 3.15Å; F106-T115 PolarHBondContact O-N 2.88Å; F106-T115 PolarHBondContact O-OG1 2.95Å; I111-T115 HydrophobicContact CG2-CG2 4.47Å; R112-T115 PolarHBondContact N-OG1 3.48Å; R112-T115 WeakPolarHBondContact O-CB 3.42Å; R112-T115 PolarHBondContact O-N 3.29Å; R113-T115 PolarHBondContact O-N 2.95Å; T115-F118 PolarHBondContact O-N 3.19Å; T115-F119 HydrophobicContact CG2-CD2 3.96Å; T115-F119 HydrophobicContact CG2-CE2 3.4Å; T115-F119 HydrophobicContact CG2-CZ 3.78Å; T115-F119 PolarHBondContact O-N 3.44Å
116L82.5Confident81.3Confident41 Ų4174.4 Ų74.422%0.21533%0.33CS..Hα-helixtrans-67.5-42-177.8-169.467.5000112.1P19 R20 A24 R112 R113 F120P19-L116 HydrophobicContact CB-CD2 4.29Å; P19-L116 HydrophobicContact CB-CG 4.06Å; R20-L116 WeakPolarHBondContact O-CD2 3.32Å; A24-L116 HydrophobicContact CB-CD2 3.97Å; R112-L116 PolarHBondContact O-N 2.99Å; R112-L116 VanDerWaalsContact O-N 3.12Å; R113-L116 PolarHBondContact O-N 2.88Å; L116-F120 VanDerWaalsContact O-CB 3.23Å; L116-F120 WeakPolarHBondContact O-CB 3.45Å; L116-F120 PolarHBondContact O-N 3.32Å
117Q86.1Confident82.6Confident75 Ų7573.8 Ų73.835%0.3533%0.33SS..Hα-helixtrans-62.4-44.4174.3-73.8-178.9-34.700111.1P19 R113 F120 T121P19-Q117 HydrophobicContact CB-CG 4.38Å; P19-Q117 HydrophobicContact CG-CG 4.18Å; P19-Q117 WeakPolarHBondContact O-CG 3.39Å; R113-Q117 HydrophobicContact CG-CG 4.32Å; R113-Q117 WeakPolarHBondContact O-CB 3.02Å; R113-Q117 WeakPolarHBondContact O-CG 2.84Å; R113-Q117 PolarHBondContact O-N 3.21Å; Q117-F120 PolarHBondContact O-N 3.24Å; Q117-T121 WeakPolarHBondContact O-CB 3.34Å; Q117-T121 PolarHBondContact O-N 3.44Å; Q117-T121 PolarHBondContact O-OG1 3.31Å
118F86.7Confident84.4Confident57 Ų5778 Ų7825%0.2534%0.344CS..Hα-helixtrans-59.5-53.2177.7-176.3-83.6000111.6F106 R114 T115 F120 T121 F122F106-F118 AromaticContact CD1-CD1 3.56Å; F106-F118 HydrophobicContact CD1-CD1 3.56Å; F106-F118 HydrophobicContact CD1-CD2 4.41Å; F106-F118 AromaticContact CD1-CE1 3.33Å; F106-F118 HydrophobicContact CD1-CE1 3.33Å; F106-F118 HydrophobicContact CD1-CE2 4.19Å; F106-F118 HydrophobicContact CD1-CG 4.13Å; F106-F118 AromaticContact CD1-CZ 3.68Å; F106-F118 HydrophobicContact CD1-CZ 3.68Å; F106-F118 AromaticContact CE1-CD1 3.92Å; F106-F118 HydrophobicContact CE1-CD1 3.92Å; F106-F118 AromaticContact CE1-CE1 3.18Å; F106-F118 HydrophobicContact CE1-CE1 3.18Å; F106-F118 HydrophobicContact CE1-CE2 4.19Å; F106-F118 AromaticContact CE1-CZ 3.35Å; F106-F118 HydrophobicContact CE1-CZ 3.35Å; F106-F118 HydrophobicContact CZ-CE1 4.29Å; R114-F118 VanDerWaalsContact O-CB 3.25Å; R114-F118 WeakPolarHBondContact O-CB 3.42Å; R114-F118 PolarHBondContact O-N 3.36Å; T115-F118 PolarHBondContact O-N 3.19Å; F118-F120 VanDerWaalsContact C-N 3.33Å; F118-F120 PolarHBondContact O-N 2.97Å; F118-T121 PolarHBondContact O-N 3.49Å; F118-F122 AromaticContact CD1-CD2 3.81Å; F118-F122 HydrophobicContact CD1-CD2 3.81Å; F118-F122 HydrophobicContact CD1-CE2 4.28Å; F118-F122 HydrophobicContact CD2-CD2 4.08Å; F118-F122 AromaticContact CD2-CE2 3.82Å; F118-F122 HydrophobicContact CD2-CE2 3.82Å; F118-F122 AromaticContact CE1-CD2 3.39Å; F118-F122 HydrophobicContact CE1-CD2 3.39Å; F118-F122 AromaticContact CE1-CE2 3.68Å; F118-F122 HydrophobicContact CE1-CE2 3.68Å; F118-F122 HydrophobicContact CE1-CG 4.2Å; F118-F122 AromaticContact CE2-CD2 3.74Å; F118-F122 HydrophobicContact CE2-CD2 3.74Å; F118-F122 AromaticContact CE2-CE2 3.19Å; F118-F122 HydrophobicContact CE2-CE2 3.19Å; F118-F122 HydrophobicContact CE2-CZ 4.11Å; F118-F122 HydrophobicContact CG-CD2 4.11Å; F118-F122 HydrophobicContact CG-CE2 4.32Å; F118-F122 AromaticContact CZ-CD2 3.35Å; F118-F122 HydrophobicContact CZ-CD2 3.35Å; F118-F122 AromaticContact CZ-CE2 3.08Å; F118-F122 HydrophobicContact CZ-CE2 3.08Å; F118-F122 HydrophobicContact CZ-CG 4.33Å; F118-F122 AromaticContact CZ-CZ 3.86Å; F118-F122 HydrophobicContact CZ-CZ 3.86Å; F118-F122 WeakPolarHBondContact O-CD2 3.36Å; F118-F122 PolarHBondContact O-N 3.44Å
119F88.3Confident86.1Confident6 Ų680.6 Ų80.63%0.02636%0.356CS..Hα-helixtrans-63.2-38.9179.3-67.7-22.7000112.5M91 T97 L100 F106 T115 F122 H123M91-F119 HydrophobicContact CB-CB 4.19Å; M91-F119 HydrophobicContact CG-CB 4.37Å; M91-F119 HydrophobicContact CG-CD1 4.07Å; M91-F119 HydrophobicContact CG-CG 4.34Å; T97-F119 HydrophobicContact CG2-CD2 3.56Å; T97-F119 HydrophobicContact CG2-CE2 3.68Å; T97-F119 HydrophobicContact CG2-CG 4.49Å; L100-F119 HydrophobicContact CB-CZ 3.88Å; L100-F119 HydrophobicContact CD2-CE1 4.16Å; L100-F119 HydrophobicContact CD2-CZ 4.35Å; F106-F119 HydrophobicContact CB-CZ 4.41Å; F106-F119 HydrophobicContact CD1-CE1 4.3Å; F106-F119 HydrophobicContact CG-CE1 4.2Å; F106-F119 HydrophobicContact CG-CZ 4.42Å; T115-F119 HydrophobicContact CG2-CD2 3.96Å; T115-F119 HydrophobicContact CG2-CE2 3.4Å; T115-F119 HydrophobicContact CG2-CZ 3.78Å; T115-F119 PolarHBondContact O-N 3.44Å; F119-F122 PolarHBondContact O-N 3.37Å; F119-H123 WeakPolarHBondContact O-CB 3.38Å; F119-H123 PolarHBondContact O-N 3.37Å
120F90.1Very high87.5Confident51 Ų5172.3 Ų72.322%0.22432%0.32CS..Hα-helixtrans-61.7-45.4174.9178.5-104000112.2V14 Y17 P19 L116 Q117 F118 F122 H123 Y124V14-F120 HydrophobicContact CB-CZ 4.28Å; V14-F120 HydrophobicContact CG1-CZ 3.96Å; V14-F120 HydrophobicContact CG2-CE2 3.96Å; V14-F120 HydrophobicContact CG2-CZ 3.7Å; Y17-F120 AromaticContact CD1-CD2 3.78Å; Y17-F120 HydrophobicContact CD1-CD2 3.78Å; Y17-F120 AromaticContact CD1-CE2 3.42Å; Y17-F120 HydrophobicContact CD1-CE2 3.42Å; Y17-F120 VanDerWaalsContact CD1-CE2 3.42Å; Y17-F120 HydrophobicContact CD1-CZ 4.02Å; Y17-F120 AromaticContact CE1-CD2 3.72Å; Y17-F120 HydrophobicContact CE1-CD2 3.72Å; Y17-F120 AromaticContact CE1-CE2 3.89Å; Y17-F120 HydrophobicContact CE1-CE2 3.89Å; Y17-F120 HydrophobicContact CE1-CG 4.42Å; P19-F120 HydrophobicContact CB-CB 3.85Å; P19-F120 HydrophobicContact CB-CD1 4.22Å; P19-F120 HydrophobicContact CB-CG 3.99Å; P19-F120 HydrophobicContact CG-CB 4.17Å; P19-F120 HydrophobicContact CG-CD1 3.65Å; P19-F120 HydrophobicContact CG-CE1 4.16Å; P19-F120 HydrophobicContact CG-CG 3.95Å; L116-F120 VanDerWaalsContact O-CB 3.23Å; L116-F120 WeakPolarHBondContact O-CB 3.45Å; L116-F120 PolarHBondContact O-N 3.32Å; Q117-F120 PolarHBondContact O-N 3.24Å; F118-F120 VanDerWaalsContact C-N 3.33Å; F118-F120 PolarHBondContact O-N 2.97Å; F120-F122 PolarHBondContact O-N 3.02Å; F120-H123 PolarHBondContact O-N 3.26Å; F120-Y124 PolarHBondContact O-N 3.38Å
