A0A087XC94_POEFO Loading...

Regulatory factor X, 6

AlphaFold DB , UniProt , Accession A0A087XC94, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 709 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
1M83.9Confident93.4Very high186 Ų18665.4 Ų65.492%0.91633%0.328SS*.  0-65.70-164.457-179.800111.6Y3 K4 T5M1-Y3 VanDerWaalsContact C-N 3.29Å; M1-Y3 PolarHBondContact O-N 2.83Å; M1-Y3 VanDerWaalsContact O-N 3.08Å; M1-K4 WeakPolarHBondContact O-CA 3.25Å; M1-K4 WeakPolarHBondContact O-CB 3.32Å; M1-K4 PolarHBondContact O-N 3.01Å; M1-T5 PolarHBondContact O-N 3.48Å
2M90.6Very high93.5Very high113 Ų11365.5 Ų65.556%0.55733%0.33SS*.Hα-helixtrans-45.7-44.7-174.6-62.2-179.6-6600114.8K4 T5 H6 F29 L37M2-K4 VanDerWaalsContact C-N 3.33Å; M2-K4 PolarHBondContact O-N 3.23Å; M2-T5 WeakPolarHBondContact O-CB 3.21Å; M2-T5 PolarHBondContact O-N 2.98Å; M2-T5 VanDerWaalsContact O-N 3.11Å; M2-H6 PolarHBondContact O-N 2.86Å; M2-F29 HydrophobicContact CB-CE2 4.34Å; M2-L37 HydrophobicContact CE-CD1 3.64Å
3Y94.1Very high93.5Very high23 Ų2361.7 Ų61.79%0.0931%0.312CS..Hα-helixtrans-60.5-37.7177.2-155.3-107.6000114.1M1 T5 H6 C7 F29 W30 F50 C53 D54 K107M1-Y3 VanDerWaalsContact C-N 3.29Å; M1-Y3 PolarHBondContact O-N 2.83Å; M1-Y3 VanDerWaalsContact O-N 3.08Å; Y3-T5 VanDerWaalsContact C-N 3.31Å; Y3-T5 PolarHBondContact O-N 3.42Å; Y3-H6 AromaticContact CE2-CD2 3.79Å; Y3-H6 WeakPolarHBondContact O-CB 3.23Å; Y3-H6 PolarHBondContact O-N 2.9Å; Y3-C7 WeakPolarHBondContact CE1-SG 3.3Å; Y3-C7 PolarHBondContact O-N 3.19Å; Y3-C7 PolarHBondContact O-SG 3.4Å; Y3-F29 AromaticContact CD2-CE1 3.59Å; Y3-F29 HydrophobicContact CD2-CE1 3.59Å; Y3-F29 AromaticContact CD2-CZ 3.64Å; Y3-F29 HydrophobicContact CD2-CZ 3.64Å; Y3-F29 HydrophobicContact CE2-CD1 4.44Å; Y3-F29 AromaticContact CE2-CE1 3.76Å; Y3-F29 HydrophobicContact CE2-CE1 3.76Å; Y3-F29 HydrophobicContact CE2-CZ 4.29Å; Y3-W30 HydrophobicContact CD2-CH2 4.43Å; Y3-W30 HydrophobicContact CD2-CZ2 4.48Å; Y3-W30 AromaticContact CE2-CH2 3.68Å; Y3-W30 HydrophobicContact CE2-CH2 3.68Å; Y3-W30 AromaticContact CE2-CZ2 3.42Å; Y3-W30 HydrophobicContact CE2-CZ2 3.42Å; Y3-W30 VanDerWaalsContact CE2-CZ2 3.42Å; Y3-W30 AromaticContact CZ-CZ2 3.99Å; Y3-F50 AromaticContact CD1-CD1 3.69Å; Y3-F50 HydrophobicContact CD1-CD1 3.69Å; Y3-F50 HydrophobicContact CD1-CE1 4.23Å; Y3-F50 AromaticContact CD2-CD1 3.59Å; Y3-F50 HydrophobicContact CD2-CD1 3.59Å; Y3-F50 AromaticContact CD2-CE1 3.55Å; Y3-F50 HydrophobicContact CD2-CE1 3.55Å; Y3-F50 HydrophobicContact CE1-CB 4.4Å; Y3-F50 AromaticContact CE1-CD1 3.85Å; Y3-F50 HydrophobicContact CE1-CD1 3.85Å; Y3-F50 AromaticContact CE2-CD1 3.79Å; Y3-F50 