121T91.7Very high89Confident69 Ų6966 Ų6642%0.42330%0.3SS..Hα-helixtrans-60.5-46.7177.3-63.70000111.6Q117 F118 Y124 L125Q117-T121 WeakPolarHBondContact O-CB 3.34Å; Q117-T121 PolarHBondContact O-N 3.44Å; Q117-T121 PolarHBondContact O-OG1 3.31Å; F118-T121 PolarHBondContact O-N 3.49Å; T121-Y124 PolarHBondContact O-N 2.7Å; T121-L125 HydrophobicContact CG2-CD1 3.76Å; T121-L125 HydrophobicContact CG2-CG 4.47Å; T121-L125 WeakPolarHBondContact O-CB 3.39Å; T121-L125 WeakPolarHBondContact O-CG 3.27Å; T121-L125 PolarHBondContact O-N 3.49Å
122F92.2Very high90.4Very high76 Ų7664.6 Ų64.633%0.33330%0.301SS..Hα-helixtrans-73.2-34.7179.7-83-82.2000113.3M91 F118 F119 F120 Y124 L125 I126M91-F122 HydrophobicContact CE-CB 3.64Å; M91-F122 HydrophobicContact CE-CG 4.35Å; M91-F122 HydrophobicContact SD-CB 3.49Å; M91-F122 WeakPolarHBondContact SD-CB 3.42Å; F118-F122 AromaticContact CD1-CD2 3.81Å; F118-F122 HydrophobicContact CD1-CD2 3.81Å; F118-F122 HydrophobicContact CD1-CE2 4.28Å; F118-F122 HydrophobicContact CD2-CD2 4.08Å; F118-F122 AromaticContact CD2-CE2 3.82Å; F118-F122 HydrophobicContact CD2-CE2 3.82Å; F118-F122 AromaticContact CE1-CD2 3.39Å; F118-F122 HydrophobicContact CE1-CD2 3.39Å; F118-F122 AromaticContact CE1-CE2 3.68Å; F118-F122 HydrophobicContact CE1-CE2 3.68Å; F118-F122 HydrophobicContact CE1-CG 4.2Å; F118-F122 AromaticContact CE2-CD2 3.74Å; F118-F122 HydrophobicContact CE2-CD2 3.74Å; F118-F122 AromaticContact CE2-CE2 3.19Å; F118-F122 HydrophobicContact CE2-CE2 3.19Å; F118-F122 HydrophobicContact CE2-CZ 4.11Å; F118-F122 HydrophobicContact CG-CD2 4.11Å; F118-F122 HydrophobicContact CG-CE2 4.32Å; F118-F122 AromaticContact CZ-CD2 3.35Å; F118-F122 HydrophobicContact CZ-CD2 3.35Å; F118-F122 AromaticContact CZ-CE2 3.08Å; F118-F122 HydrophobicContact CZ-CE2 3.08Å; F118-F122 HydrophobicContact CZ-CG 4.33Å; F118-F122 AromaticContact CZ-CZ 3.86Å; F118-F122 HydrophobicContact CZ-CZ 3.86Å; F118-F122 WeakPolarHBondContact O-CD2 3.36Å; F118-F122 PolarHBondContact O-N 3.44Å; F119-F122 PolarHBondContact O-N 3.37Å; F120-F122 PolarHBondContact O-N 3.02Å; F122-Y124 PolarHBondContact O-N 2.93Å; F122-L125 PolarHBondContact O-N 3.47Å; F122-I126 HydrophobicContact CB-CD1 4.01Å; F122-I126 HydrophobicContact CB-CG1 4.49Å; F122-I126 HydrophobicContact CD1-CD1 4.23Å; F122-I126 HydrophobicContact CD1-CG1 4.26Å; F122-I126 WeakPolarHBondContact O-CB 3.29Å; F122-I126 VanDerWaalsContact O-CG1 3.24Å; F122-I126 WeakPolarHBondContact O-CG1 3.49Å; F122-I126 PolarHBondContact O-N 3.13Å
123H92.9Very high91.5Very high45 Ų4558.8 Ų58.821%0.20828%0.281CS..Hα-helixtrans-60.3-34.6172.4-17588000111.3V88 M91 F119 F120 P127V88-H123 WeakPolarHBondContact CG1-ND1 3.38Å; V88-H123 PolarHBondContact O-CE1 3.07Å; V88-H123 PolarHBondContact O-ND1 2.81Å; M91-H123 HydrophobicContact CB-CB 4.25Å; F119-H123 WeakPolarHBondContact O-CB 3.38Å; F119-H123 PolarHBondContact O-N 3.37Å; F120-H123 PolarHBondContact O-N 3.26Å; H123-P127 WeakPolarHBondContact O-CD 3.36Å; H123-P127 WeakPolarHBondContact O-CG 3.47Å
124Y93.8Very high92.3Very high87 Ų8753.9 Ų53.934%0.34127%0.269SS..Hα-helixtrans-75.2-40173.5-175.4-99.3000113.1L11 V14 F120 T121 F122 F128L11-Y124 HydrophobicContact CD1-CE2 4.11Å; L11-Y124 WeakPolarHBondContact CD1-OH 3.34Å; V14-Y124 HydrophobicContact CG2-CD2 4.06Å; V14-Y124 HydrophobicContact CG2-CE2 4.39Å; F120-Y124 PolarHBondContact O-N 3.38Å; T121-Y124 PolarHBondContact O-N 2.7Å; F122-Y124 PolarHBondContact O-N 2.93Å; Y124-F128 HydrophobicContact CD1-CE2 4.28Å; Y124-F128 AromaticContact CE1-CE2 3.91Å; Y124-F128 HydrophobicContact CE1-CE2 3.91Å; Y124-F128 HydrophobicContact CE2-CE2 4.43Å; Y124-F128 AromaticContact CZ-CE2 3.99Å; Y124-F128 VanDerWaalsContact O-CD2 3.24Å; Y124-F128 WeakPolarHBondContact O-CD2 3.38Å; Y124-F128 VanDerWaalsContact O-CE2 3.25Å; Y124-F128 WeakPolarHBondContact O-CE2 3.5Å
125L96.1Very high93.1Very high85 Ų8551.3 Ų51.345%0.44527%0.267SS..Hα-helixtrans-79.8-43.1-174.1-72.4172.3000114.4T121 F122 P127 F128T121-L125 HydrophobicContact CG2-CD1 3.76Å; T121-L125 HydrophobicContact CG2-CG 4.47Å; T121-L125 WeakPolarHBondContact O-CB 3.39Å; T121-L125 WeakPolarHBondContact O-CG 3.27Å; T121-L125 PolarHBondContact O-N 3.49Å; F122-L125 PolarHBondContact O-N 3.47Å; L125-P127 VanDerWaalsContact C-CD 3.47Å; L125-F128 WeakPolarHBondContact O-CB 3.44Å; L125-F128 PolarHBondContact O-N 3.48Å
126I96.5Very high93.8Very high13 Ų1355.2 Ų55.27%0.06729%0.286CS..Hα-helixtrans-59.8-36.8-174-65.5164.9000112.9L84 L87 V88 M91 F122 F128 V129 I130L84-I126 HydrophobicContact CB-CG2 4.1Å; L84-I126 HydrophobicContact CD2-CG2 4.09Å; L87-I126 HydrophobicContact CD2-CD1 3.79Å; L87-I126 HydrophobicContact CG-CD1 4.07Å; V88-I126 HydrophobicContact CG2-CB 3.58Å; V88-I126 HydrophobicContact CG2-CD1 4.5Å; V88-I126 HydrophobicContact CG2-CG2 3.34Å; M91-I126 HydrophobicContact CE-CD1 3.76Å; M91-I126 HydrophobicContact SD-CD1 3.93Å; F122-I126 HydrophobicContact CB-CD1 4.01Å; F122-I126 HydrophobicContact CB-CG1 4.49Å; F122-I126 HydrophobicContact CD1-CD1 4.23Å; F122-I126 HydrophobicContact CD1-CG1 4.26Å; F122-I126 WeakPolarHBondContact O-CB 3.29Å; F122-I126 VanDerWaalsContact O-CG1 3.24Å; F122-I126 WeakPolarHBondContact O-CG1 3.49Å; F122-I126 PolarHBondContact O-N 3.13Å; I126-F128 PolarHBondContact O-N 3.48Å; I126-V129 WeakPolarHBondContact O-CA 3.35Å; I126-V129 WeakPolarHBondContact O-CB 3.36Å; I126-V129 PolarHBondContact O-N 3.35Å; I126-I130 HydrophobicContact CG2-CD1 4.13Å; I126-I130 HydrophobicContact CG2-CG1 4.23Å; I126-I130 WeakPolarHBondContact O-CG1 3.41Å; I126-I130 PolarHBondContact O-N 3.48Å
127P96.3Very high94.5Very high19 Ų1954.7 Ų54.712%0.12328%0.283CS..Hα-helixtrans-53-35.4173.3-30.337.2000114.1F3 L7 V88 H123 L125 I130 I131F3-P127 HydrophobicContact CZ-CB 4.06Å; F3-P127 WeakPolarHBondContact CZ-O 3.27Å; L7-P127 HydrophobicContact CD2-CB 3.56Å; V88-P127 HydrophobicContact CG1-CG 4.19Å; V88-P127 HydrophobicContact CG2-CG 4.21Å; H123-P127 WeakPolarHBondContact O-CD 3.36Å; H123-P127 WeakPolarHBondContact O-CG 3.47Å; L125-P127 VanDerWaalsContact C-CD 3.47Å; P127-I130 WeakPolarHBondContact O-CB 3.24Å; P127-I130 PolarHBondContact O-N 2.93Å; P127-I131 WeakPolarHBondContact O-CG1 3.43Å; P127-I131 PolarHBondContact O-N 3.19Å
128F96.7Very high94.9Very high101 Ų10155.4 Ų55.444%0.44329%0.288SS..Hα-helixtrans-70.9-35.7175.3-61.9-80.5000112.3Y124 L125 I126 I130 I131 G132Y124-F128 HydrophobicContact CD1-CE2 4.28Å; Y124-F128 AromaticContact CE1-CE2 3.91Å; Y124-F128 HydrophobicContact CE1-CE2 3.91Å; Y124-F128 HydrophobicContact CE2-CE2 4.43Å; Y124-F128 AromaticContact CZ-CE2 3.99Å; Y124-F128 VanDerWaalsContact O-CD2 3.24Å; Y124-F128 WeakPolarHBondContact O-CD2 3.38Å; Y124-F128 VanDerWaalsContact O-CE2 3.25Å; Y124-F128 WeakPolarHBondContact O-CE2 3.5Å; L125-F128 WeakPolarHBondContact O-CB 3.44Å; L125-F128 PolarHBondContact O-N 3.48Å; I126-F128 PolarHBondContact O-N 3.48Å; F128-I130 VanDerWaalsContact C-N 3.32Å; F128-I130 PolarHBondContact O-N 2.93Å; F128-I131 HydrophobicContact CD1-CD1 4.26Å; F128-I131 WeakPolarHBondContact O-CB 3.47Å; F128-I131 PolarHBondContact O-N 2.9Å; F128-G132 PolarHBondContact O-N 3.36Å
129V97.9Very high95.3Very high76 Ų7657.3 Ų57.346%0.46130%0.301SS..Hα-helixtrans-62.9-40.8172.2-178.20000110.7L84 I126 I131 G132 I133L84-V129 HydrophobicContact CD1-CG1 4.11Å; I126-V129 WeakPolarHBondContact O-CA 3.35Å; I126-V129 WeakPolarHBondContact O-CB 3.36Å; I126-V129 PolarHBondContact O-N 3.35Å; V129-I131 VanDerWaalsContact C-N 3.27Å; V129-I131 PolarHBondContact O-N 2.91Å; V129-G132 PolarHBondContact O-N 3.47Å; V129-G132 VanDerWaalsContact O-N 3.1Å; V129-I133 HydrophobicContact CG1-CD1 4.15Å; V129-I133 HydrophobicContact CG1-CG1 4.47Å; V129-I133 WeakPolarHBondContact O-CG1 3.35Å; V129-I133 PolarHBondContact O-N 3.29Å
130I98Very high95.6Very high8 Ų859.7 Ų59.74%0.04131%0.311CS..Hα-helixtrans-58.9-38.8175.9-67.3169.5000111F3 I81 L84 V88 I126 P127 F128 I133 A134F3-I130 HydrophobicContact CE2-CB 4.29Å; F3-I130 HydrophobicContact CE2-CD1 4.37Å; F3-I130 HydrophobicContact CE2-CG2 3.78Å; F3-I130 HydrophobicContact CZ-CB 3.9Å; F3-I130 HydrophobicContact CZ-CG2 3.74Å; I81-I130 HydrophobicContact CG2-CG2 4.16Å; L84-I130 HydrophobicContact CB-CD1 3.93Å; L84-I130 HydrophobicContact CB-CG1 3.66Å; L84-I130 HydrophobicContact CD1-CG1 4.06Å; V88-I130 HydrophobicContact CG2-CD1 4.13Å; I126-I130 HydrophobicContact CG2-CD1 4.13Å; I126-I130 HydrophobicContact CG2-CG1 4.23Å; I126-I130 WeakPolarHBondContact O-CG1 3.41Å; I126-I130 PolarHBondContact O-N 3.48Å; P127-I130 WeakPolarHBondContact O-CB 3.24Å; P127-I130 PolarHBondContact O-N 2.93Å; F128-I130 VanDerWaalsContact C-N 3.32Å; F128-I130 PolarHBondContact O-N 2.93Å; I130-I133 PolarHBondContact O-N 3.45Å; I130-A134 VanDerWaalsContact O-CB 3.24Å; I130-A134 WeakPolarHBondContact O-CB 3.49Å; I130-A134 PolarHBondContact O-N 2.99Å
131I97.3Very high95.6Very high64 Ų6460.5 Ų60.533%0.32832%0.317SS..Hα-helixtrans-59.9-48.1174.4-59169.5000110.5F3 L7 P127 F128 V129 I133 A134 I135F3-I131 HydrophobicContact CD1-CG1 4.35Å; F3-I131 HydrophobicContact CE1-CD1 4.22Å; F3-I131 HydrophobicContact CE1-CG1 3.58Å; F3-I131 HydrophobicContact CZ-CG1 4.42Å; L7-I131 HydrophobicContact CD1-CD1 3.64Å; L7-I131 HydrophobicContact CD1-CG1 4.42Å; P127-I131 WeakPolarHBondContact O-CG1 3.43Å; P127-I131 PolarHBondContact O-N 3.19Å; F128-I131 HydrophobicContact CD1-CD1 4.26Å; F128-I131 WeakPolarHBondContact O-CB 3.47Å; F128-I131 PolarHBondContact O-N 2.9Å; V129-I131 VanDerWaalsContact C-N 3.27Å; V129-I131 PolarHBondContact O-N 2.91Å; I131-I133 VanDerWaalsContact C-N 3.34Å; I131-I133 PolarHBondContact O-N 3.48Å; I131-A134 WeakPolarHBondContact O-CB 3.3Å; I131-A134 PolarHBondContact O-N 3.25Å; I131-I135 HydrophobicContact CG2-CD1 4.2Å; I131-I135 WeakPolarHBondContact O-CG1 3.34Å; I131-I135 PolarHBondContact O-N 2.92Å
132G97.6Very high95.4Very high34 Ų3464 Ų6435%0.35133%0.329SS..Hα-helixtrans-57.6-46.2179.100000112.3F128 V129 I135 I136F128-G132 PolarHBondContact O-N 3.36Å; V129-G132 PolarHBondContact O-N 3.47Å; V129-G132 VanDerWaalsContact O-N 3.1Å; G132-I135 PolarHBondContact O-N 3.48Å; G132-I136 WeakPolarHBondContact O-CG1 3.38Å; G132-I136 PolarHBondContact O-N 3Å
133I97.9Very high95.3Very high30 Ų3066.1 Ų66.115%0.15434%0.343CS..Hα-helixtrans-70.4-33.8178.3-57.3-178.1000111.5I80 I81 L84 V129 I130 I131 I135 I136 H137I80-I133 HydrophobicContact CG2-CD1 3.53Å; I80-I133 HydrophobicContact CG2-CG2 4.27Å; I81-I133 HydrophobicContact CD1-CG2 4.16Å; I81-I133 HydrophobicContact CG1-CB 4.19Å; I81-I133 HydrophobicContact CG1-CG2 3.68Å; L84-I133 HydrophobicContact CD1-CD1 3.5Å; V129-I133 HydrophobicContact CG1-CD1 4.15Å; V129-I133 HydrophobicContact CG1-CG1 4.47Å; V129-I133 WeakPolarHBondContact O-CG1 3.35Å; V129-I133 PolarHBondContact O-N 3.29Å; I130-I133 PolarHBondContact O-N 3.45Å; I131-I133 VanDerWaalsContact C-N 3.34Å; I131-I133 PolarHBondContact O-N 3.48Å; I133-I135 VanDerWaalsContact C-N 3.31Å; I133-I135 PolarHBondContact O-N 3.45Å; I133-I136 PolarHBondContact O-N 3.31Å; I133-H137 WeakPolarHBondContact O-CB 3.47Å; I133-H137 PolarHBondContact O-N 3.37Å
134A97Very high94.8Very high30 Ų3067 Ų6725%0.24835%0.349CS..Hα-helixtrans-62.5-37.4174.300000112.1I81 I130 I131 H137 I138I81-A134 HydrophobicContact CD1-CB 4.25Å; I130-A134 VanDerWaalsContact O-CB 3.24Å; I130-A134 WeakPolarHBondContact O-CB 3.49Å; I130-A134 PolarHBondContact O-N 2.99Å; I131-A134 WeakPolarHBondContact O-CB 3.3Å; I131-A134 PolarHBondContact O-N 3.25Å; A134-H137 PolarHBondContact O-N 3.22Å; A134-I138 VanDerWaalsContact O-CG1 3.27Å; A134-I138 WeakPolarHBondContact O-CG1 3.16Å; A134-I138 PolarHBondContact O-N 3.37Å
135I97.5Very high94.1Very high111 Ų11164.2 Ų64.257%0.56935%0.347SS*.Hα-helixtrans-62.8-46.3173.2-66165.7000110.3I131 G132 I133 H137 I138 L139I131-I135 HydrophobicContact CG2-CD1 4.2Å; I131-I135 WeakPolarHBondContact O-CG1 3.34Å; I131-I135 PolarHBondContact O-N 2.92Å; G132-I135 PolarHBondContact O-N 3.48Å; I133-I135 VanDerWaalsContact C-N 3.31Å; I133-I135 PolarHBondContact O-N 3.45Å; I135-H137 VanDerWaalsContact C-N 3.33Å; I135-H137 PolarHBondContact O-N 2.86Å; I135-I138 PolarHBondContact O-N 2.92Å; I135-L139 WeakPolarHBondContact O-CB 3.46Å; I135-L139 PolarHBondContact O-N 3.41Å
136I97.5Very high93.2Very high81 Ų8166.1 Ų66.142%0.41535%0.348SS..Hα-helixtrans-61.9-41.5176.5-62.3169.3000111T77 G132 I133 I138 L139 F140T77-I136 HydrophobicContact CG2-CG2 4.12Å; G132-I136 WeakPolarHBondContact O-CG1 3.38Å; G132-I136 PolarHBondContact O-N 3Å; I133-I136 PolarHBondContact O-N 3.31Å; I136-I138 PolarHBondContact O-N 3.37Å; I136-L139 WeakPolarHBondContact O-CB 3.34Å; I136-L139 PolarHBondContact O-N 3.08Å; I136-F140 HydrophobicContact CG2-CD2 4.04Å; I136-F140 HydrophobicContact CG2-CE2 3.6Å; I136-F140 HydrophobicContact CG2-CZ 4.16Å; I136-F140 WeakPolarHBondContact O-CD2 3.46Å; I136-F140 PolarHBondContact O-N 3.16Å