HydrophobicContact CE2-CD1 3.79Å; Y3-F50 HydrophobicContact CE2-CE1 4.13Å; Y3-F50 HydrophobicContact CE2-CG 4.46Å; Y3-F50 AromaticContact CG-CD1 3.55Å; Y3-F50 HydrophobicContact CG-CD1 3.55Å; Y3-F50 AromaticContact CG-CE1 3.62Å; Y3-F50 HydrophobicContact CG-CE1 3.62Å; Y3-F50 AromaticContact CZ-CD1 3.91Å; Y3-C53 HydrophobicContact CD1-CB 3.77Å; Y3-C53 HydrophobicContact CE1-CB 3.63Å; Y3-D54 PolarHBondContact OH-OD1 3.48Å; Y3-K107 PolarHBondContact OH-NZ 3.3Å
4K92.8Very high93.3Very high147 Ų14757.4 Ų57.464%0.63929%0.29SS*.Hα-helixtrans-62.1-41.8175.2-175.7-174.4174.9-176.40110.7M1 M2 C7 Q8M1-K4 WeakPolarHBondContact O-CA 3.25Å; M1-K4 WeakPolarHBondContact O-CB 3.32Å; M1-K4 PolarHBondContact O-N 3.01Å; M2-K4 VanDerWaalsContact C-N 3.33Å; M2-K4 PolarHBondContact O-N 3.23Å; K4-C7 PolarHBondContact O-N 3.15Å; K4-Q8 WeakPolarHBondContact O-CB 3.26Å; K4-Q8 PolarHBondContact O-N 3.25Å
5T94.3Very high93.1Very high73 Ų7359.7 Ų59.745%0.44830%0.302SS..Hα-helixtrans-62.9-43.4175.9-51.40000111M1 M2 Y3 Q8 C9M1-T5 PolarHBondContact O-N 3.48Å; M2-T5 WeakPolarHBondContact O-CB 3.21Å; M2-T5 PolarHBondContact O-N 2.98Å; M2-T5 VanDerWaalsContact O-N 3.11Å; Y3-T5 VanDerWaalsContact C-N 3.31Å; Y3-T5 PolarHBondContact O-N 3.42Å; T5-Q8 PolarHBondContact O-N 3.49Å; T5-C9 PolarHBondContact O-N 2.67Å; T5-C9 PolarHBondContact O-SG 3.46Å
6H95.4Very high92.9Very high10 Ų1062.6 Ų62.65%0.04632%0.319CS..Hα-helixtrans-59.7-48.4175.1174.856.3000112.7M2 Y3 Q8 C9 I10 F25 F29 W30M2-H6 PolarHBondContact O-N 2.86Å; Y3-H6 AromaticContact CE2-CD2 3.79Å; Y3-H6 WeakPolarHBondContact O-CB 3.23Å; Y3-H6 PolarHBondContact O-N 2.9Å; H6-Q8 VanDerWaalsContact C-N 3.3Å; H6-Q8 PolarHBondContact O-N 2.87Å; H6-C9 PolarHBondContact O-N 3.01Å; H6-I10 WeakPolarHBondContact O-CG1 3.46Å; H6-I10 PolarHBondContact O-N 2.91Å; H6-I10 VanDerWaalsContact O-N 3.12Å; H6-F25 PolarHBondContact CE1-O 3.05Å; H6-F25 VanDerWaalsContact CE1-O 3.3Å; H6-F29 HydrophobicContact CB-CD1 4.42Å; H6-F29 HydrophobicContact CB-CD2 3.6Å; H6-F29 HydrophobicContact CB-CE2 3.89Å; H6-F29 HydrophobicContact CB-CG 3.9Å; H6-F29 HydrophobicContact CB-CZ 4.44Å; H6-F29 AromaticContact CD2-CD1 3.57Å; H6-F29 AromaticContact CD2-CG 3.71Å; H6-F29 VanDerWaalsContact CE1-CB 3.47Å; H6-F29 WeakPolarHBondContact CE1-CB 3.35Å; H6-F29 AromaticContact CE1-CG 3.87Å; H6-F29 AromaticContact CG-CD1 3.83Å; H6-F29 AromaticContact CG-CD2 3.73Å; H6-F29 AromaticContact CG-CG 3.46Å; H6-F29 VanDerWaalsContact CG-CG 3.46Å; H6-F29 WeakPolarHBondContact ND1-CB 3.48Å; H6-F29 AromaticContact ND1-CG 3.58Å; H6-F29 AromaticContact NE2-CD1 3.79Å; H6-F29 AromaticContact NE2-CG 3.96Å; H6-W30 AromaticContact NE2-NE1 3.83Å