137H95.6Very high92.4Very high31 Ų3166.1 Ų66.114%0.14435%0.349CS..Hα-helixtrans-61.3-44177.2-175.974.1000111.8R74 T77 G78 I81 I133 A134 I135 F140 L141R74-H137 PolarHBondContact O-CE1 3.31Å; R74-H137 PolarHBondContact O-ND1 2.98Å; R74-H137 VanDerWaalsContact O-ND1 3.1Å; T77-H137 PolarHBondContact OG1-ND1 2.85Å; G78-H137 PolarHBondContact N-ND1 3.23Å; I81-H137 HydrophobicContact CD1-CB 3.78Å; I133-H137 WeakPolarHBondContact O-CB 3.47Å; I133-H137 PolarHBondContact O-N 3.37Å; A134-H137 PolarHBondContact O-N 3.22Å; I135-H137 VanDerWaalsContact C-N 3.33Å; I135-H137 PolarHBondContact O-N 2.86Å; H137-F140 PolarHBondContact O-N 3Å; H137-L141 PolarHBondContact O-N 3.04Å; H137-L141 VanDerWaalsContact O-N 3.16Å
138I95.2Very high91.6Very high90 Ų9066.7 Ų66.746%0.46235%0.351SS..Hα-helixtrans-65.5-40.1175.1-69165.2000110.8A134 I135 I136 F140 L141 H142A134-I138 VanDerWaalsContact O-CG1 3.27Å; A134-I138 WeakPolarHBondContact O-CG1 3.16Å; A134-I138 PolarHBondContact O-N 3.37Å; I135-I138 PolarHBondContact O-N 2.92Å; I136-I138 PolarHBondContact O-N 3.37Å; I138-F140 PolarHBondContact O-N 3.46Å; I138-L141 WeakPolarHBondContact O-CA 3.36Å; I138-L141 VanDerWaalsContact O-CB 3.28Å; I138-L141 WeakPolarHBondContact O-CB 3.45Å; I138-L141 PolarHBondContact O-N 3.42Å; I138-H142 PolarHBondContact O-CD2 3.1Å; I138-H142 VanDerWaalsContact O-CD2 3.26Å; I138-H142 PolarHBondContact O-N 3.26Å
139L96.1Very high90.7Very high97 Ų9767 Ų6751%0.50836%0.363SS..Hα-helixtrans-57.8-47.7176.1-179.466.4000111.4I135 I136 L141 H142 L143I135-L139 WeakPolarHBondContact O-CB 3.46Å; I135-L139 PolarHBondContact O-N 3.41Å; I136-L139 WeakPolarHBondContact O-CB 3.34Å; I136-L139 PolarHBondContact O-N 3.08Å; L139-L141 PolarHBondContact O-N 3.39Å; L139-H142 PolarHBondContact O-N 3.01Å; L139-H142 VanDerWaalsContact O-N 3.1Å; L139-L143 HydrophobicContact CG-CD1 4.36Å; L139-L143 WeakPolarHBondContact O-CG 3.25Å; L139-L143 PolarHBondContact O-N 2.96Å
140F93Very high89.6Confident55 Ų5570.6 Ų70.624%0.24138%0.379CS..Hα-helixtrans-64.1-27.7175.6-68.8-43.7000113R74 T77 I136 H137 I138 L143 N144R74-F140 WeakPolarHBondContact CD-O 3.5Å; R74-F140 HydrophobicContact CG-CB 3.54Å; T77-F140 HydrophobicContact CG2-CD2 3.79Å; T77-F140 HydrophobicContact CG2-CE2 3.65Å; I136-F140 HydrophobicContact CG2-CD2 4.04Å; I136-F140 HydrophobicContact CG2-CE2 3.6Å; I136-F140 HydrophobicContact CG2-CZ 4.16Å; I136-F140 WeakPolarHBondContact O-CD2 3.46Å; I136-F140 PolarHBondContact O-N 3.16Å; H137-F140 PolarHBondContact O-N 3Å; I138-F140 PolarHBondContact O-N 3.46Å; F140-L143 HydrophobicContact CD1-CD1 4.15Å; F140-N144 PolarHBondContact O-N 3.03Å; F140-N144 PolarHBondContact O-ND2 3.38Å
141L89.9Confident88.1Confident68 Ų6871.6 Ų71.636%0.35639%0.391SS..Hα-helixtrans-68.9-38.6172.7-168.9149.3000111.9H137 I138 L139 G145H137-L141 PolarHBondContact O-N 3.04Å; H137-L141 VanDerWaalsContact O-N 3.16Å; I138-L141 WeakPolarHBondContact O-CA 3.36Å; I138-L141 VanDerWaalsContact O-CB 3.28Å; I138-L141 WeakPolarHBondContact O-CB 3.45Å; I138-L141 PolarHBondContact O-N 3.42Å; L139-L141 PolarHBondContact O-N 3.39Å; L141-G145 CarbonylContact O-C 3.57Å; L141-G145 VanDerWaalsContact O-CA 3.31Å; L141-G145 WeakPolarHBondContact O-CA 3.49Å; L141-G145 PolarHBondContact O-N 3.02Å
142H89.6Confident86.4Confident143 Ų14371 Ų7166%0.66239%0.392SS*.Hα-helixtrans-66.9-42174-79.6-76.4000112.4I138 L139I138-H142 PolarHBondContact O-CD2 3.1Å; I138-H142 VanDerWaalsContact O-CD2 3.26Å; I138-H142 PolarHBondContact O-N 3.26Å; L139-H142 PolarHBondContact O-N 3.01Å; L139-H142 VanDerWaalsContact O-N 3.1Å
143L89Confident84.8Confident120 Ų12073.6 Ų73.663%0.62840%0.396SS*.Hα-helixtrans-64.8-44.8-179.2-68.1173000112.5L139 F140L139-L143 HydrophobicContact CG-CD1 4.36Å; L139-L143 WeakPolarHBondContact O-CG 3.25Å; L139-L143 PolarHBondContact O-N 2.96Å; F140-L143 HydrophobicContact CD1-CD1 4.15Å
144N81.8Confident83Confident65 Ų6574.4 Ų74.435%0.34840%0.404SS..Hα-helixtrans-96.3-6.1-174.3-62.1-45.2000114.2L71 F140 H153L71-N144 HydrophobicContact CD1-CB 3.77Å; L71-N144 HydrophobicContact CD2-CB 4.12Å; F140-N144 PolarHBondContact O-N 3.03Å; F140-N144 PolarHBondContact O-ND2 3.38Å; N144-H153 PolarHBondContact O-ND1 3.28Å
145G79.8Confident81.5Confident28 Ų2877.5 Ų77.529%0.28942%0.421SS..  trans67.3167.5-173.400000113.9R74 L141R74-G145 PolarHBondContact NH1-O 3.16Å; L141-G145 CarbonylContact O-C 3.57Å; L141-G145 VanDerWaalsContact O-CA 3.31Å; L141-G145 WeakPolarHBondContact O-CA 3.49Å; L141-G145 PolarHBondContact O-N 3.02Å
146R76.7Confident80Confident124 Ų12479.9 Ų79.947%0.46844%0.435SS..PPolyproline II helixtrans-80.4143.9-178.2-170.4-175.6162.5179.3-6.1111.6
147S79.6Confident78.8Confident14 Ų1482.8 Ų82.810%0.09845%0.449CS..PPolyproline II helixtrans-77.5140.2166.441.20000111.3S68S68-S147 PolarHBondContact OG-OG 3.18Å
148N79.1Confident78.1Confident30 Ų3089.5 Ų89.516%0.1648%0.478CS..PPolyproline II helixtrans-91.9169173.369.414.7000110.9L150 G151 S152 S154N148-L150 PolarHBondContact O-N 3.02Å; N148-L150 WeakPolarHBondContact OD1-CA 3.14Å; N148-L150 WeakPolarHBondContact OD1-CB 3.35Å; N148-L150 PolarHBondContact OD1-N 3.45Å; N148-L150 VanDerWaalsContact OD1-N 3.08Å; N148-G151 PolarHBondContact O-N 2.87Å; N148-G151 PolarHBondContact OD1-N 3.23Å; N148-G151 VanDerWaalsContact OD1-N 3.11Å; N148-S152 PolarHBondContact ND2-O 3.27Å; N148-S152 VanDerWaalsContact ND2-O 3.17Å; N148-S152 PolarHBondContact ND2-OG 3.44Å; N148-S152 PolarHBondContact OD1-N 3.28Å; N148-S152 PolarHBondContact OD1-O 2.99Å; N148-S152 PolarHBondContact OD1-OG 3.19Å; N148-S154 PolarHBondContact ND2-OG 3.1Å
149P79.2Confident77.7Confident107 Ų10789.8 Ų89.870%0.69548%0.48SS*.THydrogen-bonded Turntrans-59.8-21.6176.3-23.834.8000114.3G151P149-G151 PolarHBondContact O-N 2.94Å
150L74.5Confident77.3Confident153 Ų15393.4 Ų93.480%0.80149%0.491SS*.THydrogen-bonded Turntrans-79.42.6175.5-60.5171000112.6N148 S152N148-L150 PolarHBondContact O-N 3.02Å; N148-L150 WeakPolarHBondContact OD1-CA 3.14Å; N148-L150 WeakPolarHBondContact OD1-CB 3.35Å; N148-L150 PolarHBondContact OD1-N 3.45Å; N148-L150 VanDerWaalsContact OD1-N 3.08Å; L150-S152 PolarHBondContact O-N 3.35Å; L150-S152 VanDerWaalsContact O-N 3.11Å
151G66.2Low77.2Confident28 Ų2896.6 Ų96.629%0.28951%0.505SS..SBendtrans67.47.3-177.900000114.2N148 P149N148-G151 PolarHBondContact O-N 2.87Å; N148-G151 PolarHBondContact OD1-N 3.23Å; N148-G151 VanDerWaalsContact OD1-N 3.11Å; P149-G151 PolarHBondContact O-N 2.94Å
152S62.8Low77.3Confident51 Ų51101.4 Ų101.436%0.35752%0.52SS..  trans-99.6139.1-179.670.10000111.5N148 L150 S154N148-S152 PolarHBondContact ND2-O 3.27Å; N148-S152 VanDerWaalsContact ND2-O 3.17Å; N148-S152 PolarHBondContact ND2-OG 3.44Å; N148-S152 PolarHBondContact OD1-N 3.28Å; N148-S152 PolarHBondContact OD1-O 2.99Å; N148-S152 PolarHBondContact OD1-OG 3.19Å; L150-S152 PolarHBondContact O-N 3.35Å; L150-S152 VanDerWaalsContact O-N 3.11Å; S152-S154 PolarHBondContact O-N 3.41Å
153H63.6Low77.5Confident90 Ų9097.3 Ų97.342%0.41751%0.506SS..  trans-76.199.4160.9-71.2-83.5000106.2L71 N144 P155L71-H153 WeakPolarHBondContact CD1-CE1 3.29Å; L71-H153 WeakPolarHBondContact CD1-NE2 3.27Å; N144-H153 PolarHBondContact O-ND1 3.28Å; H153-P155 WeakPolarHBondContact O-CD 3.43Å
154S60.4Low77.7Confident47 Ų4797.6 Ų97.633%0.32950%0.502SS..  trans-9596.9179.634.80000109.5N148 S152 L156N148-S154 PolarHBondContact ND2-OG 3.1Å; S152-S154 PolarHBondContact O-N 3.41Å; S154-L156 PolarHBondContact O-N 2.9Å
155P65.3Low78.2Confident95 Ų9597 Ų9762%0.61750%0.497SS*.THydrogen-bonded Turntrans-67.5-20.5170.127.7-34.2000112.2H153 I157H153-P155 WeakPolarHBondContact O-CD 3.43Å; P155-I157 PolarHBondContact O-N 3.1Å
156L65.4Low78.8Confident161 Ų16197.6 Ų97.684%0.84350%0.495SS*.THydrogen-bonded Turntrans-68.4-27.2-169.4-61.6172000114.2S154S154-L156 PolarHBondContact O-N 2.9Å
157I72.4Confident79.7Confident142 Ų14295 Ų9573%0.72850%0.496SS*.  trans-135.992.1-178.2-53.2176.5000109.2P155P155-I157 PolarHBondContact O-N 3.1Å
158K80.3Confident80.4Confident172 Ų172100 Ų10075%0.74852%0.516SS*.  trans-110.3125.6171.4-67.7-177.5-177.8176.40109.4
159I86.1Confident81.1Confident96 Ų96102.5 Ų102.549%0.49253%0.529SS..  trans-100.6149.3169.257174.9000109.6F164 F165I159-F164 HydrophobicContact CB-CD2 4.4Å; I159-F164 HydrophobicContact CD1-CB 4.14Å; I159-F164 HydrophobicContact CD1-CD2 4.35Å; I159-F164 HydrophobicContact CD1-CG 4.27Å; I159-F165 HydrophobicContact CD1-CD2 4.46Å; I159-F165 HydrophobicContact CD1-CE2 3.75Å; I159-F165 HydrophobicContact CD1-CZ 4.13Å; I159-F165 HydrophobicContact CG1-CD2 4.48Å; I159-F165 HydrophobicContact CG1-CE2 3.68Å; I159-F165 HydrophobicContact CG1-CZ 4.36Å
160K89.4Confident81.8Confident172 Ų172101.9 Ų101.975%0.74852%0.519SS*.  trans-60.2145.8175.5-69.3-176.3179.7179.20110.4Y162K160-Y162 WeakPolarHBondContact CB-O 3.35Å
161F89.3Confident82.8Confident123 Ų12399.5 Ų99.554%0.53951%0.507SS..SBendtrans-62-51179.1-173.6-88.9000111.5P163 F164 F165 T166F161-P163 CarbonylContact O-C 3.58Å; F161-F164 PolarHBondContact O-N 3.06Å; F161-F165 HydrophobicContact CD1-CB 4.4Å; F161-F165 HydrophobicContact CD2-CB 3.58Å; F161-F165 HydrophobicContact CD2-CD2 4.26Å; F161-F165 HydrophobicContact CD2-CG 4.17Å; F161-F165 HydrophobicContact CE1-CB 4.32Å; F161-F165 HydrophobicContact CE2-CB 3.48Å; F161-F165 VanDerWaalsContact CE2-CB 3.48Å; F161-F165 HydrophobicContact CE2-CG 4.3Å; F161-F165 HydrophobicContact CG-CB 4.05Å; F161-F165 HydrophobicContact CZ-CB 3.88Å; F161-F165 WeakPolarHBondContact O-CB 3.41Å; F161-F165 PolarHBondContact O-N 3.03Å; F161-T166 WeakPolarHBondContact CD1-OG1 3.32Å; F161-T166 WeakPolarHBondContact CE1-OG1 3.47Å; F161-T166 PolarHBondContact O-N 3.08Å
162Y92.4Very high84.1Confident169 Ų169100.9 Ų100.966%0.66351%0.508SS*.THydrogen-bonded Turntrans-88.4135.9170.2-176.2-93.2000109.9K160 T166K160-Y162 WeakPolarHBondContact CB-O 3.35Å; Y162-T166 HydrophobicContact CD2-CG2 4.17Å
163P94.5Very high85.4Confident56 Ų56101.1 Ų101.136%0.36450%0.504SS..THydrogen-bonded Turncis-89.2-14.70.834.1-34.6000114.1F161 T166 S167F161-P163 CarbonylContact O-C 3.58Å; P163-T166 PolarHBondContact O-N 3.3Å; P163-S167 PolarHBondContact O-N 2.95Å; P163-S167 PolarHBondContact O-OG 2.89Å; P163-S167 VanDerWaalsContact O-OG 3.1Å
164F93.2Very high86.8Confident126 Ų126101.6 Ų101.655%0.55351%0.51SS*.Hα-helixtrans-61-54.4-163.3-61.3-74.3000114.6I159 F161 K168I159-F164 HydrophobicContact CB-CD2 4.4Å; I159-F164 HydrophobicContact CD1-CB 4.14Å; I159-F164 HydrophobicContact CD1-CD2 4.35Å; I159-F164 HydrophobicContact CD1-CG 4.27Å; F161-F164 PolarHBondContact O-N 3.06Å; F164-K168 WeakPolarHBondContact O-CB 3.49Å; F164-K168 PolarHBondContact O-N 3Å
165F91.1Very high88.4Confident54 Ų54103.4 Ų103.424%0.23752%0.516CS..Hα-helixtrans-75.8-31.4-179.2-70.6-74.9000111.6I159 F161 K168 D169I159-F165 HydrophobicContact CD1-CD2 4.46Å; I159-F165 HydrophobicContact CD1-CE2 3.75Å; I159-F165 HydrophobicContact CD1-CZ 4.13Å; I159-F165 HydrophobicContact CG1-CD2 4.48Å; I159-F165 HydrophobicContact CG1-CE2 3.68Å; I159-F165 HydrophobicContact CG1-CZ 4.36Å; F161-F165 HydrophobicContact CD1-CB 4.4Å; F161-F165 HydrophobicContact CD2-CB 3.58Å; F161-F165 HydrophobicContact CD2-CD2 4.26Å; F161-F165 HydrophobicContact CD2-CG 4.17Å; F161-F165 HydrophobicContact CE1-CB 4.32Å; F161-F165 HydrophobicContact CE2-CB 3.48Å; F161-F165 VanDerWaalsContact CE2-CB 3.48Å; F161-F165 HydrophobicContact CE2-CG 4.3Å; F161-F165 HydrophobicContact CG-CB 4.05Å; F161-F165 HydrophobicContact CZ-CB 3.88Å; F161-F165 WeakPolarHBondContact O-CB 3.41Å; F161-F165 PolarHBondContact O-N 3.03Å; F165-K168 PolarHBondContact O-N 3.38Å; F165-D169 VanDerWaalsContact O-CB 3.31Å; F165-D169 WeakPolarHBondContact O-CB 3.28Å; F165-D169 VanDerWaalsContact O-CG 3.24Å; F165-D169 PolarHBondContact O-N 2.87Å
166T93.9Very high89.6Confident40 Ų40103.4 Ų103.425%0.24551%0.506CS..Hα-helixtrans-59.5-51.4173.6-52.20000111.8F161 Y162 P163 K168 D169 L170F161-T166 WeakPolarHBondContact CD1-OG1 3.32Å; F161-T166 WeakPolarHBondContact CE1-OG1 3.47Å; F161-T166 PolarHBondContact O-N 3.08Å; Y162-T166 HydrophobicContact CD2-CG2 4.17Å; P163-T166 PolarHBondContact O-N 3.3Å; T166-K168 VanDerWaalsContact C-N 3.33Å; T166-K168 PolarHBondContact O-N 3.4Å; T166-D169 PolarHBondContact O-N 3.28Å; T166-L170 HydrophobicContact CG2-CD1 4.32Å; T166-L170 WeakPolarHBondContact O-CG 3.32Å; T166-L170 PolarHBondContact O-N 3.5Å
167S95.3Very high90.8Very high70 Ų7096.8 Ų96.849%0.4947%0.471SS..Hα-helixtrans-64-39.7179.1-58.10000111.8P163 L170 L171P163-S167 PolarHBondContact O-N 2.95Å; P163-S167 PolarHBondContact O-OG 2.89Å; P163-S167 VanDerWaalsContact O-OG 3.1Å; S167-L170 PolarHBondContact O-N 2.81Å; S167-L171 PolarHBondContact O-N 3.04Å