7C96.2Very high92.6Very high19 Ų1963.8 Ų63.813%0.12833%0.325CS..Hα-helixtrans-59.3-39.6174.5-62.10000112.5Y3 K4 I10 L11 L57Y3-C7 WeakPolarHBondContact CE1-SG 3.3Å; Y3-C7 PolarHBondContact O-N 3.19Å; Y3-C7 PolarHBondContact O-SG 3.4Å; K4-C7 PolarHBondContact O-N 3.15Å; C7-I10 PolarHBondContact O-N 2.81Å; C7-L11 PolarHBondContact O-N 2.86Å; C7-L57 HydrophobicContact CB-CD1 4.27Å; C7-L57 HydrophobicContact CB-CD2 4Å; C7-L57 WeakPolarHBondContact O-CD1 3.35Å
8Q94.6Very high92.5Very high83 Ų8364.2 Ų64.239%0.38833%0.328SS..Hα-helixtrans-64-46.9176.6-168.768.658.300111.3K4 T5 H6 I10 L11 D12K4-Q8 WeakPolarHBondContact O-CB 3.26Å; K4-Q8 PolarHBondContact O-N 3.25Å; T5-Q8 PolarHBondContact O-N 3.49Å; H6-Q8 VanDerWaalsContact C-N 3.3Å; H6-Q8 PolarHBondContact O-N 2.87Å; Q8-I10 VanDerWaalsContact C-N 3.27Å; Q8-I10 PolarHBondContact O-N 3.25Å; Q8-L11 PolarHBondContact O-N 3.12Å; Q8-L11 VanDerWaalsContact O-N 3.1Å; Q8-D12 PolarHBondContact NE2-OD1 2.95Å; Q8-D12 WeakPolarHBondContact O-CB 3.38Å; Q8-D12 PolarHBondContact O-N 3.02Å
9C95Very high92.4Very high36 Ų3661.8 Ų61.824%0.24332%0.315CS..Hα-helixtrans-61.1-34177.8-63.50000113.1T5 H6 N13 F25T5-C9 PolarHBondContact O-N 2.67Å; T5-C9 PolarHBondContact O-SG 3.46Å; H6-C9 PolarHBondContact O-N 3.01Å; C9-N13 PolarHBondContact O-N 2.81Å; C9-N13 PolarHBondContact O-ND2 3.33Å; C9-F25 HydrophobicContact CB-CD1 4.11Å; C9-F25 HydrophobicContact CB-CE1 4.24Å; C9-F25 HydrophobicContact CB-CG 4.42Å
10I95.9Very high92.2Very high3 Ų367.1 Ų67.12%0.01534%0.338CS..Hα-helixtrans-65.9-48.2172.9-67.7168.4000110.4H6 C7 Q8 N13 A14 I22 L26 L57 L61 W88H6-I10 WeakPolarHBondContact O-CG1 3.46Å; H6-I10 PolarHBondContact O-N 2.91Å; H6-I10 VanDerWaalsContact O-N 3.12Å; C7-I10 PolarHBondContact O-N 2.81Å; Q8-I10 VanDerWaalsContact C-N 3.27Å; Q8-I10 PolarHBondContact O-N 3.25Å; I10-N13 PolarHBondContact O-N 3.32Å; I10-A14 WeakPolarHBondContact O-CB 3.46Å; I10-A14 PolarHBondContact O-N 2.91Å; I10-I22 HydrophobicContact CG1-CG2 4.42Å; I10-I22 HydrophobicContact CG2-CG2 4.17Å; I10-L26 HydrophobicContact CD1-CD2 4Å; I10-L57 HydrophobicContact CB-CD2 4.34Å; I10-L57 HydrophobicContact CD1-CD2 4.08Å; I10-L57 HydrophobicContact CG2-CD1 4.49Å; I10-L57 HydrophobicContact CG2-CD2 4.21Å; I10-L61 HydrophobicContact CG2-CD1 4.09Å; I10-W88 HydrophobicContact CD1-CH2 4.41Å; I10-W88 HydrophobicContact CG2-CH2 3.99Å; I10-W88 HydrophobicContact CG2-CZ3 4.11Å