168K94.4Very high91.8Very high119 Ų11996.1 Ų96.152%0.51746%0.464SS..Hα-helixtrans-63.2-42.3175.6-179.6170.3-178.1160.80112.3F164 F165 T166 L171 N172F164-K168 WeakPolarHBondContact O-CB 3.49Å; F164-K168 PolarHBondContact O-N 3Å; F165-K168 PolarHBondContact O-N 3.38Å; T166-K168 VanDerWaalsContact C-N 3.33Å; T166-K168 PolarHBondContact O-N 3.4Å; K168-L171 PolarHBondContact O-N 3.21Å; K168-N172 WeakPolarHBondContact O-CB 3.49Å; K168-N172 PolarHBondContact O-N 3.37Å; K168-N172 PolarHBondContact O-ND2 3.2Å
169D93Very high92.3Very high81 Ų8194 Ų9443%0.43345%0.454SS..Hα-helixtrans-70.7-36.8-179.4-73.8-13000111.6F165 T166 N172 L173F165-D169 VanDerWaalsContact O-CB 3.31Å; F165-D169 WeakPolarHBondContact O-CB 3.28Å; F165-D169 VanDerWaalsContact O-CG 3.24Å; F165-D169 PolarHBondContact O-N 2.87Å; T166-D169 PolarHBondContact O-N 3.28Å; D169-N172 PolarHBondContact O-N 3.25Å; D169-L173 WeakPolarHBondContact O-CB 3.5Å; D169-L173 PolarHBondContact O-N 3.21Å
170L93.6Very high92.7Very high94 Ų9490.1 Ų90.149%0.49243%0.434SS..Hα-helixtrans-62-45.7172-77.7168.4000112.2T166 S167 L173 N174T166-L170 HydrophobicContact CG2-CD1 4.32Å; T166-L170 WeakPolarHBondContact O-CG 3.32Å; T166-L170 PolarHBondContact O-N 3.5Å; S167-L170 PolarHBondContact O-N 2.81Å; L170-L173 WeakPolarHBondContact O-CB 3.19Å; L170-L173 PolarHBondContact O-N 3.23Å; L170-N174 PolarHBondContact O-N 3.2Å; L170-N174 PolarHBondContact O-ND2 3.28Å
171L95.4Very high92.8Very high103 Ų10387.7 Ų87.754%0.53942%0.421SS..Hα-helixtrans-62-46.5177.1-174.6144.3000111.3S167 K168 L173 N174 L175S167-L171 PolarHBondContact O-N 3.04Å; K168-L171 PolarHBondContact O-N 3.21Å; L171-L173 VanDerWaalsContact C-N 3.27Å; L171-L173 PolarHBondContact O-N 2.9Å; L171-N174 PolarHBondContact O-N 3.41Å; L171-L175 HydrophobicContact CD2-CD1 3.6Å; L171-L175 HydrophobicContact CD2-CG 4.36Å; L171-L175 WeakPolarHBondContact O-CG 3.28Å; L171-L175 PolarHBondContact O-N 2.85Å
172N93Very high92.9Very high58 Ų5885.8 Ų85.831%0.3142%0.416SS..Hα-helixtrans-62.1-35.4176.1-71.8-32.7000112.5K168 D169 K176K168-N172 WeakPolarHBondContact O-CB 3.49Å; K168-N172 PolarHBondContact O-N 3.37Å; K168-N172 PolarHBondContact O-ND2 3.2Å; D169-N172 PolarHBondContact O-N 3.25Å; N172-K176 WeakPolarHBondContact O-CB 3.35Å; N172-K176 VanDerWaalsContact O-CG 3.25Å; N172-K176 WeakPolarHBondContact O-CG 3.5Å; N172-K176 PolarHBondContact O-N 3.39Å; N172-K176 VanDerWaalsContact O-N 3.08Å
173L91.9Very high92.9Very high55 Ų5581.3 Ų81.329%0.28841%0.406SS..Hα-helixtrans-67.4-45.9177.7-178.7146.2000111M1 D169 L170 L171 K176 N177M1-L173 HydrophobicContact CB-CD1 4.21Å; M1-L173 HydrophobicContact CE-CD1 3.86Å; M1-L173 HydrophobicContact CE-CD2 3.81Å; M1-L173 HydrophobicContact CE-CG 3.52Å; M1-L173 HydrophobicContact SD-CD1 3.63Å; M1-L173 HydrophobicContact SD-CD2 3.74Å; M1-L173 HydrophobicContact SD-CG 3.8Å; D169-L173 WeakPolarHBondContact O-CB 3.5Å; D169-L173 PolarHBondContact O-N 3.21Å; L170-L173 WeakPolarHBondContact O-CB 3.19Å; L170-L173 PolarHBondContact O-N 3.23Å; L171-L173 VanDerWaalsContact C-N 3.27Å; L171-L173 PolarHBondContact O-N 2.9Å; L173-K176 PolarHBondContact O-N 2.95Å; L173-N177 WeakPolarHBondContact O-CB 3.35Å; L173-N177 PolarHBondContact O-N 3.1Å
174N92.3Very high92.8Very high100 Ų10079.3 Ų79.354%0.53539%0.392SS..Hα-helixtrans-62.6-43.1177.1-70.9-19.5000111.7L170 L171 N177 F178L170-N174 PolarHBondContact O-N 3.2Å; L170-N174 PolarHBondContact O-ND2 3.28Å; L171-N174 PolarHBondContact O-N 3.41Å; N174-N177 PolarHBondContact O-N 2.83Å; N174-F178 WeakPolarHBondContact O-CB 3.45Å; N174-F178 PolarHBondContact O-N 3.01Å
175L93.4Very high92.6Very high85 Ų8578.7 Ų78.745%0.44539%0.394SS..Hα-helixtrans-61.1-48.6175.9-72.6173.5000112L171 N177 F178 F179L171-L175 HydrophobicContact CD2-CD1 3.6Å; L171-L175 HydrophobicContact CD2-CG 4.36Å; L171-L175 WeakPolarHBondContact O-CG 3.28Å; L171-L175 PolarHBondContact O-N 2.85Å; L175-N177 VanDerWaalsContact C-N 3.3Å; L175-N177 PolarHBondContact O-N 3.22Å; L175-F178 WeakPolarHBondContact O-CB 3.41Å; L175-F178 PolarHBondContact O-N 3.48Å; L175-F179 WeakPolarHBondContact O-CD2 3.27Å; L175-F179 PolarHBondContact O-N 2.66Å
176K91.3Very high92.6Very high95 Ų9579.7 Ų79.741%0.41341%0.407SS..Hα-helixtrans-60-41.4178.3-73.5169.9-175.4179.30112L55 N172 L173 F180L55-K176 HydrophobicContact CD1-CD 4.48Å; L55-K176 HydrophobicContact CD2-CD 3.9Å; L55-K176 HydrophobicContact CD2-CG 4.49Å; N172-K176 WeakPolarHBondContact O-CB 3.35Å; N172-K176 VanDerWaalsContact O-CG 3.25Å; N172-K176 WeakPolarHBondContact O-CG 3.5Å; N172-K176 PolarHBondContact O-N 3.39Å; N172-K176 VanDerWaalsContact O-N 3.08Å; L173-K176 PolarHBondContact O-N 2.95Å; K176-F180 WeakPolarHBondContact O-CB 3.36Å; K176-F180 PolarHBondContact O-N 3.44Å
177N90.2Very high92.4Very high22 Ų2280.2 Ų80.212%0.11841%0.408CS..Hα-helixtrans-65.3-44.4175.9-81.2-3.1000112.2M1 L173 N174 L175 F179 F180 Y181M1-N177 WeakPolarHBondContact CE-ND2 3.42Å; M1-N177 WeakPolarHBondContact CE-OD1 3.31Å; L173-N177 WeakPolarHBondContact O-CB 3.35Å; L173-N177 PolarHBondContact O-N 3.1Å; N174-N177 PolarHBondContact O-N 2.83Å; L175-N177 VanDerWaalsContact C-N 3.3Å; L175-N177 PolarHBondContact O-N 3.22Å; N177-F179 PolarHBondContact O-N 2.99Å; N177-F180 PolarHBondContact O-N 3.44Å; N177-F180 VanDerWaalsContact O-N 3.16Å; N177-Y181 HydrophobicContact CB-CD2 4.19Å; N177-Y181 HydrophobicContact CB-CE2 3.91Å; N177-Y181 WeakPolarHBondContact O-CD2 3.49Å; N177-Y181 PolarHBondContact O-N 3.13Å
178F93.2Very high92.1Very high129 Ų12978.5 Ų78.557%0.56639%0.393SS*.Hα-helixtrans-56.4-50.8177.8176.4-99.2000111.1N174 L175 F180 Y181 L182N174-F178 WeakPolarHBondContact O-CB 3.45Å; N174-F178 PolarHBondContact O-N 3.01Å; L175-F178 WeakPolarHBondContact O-CB 3.41Å; L175-F178 PolarHBondContact O-N 3.48Å; F178-F180 VanDerWaalsContact C-N 3.33Å; F178-F180 PolarHBondContact O-N 3.05Å; F178-Y181 PolarHBondContact O-N 3.07Å; F178-L182 WeakPolarHBondContact O-CB 3.31Å; F178-L182 PolarHBondContact O-N 3.36Å
179F92.2Very high91.7Very high127 Ų12778.9 Ų78.956%0.55740%0.395SS*.Hα-helixtrans-62-39.7176.1-75-67.4000112.5L175 N177 L182 V183L175-F179 WeakPolarHBondContact O-CD2 3.27Å; L175-F179 PolarHBondContact O-N 2.66Å; N177-F179 PolarHBondContact O-N 2.99Å; F179-L182 PolarHBondContact O-N 3Å; F179-V183 WeakPolarHBondContact O-CG2 3.4Å; F179-V183 PolarHBondContact O-N 2.99Å