11L94.6Very high92.2Very high26 Ų2668 Ų6814%0.13634%0.342CS..Hα-helixtrans-62.8-45.7-179.9178.758.5000111.9C7 Q8 N13 A14 I15 L57 V60 L61 V64C7-L11 PolarHBondContact O-N 2.86Å; Q8-L11 PolarHBondContact O-N 3.12Å; Q8-L11 VanDerWaalsContact O-N 3.1Å; L11-N13 VanDerWaalsContact C-N 3.31Å; L11-N13 PolarHBondContact O-N 2.7Å; L11-A14 PolarHBondContact O-N 2.72Å; L11-I15 HydrophobicContact CD1-CD1 4.15Å; L11-I15 HydrophobicContact CD1-CG1 4.31Å; L11-I15 HydrophobicContact CG-CD1 3.95Å; L11-I15 VanDerWaalsContact O-CG1 3.3Å; L11-I15 WeakPolarHBondContact O-CG1 3.06Å; L11-I15 PolarHBondContact O-N 2.89Å; L11-L57 HydrophobicContact CB-CD1 4.1Å; L11-V60 HydrophobicContact CD1-CG1 3.89Å; L11-V60 HydrophobicContact CD2-CG1 3.81Å; L11-L61 HydrophobicContact CD1-CD2 3.95Å; L11-V64 HydrophobicContact CD1-CG2 4.34Å
12D94.1Very high92.7Very high67 Ų6759.2 Ų59.236%0.35830%0.298SS..Hα-helixtrans-61.5-39.3179.5-63.7-15.2000111.2Q8 N16Q8-D12 PolarHBondContact NE2-OD1 2.95Å; Q8-D12 WeakPolarHBondContact O-CB 3.38Å; Q8-D12 PolarHBondContact O-N 3.02Å; D12-N16 PolarHBondContact O-N 2.79Å; D12-N16 PolarHBondContact O-ND2 3.21Å
13N93.5Very high92.9Very high16 Ų1657.1 Ų57.19%0.08629%0.287CS..Hα-helixtrans-71.2-37.4175.3-83.1-77.5000112.9C9 I10 L11 N16 I17 N18 E21 I22 F25C9-N13 PolarHBondContact O-N 2.81Å; C9-N13 PolarHBondContact O-ND2 3.33Å; I10-N13 PolarHBondContact O-N 3.32Å; L11-N13 VanDerWaalsContact C-N 3.31Å; L11-N13 PolarHBondContact O-N 2.7Å; N13-N16 CarbonylContact O-C 3.58Å; N13-N16 PolarHBondContact O-N 3.11Å; N13-I17 PolarHBondContact O-N 2.61Å; N13-N18 HydrophobicContact CB-CB 4.2Å; N13-N18 PolarHBondContact O-N 3.01Å; N13-N18 WeakPolarHBondContact OD1-CB 3.5Å; N13-E21 PolarHBondContact OD1-OE2 3.5Å; N13-I22 HydrophobicContact CB-CD1 4.19Å; N13-I22 HydrophobicContact CB-CG1 3.73Å; N13-F25 WeakPolarHBondContact ND2-CE2 3.45Å
14A91.9Very high92.9Very high1 Ų160.8 Ų60.81%0.00831%0.309CS..Hα-helixtrans-65.2-38.8175.100000112.4I10 L11 N16 I17 I22 L61 L65I10-A14 WeakPolarHBondContact O-CB 3.46Å; I10-A14 PolarHBondContact O-N 2.91Å; L11-A14 PolarHBondContact O-N 2.72Å; A14-N16 VanDerWaalsContact C-N 3.26Å; A14-N16 PolarHBondContact O-N 2.92Å; A14-I17 PolarHBondContact O-N 3.42Å; A14-I17 VanDerWaalsContact O-N 3.11Å; A14-I22 HydrophobicContact CB-CD1 4.16Å; A14-L61 HydrophobicContact CB-CD2 3.28Å; A14-L65 HydrophobicContact CB-CD2 4.36Å
15I89.2Confident93Very high92 Ų9257 Ų5747%0.47229%0.292SS..Hα-helixtrans-58.7-39.4172.2-70.7163.8000111.2L11 I17 V64L11-I15 HydrophobicContact CD1-CD1 4.15Å; L11-I15 HydrophobicContact CD1-CG1 4.31Å; L11-I15 HydrophobicContact CG-CD1 3.95Å; L11-I15 VanDerWaalsContact O-CG1 3.3Å; L11-I15 WeakPolarHBondContact O-CG1 3.06Å; L11-I15 PolarHBondContact O-N 2.89Å; I15-I17 VanDerWaalsContact C-N 3.31Å; I15-V64 HydrophobicContact CG1-CG1 3.59Å