180F92.8Very high91.4Very high14 Ų1480.1 Ų80.16%0.06140%0.401CS..Hα-helixtrans-63.1-46.4177.8-177.7-116.1000112.5N47 L51 K176 N177 F178 V183 L184N47-F180 HydrophobicContact CB-CE2 3.87Å; N47-F180 HydrophobicContact CB-CZ 4.35Å; L51-F180 HydrophobicContact CB-CD2 4.38Å; L51-F180 HydrophobicContact CD2-CB 3.72Å; L51-F180 HydrophobicContact CD2-CD2 3.36Å; L51-F180 HydrophobicContact CD2-CE2 4.14Å; L51-F180 HydrophobicContact CD2-CG 3.7Å; K176-F180 WeakPolarHBondContact O-CB 3.36Å; K176-F180 PolarHBondContact O-N 3.44Å; N177-F180 PolarHBondContact O-N 3.44Å; N177-F180 VanDerWaalsContact O-N 3.16Å; F178-F180 VanDerWaalsContact C-N 3.33Å; F178-F180 PolarHBondContact O-N 3.05Å; F180-V183 PolarHBondContact O-N 2.95Å; F180-L184 HydrophobicContact CD1-CD1 3.91Å; F180-L184 HydrophobicContact CE1-CD1 3.47Å; F180-L184 VanDerWaalsContact CE1-CD1 3.47Å; F180-L184 HydrophobicContact CE1-CG 4.34Å; F180-L184 HydrophobicContact CE2-CD1 4.4Å; F180-L184 HydrophobicContact CE2-CG 4.45Å; F180-L184 HydrophobicContact CZ-CD1 3.76Å; F180-L184 HydrophobicContact CZ-CD2 4.49Å; F180-L184 HydrophobicContact CZ-CG 4.23Å; F180-L184 WeakPolarHBondContact O-CG 3.32Å; F180-L184 PolarHBondContact O-N 3.5Å
181Y91.4Very high90.9Very high121 Ų12176.8 Ų76.848%0.47539%0.386SS..Hα-helixtrans-68.3-34.8177.8-67-53.8000112.4N177 F178 L184 L185N177-Y181 HydrophobicContact CB-CD2 4.19Å; N177-Y181 HydrophobicContact CB-CE2 3.91Å; N177-Y181 WeakPolarHBondContact O-CD2 3.49Å; N177-Y181 PolarHBondContact O-N 3.13Å; F178-Y181 PolarHBondContact O-N 3.07Å; Y181-L184 HydrophobicContact CD1-CD1 4.17Å; Y181-L184 PolarHBondContact O-N 3.37Å; Y181-L185 WeakPolarHBondContact O-CB 3.22Å; Y181-L185 PolarHBondContact O-N 3.39Å
182L92.7Very high90.1Very high83 Ų8376 Ų7644%0.43539%0.385SS..Hα-helixtrans-59.8-48.1173.2-175.569.8000111F178 F179 L184 L185 C186F178-L182 WeakPolarHBondContact O-CB 3.31Å; F178-L182 PolarHBondContact O-N 3.36Å; F179-L182 PolarHBondContact O-N 3Å; L182-L184 PolarHBondContact O-N 3.25Å; L182-L185 PolarHBondContact O-N 2.83Å; L182-C186 PolarHBondContact O-N 2.86Å; L182-C186 PolarHBondContact O-SG 3.2Å; L182-C186 VanDerWaalsContact O-SG 3.39Å
183V91.8Very high89.3Confident76 Ų7679.1 Ų79.146%0.46140%0.396SS..Hα-helixtrans-61.6-44.1176.8171.90000111.2F179 F180 L185 C186 I187F179-V183 WeakPolarHBondContact O-CG2 3.4Å; F179-V183 PolarHBondContact O-N 2.99Å; F180-V183 PolarHBondContact O-N 2.95Å; V183-L185 VanDerWaalsContact C-N 3.32Å; V183-L185 PolarHBondContact O-N 3.27Å; V183-C186 PolarHBondContact O-N 3.29Å; V183-I187 HydrophobicContact CG1-CD1 3.92Å; V183-I187 WeakPolarHBondContact O-CG1 3.38Å; V183-I187 PolarHBondContact O-N 2.74Å
184L91.8Very high88.3Confident13 Ų1380.6 Ų80.67%0.06840%0.403CS..Hα-helixtrans-59.5-43.2175.8-75.2174.6000111.7L43 I44 N47 F180 Y181 L182 C186 I187 L188L43-L184 HydrophobicContact CB-CD2 4.12Å; I44-L184 HydrophobicContact CG1-CD1 3.99Å; N47-L184 HydrophobicContact CB-CD2 4.01Å; F180-L184 HydrophobicContact CD1-CD1 3.91Å; F180-L184 HydrophobicContact CE1-CD1 3.47Å; F180-L184 VanDerWaalsContact CE1-CD1 3.47Å; F180-L184 HydrophobicContact CE1-CG 4.34Å; F180-L184 HydrophobicContact CE2-CD1 4.4Å; F180-L184 HydrophobicContact CE2-CG 4.45Å; F180-L184 HydrophobicContact CZ-CD1 3.76Å; F180-L184 HydrophobicContact CZ-CD2 4.49Å; F180-L184 HydrophobicContact CZ-CG 4.23Å; F180-L184 WeakPolarHBondContact O-CG 3.32Å; F180-L184 PolarHBondContact O-N 3.5Å; Y181-L184 HydrophobicContact CD1-CD1 4.17Å; Y181-L184 PolarHBondContact O-N 3.37Å; L182-L184 PolarHBondContact O-N 3.25Å; L184-C186 PolarHBondContact O-N 2.97Å; L184-I187 PolarHBondContact O-N 3.02Å; L184-L188 VanDerWaalsContact O-CG 3.22Å; L184-L188 WeakPolarHBondContact O-CG 3.17Å; L184-L188 PolarHBondContact O-N 3.21Å
185L90.9Very high87.1Confident114 Ų11480.9 Ų80.960%0.59740%0.404SS*.Hα-helixtrans-63.8-40.6178.1-170.4136.9000111.9Y181 L182 V183 I187 L188 F189Y181-L185 WeakPolarHBondContact O-CB 3.22Å; Y181-L185 PolarHBondContact O-N 3.39Å; L182-L185 PolarHBondContact O-N 2.83Å; V183-L185 VanDerWaalsContact C-N 3.32Å; V183-L185 PolarHBondContact O-N 3.27Å; L185-I187 PolarHBondContact O-N 3.47Å; L185-L188 PolarHBondContact O-N 3.43Å; L185-F189 WeakPolarHBondContact O-CB 3.4Å; L185-F189 PolarHBondContact O-N 3.27Å
186C90.7Very high85.6Confident74 Ų7479 Ų7950%0.541%0.405SS..Hα-helixtrans-60.3-43.5172.6-690000112.2L182 V183 L184 F189 L190L182-C186 PolarHBondContact O-N 2.86Å; L182-C186 PolarHBondContact O-SG 3.2Å; L182-C186 VanDerWaalsContact O-SG 3.39Å; V183-C186 PolarHBondContact O-N 3.29Å; L184-C186 PolarHBondContact O-N 2.97Å; C186-F189 PolarHBondContact O-N 3.26Å; C186-L190 WeakPolarHBondContact O-CB 3.32Å; C186-L190 PolarHBondContact O-N 2.93Å
187I89.6Confident83.8Confident51 Ų5184.2 Ų84.226%0.26242%0.423SS..Hα-helixtrans-65.2-42178.2-65.5165.5000110.9L43 N47 V183 L184 L185 L190 S191L43-I187 HydrophobicContact CD2-CG2 3.61Å; N47-I187 VanDerWaalsContact OD1-CD1 3.27Å; N47-I187 WeakPolarHBondContact OD1-CD1 3.4Å; V183-I187 HydrophobicContact CG1-CD1 3.92Å; V183-I187 WeakPolarHBondContact O-CG1 3.38Å; V183-I187 PolarHBondContact O-N 2.74Å; L184-I187 PolarHBondContact O-N 3.02Å; L185-I187 PolarHBondContact O-N 3.47Å; I187-L190 PolarHBondContact O-N 3.39Å; I187-S191 WeakPolarHBondContact O-CB 3.38Å; I187-S191 PolarHBondContact O-N 3.4Å; I187-S191 PolarHBondContact O-OG 3.37Å
188L88.2Confident82.1Confident35 Ų3589.3 Ų89.318%0.18345%0.448CS..Hα-helixtrans-60-50.1176.7-70.6168.1000110.9F39 F40 L43 L184 L185 L190 S191 T192F39-L188 HydrophobicContact CD1-CD2 3.92Å; F39-L188 HydrophobicContact CE1-CD2 3.29Å; F39-L188 HydrophobicContact CZ-CD2 4.2Å; F40-L188 HydrophobicContact CD1-CD1 4.01Å; F40-L188 HydrophobicContact CD1-CD2 4.17Å; F40-L188 HydrophobicContact CE1-CD1 3.27Å; F40-L188 HydrophobicContact CE1-CD2 3.77Å; F40-L188 HydrophobicContact CE1-CG 4.18Å; F40-L188 HydrophobicContact CZ-CD1 3.97Å; F40-L188 HydrophobicContact CZ-CD2 3.98Å; L43-L188 HydrophobicContact CD1-CD2 3.45Å; L43-L188 VanDerWaalsContact CD1-CD2 3.45Å; L43-L188 HydrophobicContact CD1-CG 4.24Å; L184-L188 VanDerWaalsContact O-CG 3.22Å; L184-L188 WeakPolarHBondContact O-CG 3.17Å; L184-L188 PolarHBondContact O-N 3.21Å; L185-L188 PolarHBondContact O-N 3.43Å; L188-L190 VanDerWaalsContact C-N 3.34Å; L188-L190 PolarHBondContact O-N 3.22Å; L188-S191 PolarHBondContact O-N 3.43Å; L188-S191 VanDerWaalsContact O-N 3.16Å; L188-S191 PolarHBondContact O-OG 3.38Å; L188-T192 PolarHBondContact O-N 3.02Å; L188-T192 PolarHBondContact O-OG1 2.8Å