16N89.7Confident93Very high107 Ų10753.7 Ų53.757%0.57227%0.271SS*.THydrogen-bonded Turntrans-85.52.4178.5-70.6-76.3000113.8D12 N13 A14 N18D12-N16 PolarHBondContact O-N 2.79Å; D12-N16 PolarHBondContact O-ND2 3.21Å; N13-N16 CarbonylContact O-C 3.58Å; N13-N16 PolarHBondContact O-N 3.11Å; A14-N16 VanDerWaalsContact C-N 3.26Å; A14-N16 PolarHBondContact O-N 2.92Å; N16-N18 PolarHBondContact O-N 2.9Å; N16-N18 PolarHBondContact O-OD1 3.22Å
17I87.7Confident93Very high82 Ų8255.9 Ų55.942%0.42128%0.283SS..THydrogen-bonded Turntrans64.713.7-178.3-52.4159.4000112.5N13 A14 I15 F19 L77N13-I17 PolarHBondContact O-N 2.61Å; A14-I17 PolarHBondContact O-N 3.42Å; A14-I17 VanDerWaalsContact O-N 3.11Å; I15-I17 VanDerWaalsContact C-N 3.31Å; I17-F19 HydrophobicContact CG2-CD2 4.16Å; I17-F19 HydrophobicContact CG2-CE2 3.73Å; I17-F19 HydrophobicContact CG2-CZ 4.32Å; I17-F19 PolarHBondContact O-N 3.41Å; I17-L77 HydrophobicContact CD1-CD1 3.91Å; I17-L77 HydrophobicContact CG1-CD1 4.17Å; I17-L77 HydrophobicContact CG2-CD1 4.46Å
18N90.9Very high92.9Very high72 Ų7262.2 Ų62.239%0.38531%0.311SS..  trans-77.457.6178.5-75.54.3000112.1N13 N16 E20 E21N13-N18 HydrophobicContact CB-CB 4.2Å; N13-N18 PolarHBondContact O-N 3.01Å; N13-N18 WeakPolarHBondContact OD1-CB 3.5Å; N16-N18 PolarHBondContact O-N 2.9Å; N16-N18 PolarHBondContact O-OD1 3.22Å; N18-E20 VanDerWaalsContact C-N 3.27Å; N18-E20 PolarHBondContact O-N 3.2Å; N18-E21 PolarHBondContact O-N 3.49Å
19F90.9Very high92.9Very high19 Ų1959.8 Ų59.88%0.08330%0.299CS..Hα-helixtrans-62.2-28.7-173-63.4-50.8000114.2I17 I22 L65 D80 I81 F84 W91I17-F19 HydrophobicContact CG2-CD2 4.16Å; I17-F19 HydrophobicContact CG2-CE2 3.73Å; I17-F19 HydrophobicContact CG2-CZ 4.32Å; I17-F19 PolarHBondContact O-N 3.41Å; F19-I22 HydrophobicContact CD1-CD1 4.16Å; F19-I22 WeakPolarHBondContact O-CB 3.43Å; F19-I22 PolarHBondContact O-N 2.91Å; F19-L65 HydrophobicContact CE1-CD1 4.34Å; F19-L65 HydrophobicContact CE1-CD2 3.87Å; F19-L65 HydrophobicContact CZ-CD2 3.82Å; F19-D80 HydrophobicContact CD2-CB 4.29Å; F19-D80 HydrophobicContact CE2-CB 3.91Å; F19-I81 HydrophobicContact CE2-CG1 4.49Å; F19-I81 HydrophobicContact CZ-CG1 4.09Å; F19-F84 HydrophobicContact CB-CB 4.28Å; F19-F84 HydrophobicContact CB-CD2 3.96Å; F19-F84 HydrophobicContact CB-CG 4.49Å; F19-F84 HydrophobicContact CD1-CB 3.79Å; F19-F84 HydrophobicContact CD1-CD1 4.15Å; F19-F84 AromaticContact CD1-CD2 3.27Å; F19-F84 HydrophobicContact CD1-CD2 3.27Å; F19-F84 AromaticContact CD1-CE2 3.78Å; F19-F84 HydrophobicContact CD1-CE2 3.78Å; F19-F84 AromaticContact CD1-CG 3.48Å; F19-F84 HydrophobicContact CD1-CG 3.48Å; F19-F84 VanDerWaalsContact CD1-CG 3.48Å; F19-F84 HydrophobicContact