189F86.7Confident80.6Confident127 Ų12787.5 Ų87.556%0.55746%0.457SS*.Hα-helixtrans-59.6-43.8178.5-174.4-99.2000112.1L185 C186 S191 T192 F193L185-F189 WeakPolarHBondContact O-CB 3.4Å; L185-F189 PolarHBondContact O-N 3.27Å; C186-F189 PolarHBondContact O-N 3.26Å; F189-S191 PolarHBondContact O-N 3.14Å; F189-T192 WeakPolarHBondContact CA-OG1 3.37Å; F189-T192 PolarHBondContact O-N 2.87Å; F189-T192 PolarHBondContact O-OG1 3.19Å; F189-F193 HydrophobicContact CD1-CD2 4.08Å; F189-F193 HydrophobicContact CD1-CE2 4.49Å; F189-F193 AromaticContact CE1-CD2 3.58Å; F189-F193 HydrophobicContact CE1-CD2 3.58Å; F189-F193 AromaticContact CE1-CE2 3.59Å; F189-F193 HydrophobicContact CE1-CE2 3.59Å; F189-F193 HydrophobicContact CE2-CD2 4.11Å; F189-F193 AromaticContact CE2-CE2 3.85Å; F189-F193 HydrophobicContact CE2-CE2 3.85Å; F189-F193 AromaticContact CZ-CD2 3.63Å; F189-F193 HydrophobicContact CZ-CD2 3.63Å; F189-F193 AromaticContact CZ-CE2 3.23Å; F189-F193 HydrophobicContact CZ-CE2 3.23Å; F189-F193 HydrophobicContact CZ-CZ 4.27Å; F189-F193 PolarHBondContact O-N 3.42Å
190L86.1Confident78.9Confident106 Ų10688 Ų8856%0.55548%0.477SS*.Hα-helixtrans-63.2-42.1176.2-168.773.8000111.4C186 I187 L188 T192 F193 I194C186-L190 WeakPolarHBondContact O-CB 3.32Å; C186-L190 PolarHBondContact O-N 2.93Å; I187-L190 PolarHBondContact O-N 3.39Å; L188-L190 VanDerWaalsContact C-N 3.34Å; L188-L190 PolarHBondContact O-N 3.22Å; L190-T192 PolarHBondContact O-N 2.97Å; L190-F193 PolarHBondContact O-N 2.98Å; L190-I194 HydrophobicContact CD1-CD1 4.49Å; L190-I194 HydrophobicContact CD2-CD1 4.23Å; L190-I194 HydrophobicContact CG-CD1 3.84Å; L190-I194 HydrophobicContact CG-CG1 4.46Å; L190-I194 VanDerWaalsContact O-CG1 3.29Å; L190-I194 WeakPolarHBondContact O-CG1 3.39Å; L190-I194 PolarHBondContact O-N 2.93Å
191S83.2Confident78.2Confident25 Ų2591.8 Ų91.818%0.17550%0.498CS..Hα-helixtrans-64.6-39.2179.272.70000112.5I187 L188 F189 L195I187-S191 WeakPolarHBondContact O-CB 3.38Å; I187-S191 PolarHBondContact O-N 3.4Å; I187-S191 PolarHBondContact O-OG 3.37Å; L188-S191 PolarHBondContact O-N 3.43Å; L188-S191 VanDerWaalsContact O-N 3.16Å; L188-S191 PolarHBondContact O-OG 3.38Å; F189-S191 PolarHBondContact O-N 3.14Å; S191-L195 WeakPolarHBondContact O-CB 2.96Å; S191-L195 VanDerWaalsContact O-CG 3.25Å; S191-L195 WeakPolarHBondContact O-CG 3.31Å; S191-L195 PolarHBondContact O-N 2.93Å
192T78Confident77.5Confident85 Ų8590.2 Ų90.252%0.52150%0.499SS..Hα-helixtrans-68.1-37.3174.546.50000111.9L188 F189 L190 G196L188-T192 PolarHBondContact O-N 3.02Å; L188-T192 PolarHBondContact O-OG1 2.8Å; F189-T192 WeakPolarHBondContact CA-OG1 3.37Å; F189-T192 PolarHBondContact O-N 2.87Å; F189-T192 PolarHBondContact O-OG1 3.19Å; L190-T192 PolarHBondContact O-N 2.97Å; T192-G196 PolarHBondContact O-N 3.17Å
193F76.3Confident76.6Confident124 Ų12490.6 Ų90.654%0.54450%0.502SS..Hα-helixtrans-64.4-48.2175.2-110.6-90.1000111.5F189 L190 G196 W197F189-F193 HydrophobicContact CD1-CD2 4.08Å; F189-F193 HydrophobicContact CD1-CE2 4.49Å; F189-F193 AromaticContact CE1-CD2 3.58Å; F189-F193 HydrophobicContact CE1-CD2 3.58Å; F189-F193 AromaticContact CE1-CE2 3.59Å; F189-F193 HydrophobicContact CE1-CE2 3.59Å; F189-F193 HydrophobicContact CE2-CD2 4.11Å; F189-F193 AromaticContact CE2-CE2 3.85Å; F189-F193 HydrophobicContact CE2-CE2 3.85Å; F189-F193 AromaticContact CZ-CD2 3.63Å; F189-F193 HydrophobicContact CZ-CD2 3.63Å; F189-F193 AromaticContact CZ-CE2 3.23Å; F189-F193 HydrophobicContact CZ-CE2 3.23Å; F189-F193 HydrophobicContact CZ-CZ 4.27Å; F189-F193 PolarHBondContact O-N 3.42Å; L190-F193 PolarHBondContact O-N 2.98Å; F193-G196 PolarHBondContact O-N 2.99Å; F193-W197 WeakPolarHBondContact O-CB 3.29Å; F193-W197 PolarHBondContact O-N 3.18Å
194I71.5Confident75.7Confident86 Ų8691.5 Ų91.544%0.44151%0.505SS..Hα-helixtrans-63.3-44.4179.2-67.7167000110.8L190 W197 I198L190-I194 HydrophobicContact CD1-CD1 4.49Å; L190-I194 HydrophobicContact CD2-CD1 4.23Å; L190-I194 HydrophobicContact CG-CD1 3.84Å; L190-I194 HydrophobicContact CG-CG1 4.46Å; L190-I194 VanDerWaalsContact O-CG1 3.29Å; L190-I194 WeakPolarHBondContact O-CG1 3.39Å; L190-I194 PolarHBondContact O-N 2.93Å; I194-W197 PolarHBondContact O-N 3.39Å; I194-I198 HydrophobicContact CG2-CD1 3.71Å; I194-I198 HydrophobicContact CG2-CG1 4.49Å; I194-I198 VanDerWaalsContact O-CG1 3.28Å; I194-I198 WeakPolarHBondContact O-CG1 3.42Å; I194-I198 PolarHBondContact O-N 3.02Å
195L67.3Low74.7Confident106 Ų10696.4 Ų96.456%0.55553%0.532SS*.Hα-helixtrans-66.2-37.4177.4-72.6169.8000112.2S191 W197 I198 A199S191-L195 WeakPolarHBondContact O-CB 2.96Å; S191-L195 VanDerWaalsContact O-CG 3.25Å; S191-L195 WeakPolarHBondContact O-CG 3.31Å; S191-L195 PolarHBondContact O-N 2.93Å; L195-W197 VanDerWaalsContact C-N 3.34Å; L195-I198 PolarHBondContact O-N 3.11Å; L195-A199 WeakPolarHBondContact O-CB 3.41Å; L195-A199 PolarHBondContact O-N 3.11Å
196G62.7Low73.7Confident45 Ų4595.2 Ų95.246%0.46453%0.528SS..Hα-helixtrans-65.2-36.8173.900000112.8T192 F193 A199 S200T192-G196 PolarHBondContact O-N 3.17Å; F193-G196 PolarHBondContact O-N 2.99Å; G196-A199 PolarHBondContact O-N 3.34Å; G196-S200 PolarHBondContact O-N 3.08Å
197W52.1Low72.5Confident206 Ų20696.7 Ų96.778%0.7853%0.53SS*.Hα-helixtrans-74.4-30.3178.2-142.277.7000113.2F193 I194 L195 A199 S200F193-W197 WeakPolarHBondContact O-CB 3.29Å; F193-W197 PolarHBondContact O-N 3.18Å; I194-W197 PolarHBondContact O-N 3.39Å; L195-W197 VanDerWaalsContact C-N 3.34Å; W197-A199 VanDerWaalsContact C-N 3.33Å; W197-S200 PolarHBondContact O-OG 3.3Å; W197-S200 VanDerWaalsContact O-OG 3.07Å
198I55.1Low71.1Confident128 Ų128100.2 Ų100.266%0.65655%0.55SS**Hα-helixtrans-76.7-23.4174.6-66.8165.3000111.4I194 L195I194-I198 HydrophobicContact CG2-CD1 3.71Å; I194-I198 HydrophobicContact CG2-CG1 4.49Å; I194-I198 VanDerWaalsContact O-CG1 3.28Å; I194-I198 WeakPolarHBondContact O-CG1 3.42Å; I194-I198 PolarHBondContact O-N 3.02Å; L195-I198 PolarHBondContact O-N 3.11Å
199A61.4Low69.7Low91 Ų91105.7 Ų105.775%0.75258%0.581SS**  trans-89.8-5.5-179.300000114.4L195 G196 W197L195-A199 WeakPolarHBondContact O-CB 3.41Å; L195-A199 PolarHBondContact O-N 3.11Å; G196-A199 PolarHBondContact O-N 3.34Å; W197-A199 VanDerWaalsContact C-N 3.33Å
200S56.1Low68.2Low139 Ų139103.7 Ų103.797%0.97258%0.583SS**  trans-103.20176.160.40000111.8G196 W197G196-S200 PolarHBondContact O-N 3.08Å; W197-S200 PolarHBondContact O-OG 3.3Å; W197-S200 VanDerWaalsContact O-OG 3.07Å

Retrieved 200 of 200 residues in 943.9 ms (Link to these results)