CD1-CZ 4.4Å; F19-F84 HydrophobicContact CD2-CB 3.96Å; F19-F84 HydrophobicContact CE1-CB 4.03Å; F19-F84 AromaticContact CE1-CD1 3.93Å; F19-F84 HydrophobicContact CE1-CD1 3.93Å; F19-F84 AromaticContact CE1-CD2 3.91Å; F19-F84 HydrophobicContact CE1-CD2 3.91Å; F19-F84 HydrophobicContact CE1-CE1 4.33Å; F19-F84 HydrophobicContact CE1-CE2 4.31Å; F19-F84 AromaticContact CE1-CG 3.69Å; F19-F84 HydrophobicContact CE1-CG 3.69Å; F19-F84 HydrophobicContact CE2-CB 4.17Å; F19-F84 HydrophobicContact CG-CB 3.76Å; F19-F84 AromaticContact CG-CD2 3.79Å; F19-F84 HydrophobicContact CG-CD2 3.79Å; F19-F84 AromaticContact CG-CG 3.95Å; F19-F84 HydrophobicContact CG-CG 3.95Å; F19-F84 HydrophobicContact CZ-CB 4.22Å; F19-F84 HydrophobicContact CZ-CG 4.32Å; F19-W91 WeakPolarHBondContact O-CH2 3.44Å; F19-W91 WeakPolarHBondContact O-CZ3 3.45Å
20E88.4Confident93Very high166 Ų16658.1 Ų58.178%0.77629%0.288SS*.Hα-helixtrans-69.1-35.8179.1-59.8-171.6164.700112.7N18 I22 Q23N18-E20 VanDerWaalsContact C-N 3.27Å; N18-E20 PolarHBondContact O-N 3.2Å; E20-I22 PolarHBondContact O-N 3.31Å; E20-Q23 PolarHBondContact O-N 3.15Å
21E92.8Very high92.9Very high88 Ų8862.3 Ų62.341%0.41131%0.307SS..Hα-helixtrans-66.2-28.8177.9-70.1-165.2-15000112.2N13 N18 Q23 N24 F25N13-E21 PolarHBondContact OD1-OE2 3.5Å; N18-E21 PolarHBondContact O-N 3.49Å; E21-Q23 VanDerWaalsContact C-N 3.28Å; E21-Q23 PolarHBondContact O-N 3.44Å; E21-N24 WeakPolarHBondContact O-CA 3.31Å; E21-N24 WeakPolarHBondContact O-CB 3.43Å; E21-N24 PolarHBondContact O-N 2.9Å; E21-F25 HydrophobicContact CB-CD2 4.18Å; E21-F25 HydrophobicContact CB-CE2 3.99Å; E21-F25 WeakPolarHBondContact O-CD2 3.45Å; E21-F25 PolarHBondContact O-N 3.42Å
22I94.3Very high92.7Very high0 Ų063.4 Ų63.40%033%0.325CS..Hα-helixtrans-60.9-36.4-179.2-62.7177.7000111.5I10 N13 A14 F19 E20 N24 F25 L26 F84 W88I10-I22 HydrophobicContact CG1-CG2 4.42Å; I10-I22 HydrophobicContact CG2-CG2 4.17Å; N13-I22 HydrophobicContact CB-CD1 4.19Å; N13-I22 HydrophobicContact CB-CG1 3.73Å; A14-I22 HydrophobicContact CB-CD1 4.16Å; F19-I22 HydrophobicContact CD1-CD1 4.16Å; F19-I22 WeakPolarHBondContact O-CB 3.43Å; F19-I22 PolarHBondContact O-N 2.91Å; E20-I22 PolarHBondContact O-N 3.31Å; I22-N24 VanDerWaalsContact C-N 3.3Å; I22-N24 PolarHBondContact O-N 3.07Å; I22-F25 PolarHBondContact O-N 3.33Å; I22-L26 HydrophobicContact CG2-CD1 4.22Å; I22-L26 HydrophobicContact CG2-CG 4.49Å; I22-L26 WeakPolarHBondContact O-CG 3.45Å; I22-L26 PolarHBondContact O-N 3.5Å; I22-F84 HydrophobicContact CD1-CE2 3.72Å; I22-F84 HydrophobicContact CD1-CZ 4.35Å; I22-F84 HydrophobicContact CG2-CE2 4.4Å; I22-W88 HydrophobicContact CG2-CE3 4.4Å; I22-W88 HydrophobicContact CG2-CH2 4.46Å; I22-W88 HydrophobicContact CG2-CZ3 3.69Å
23Q94.4Very high92.6Very high69 Ų6961.4 Ų61.432%0.32231%0.314SS..Hα-helixtrans-59.1-43.3173-177.6178.3-4.300111.2E20 E21 L26 L27 W91E20-Q23 PolarHBondContact O-N 3.15Å; E21-Q23 VanDerWaalsContact C-N 3.28Å; E21-Q23 PolarHBondContact O-N 3.44Å; Q23-L26 PolarHBondContact O-N 3.45Å; Q23-L27 HydrophobicContact CG-CD1 4Å; Q23-L27 WeakPolarHBondContact O-CG 3.42Å; Q23-L27 PolarHBondContact O-N 2.94Å; Q23-W91 HydrophobicContact CB-CD2 3.85Å; Q23-W91 HydrophobicContact CB-CE3 4.33Å; Q23-W91 HydrophobicContact CB-CG 3.97Å; Q23-W91 HydrophobicContact CB-CZ2 4.39Å; Q23-W91 HydrophobicContact CG-CB 4.26Å; Q23-W91 HydrophobicContact CG-CD2 4.19Å; Q23-W91 HydrophobicContact CG-CG 3.79Å
24N94Very high92.5Very high101 Ų10163.3 Ų63.354%0.5433%0.327SS..Hα-helixtrans-68.2-39.8179.1-62.3-49.7000111.6E21 I22 L27 H28E21-N24 WeakPolarHBondContact O-CA 3.31Å; E21-N24 WeakPolarHBondContact O-CB 3.43Å; E21-N24 PolarHBondContact O-N 2.9Å; I22-N24 VanDerWaalsContact C-N 3.3Å; I22-N24 PolarHBondContact O-N 3.07Å; N24-L27 PolarHBondContact O-N 3.21Å; N24-H28 WeakPolarHBondContact O-CB 3.22Å; N24-H28 PolarHBondContact O-N 2.79Å
25F94.4Very high92.4Very high68 Ų6869.8 Ų69.830%0.29836%0.362SS..Hα-helixtrans-66.4-35.1175-76.3-67.9000113.3H6 C9 N13 E21 I22 F29H6-F25 PolarHBondContact CE1-O 3.05Å; H6-F25 VanDerWaalsContact CE1-O 3.3Å; C9-F25 HydrophobicContact CB-CD1 4.11Å; C9-F25 HydrophobicContact CB-CE1 4.24Å; C9-F25 HydrophobicContact CB-CG 4.42Å; N13-F25 WeakPolarHBondContact ND2-CE2 3.45Å; E21-F25 HydrophobicContact CB-CD2 4.18Å; E21-F25 HydrophobicContact CB-CE2 3.99Å; E21-F25 WeakPolarHBondContact O-CD2 3.45Å; E21-F25 PolarHBondContact O-N 3.42Å; I22-F25 PolarHBondContact O-N 3.33Å; F25-F29 VanDerWaalsContact O-CB 3.26Å; F25-F29 WeakPolarHBondContact O-CB 3.29Å; F25-F29 PolarHBondContact O-N 3.3Å; F25-F29 VanDerWaalsContact O-N 3.13Å
26L95.6Very high92.4Very high2 Ų272.5 Ų72.51%0.0137%0.372CS..Hα-helixtrans-64.3-54.1172.1-74169.1000111.1I10 I22 Q23 F29 W30 W88 W91 L92I10-L26 HydrophobicContact CD1-CD2 4Å; I22-L26 HydrophobicContact CG2-CD1 4.22Å; I22-L26 HydrophobicContact CG2-CG 4.49Å; I22-L26 WeakPolarHBondContact O-CG 3.45Å; I22-L26 PolarHBondContact O-N 3.5Å; Q23-L26 PolarHBondContact O-N 3.45Å; L26-F29 PolarHBondContact O-N 3.31Å; L26-W30 VanDerWaalsContact O-CD1 3.32Å; L26-W30 PolarHBondContact O-N 3.39Å; L26-W30 VanDerWaalsContact O-N 3.15Å; L26-W88 HydrophobicContact CD1-CH2 4.42Å; L26-W88 HydrophobicContact CD1-CZ3 4.5Å; L26-W91 HydrophobicContact CD1-CB 3.98Å; L26-L92 HydrophobicContact CD2-CD1 4.01Å
27L94.8Very high92.5Very high57 Ų5768.8 Ų68.830%0.29835%0.352SS..Hα-helixtrans-58.3-52.3179-75.4163.8000112Q23 N24 F29 W30 Q31Q23-L27 HydrophobicContact CG-CD1 4Å; Q23-L27 WeakPolarHBondContact O-CG 3.42Å; Q23-L27 PolarHBondContact O-N 2.94Å; N24-L27 PolarHBondContact O-N 3.21Å; L27-F29 VanDerWaalsContact C-N 3.31Å; L27-F29 PolarHBondContact O-N 3.45Å; L27-W30 PolarHBondContact O-N 3.3Å; L27-Q31 VanDerWaalsContact O-CB 3.3Å; L27-Q31 WeakPolarHBondContact O-CB 3.4Å; L27-Q31 PolarHBondContact O-N 3.04Å
28H94.1Very high92.6Very high151 Ų15167.4 Ų67.470%0.69935%0.345SS*.Hα-helixtrans-62.7-35.9-178.4-176.9-64.4000112.4N24 G32N24-H28 WeakPolarHBondContact O-CB 3.22Å; N24-H28 PolarHBondContact O-N 2.79Å; H28-G32 VanDerWaalsContact O-CA 3.3Å; H28-G32 WeakPolarHBondContact O-CA 3.28Å; H28-G32 PolarHBondContact O-N 3.3Å
29F95.4Very high92.6Very high33 Ų3367.9 Ų67.915%0.14535%0.352CS..Hα-helixtrans-69.8-50.5178.6-178.4-96.7000112M2 Y3 H6 F25 L26 L27 M33M2-F29 HydrophobicContact CB-CE2 4.34Å; Y3-F29 AromaticContact CD2-CE1 3.59Å; Y3-F29 HydrophobicContact CD2-CE1 3.59Å; Y3-F29 AromaticContact CD2-CZ 3.64Å; Y3-F29 HydrophobicContact CD2-CZ 3.64Å; Y3-F29 HydrophobicContact CE2-CD1 4.44Å; Y3-F29 AromaticContact CE2-CE1 3.76Å; Y3-F29 HydrophobicContact CE2-CE1 3.76Å; Y3-F29 HydrophobicContact CE2-CZ 4.29Å; H6-F29 HydrophobicContact CB-CD1 4.42Å; H6-F29 HydrophobicContact CB-CD2 3.6Å; H6-F29 HydrophobicContact CB-CE2 3.89Å; H6-F29 HydrophobicContact CB-CG 3.9Å; H6-F29 HydrophobicContact CB-CZ 4.44Å; H6-F29 AromaticContact CD2-CD1 3.57Å; H6-F29 AromaticContact CD2-CG 3.71Å; H6-F29 VanDerWaalsContact CE1-CB 3.47Å; H6-F29 WeakPolarHBondContact CE1-CB 3.35Å; H6-F29 AromaticContact CE1-CG 3.87Å; H6-F29 AromaticContact CG-CD1 3.83Å; H6-F29 AromaticContact CG-CD2 3.73Å; H6-F29 AromaticContact CG-CG 3.46Å; H6-F29 VanDerWaalsContact CG-CG 3.46Å; H6-F29 WeakPolarHBondContact ND1-CB 3.48Å; H6-F29 AromaticContact ND1-CG 3.58Å; H6-F29 AromaticContact NE2-CD1 3.79Å; H6-F29 AromaticContact NE2-CG 3.96Å; F25-F29 VanDerWaalsContact O-CB 3.26Å; F25-F29 WeakPolarHBondContact O-CB 3.29Å; F25-F29 PolarHBondContact O-N 3.3Å; F25-F29 VanDerWaalsContact O-N 3.13Å; L26-F29 PolarHBondContact O-N 3.31Å; L27-F29 VanDerWaalsContact C-N 3.31Å; L27-F29 PolarHBondContact O-N 3.45Å; F29-M33 HydrophobicContact CE1-SD 4.24Å; F29-M33 HydrophobicContact CZ-SD 4.02Å; F29-M33 WeakPolarHBondContact O-CG 3.43Å
30W95.4Very high92.6Very high1 Ų170.8 Ų70.80%0.00437%0.368CS..Hα-helixtrans-79.6-43.2-172.2-70.8113000113.4Y3 H6 L26 L27 G32 M33 L41 F50 S95 L96 L99 L103 K107Y3-W30 HydrophobicContact CD2-CH2 4.43Å; Y3-W30 HydrophobicContact CD2-CZ2 4.48Å; Y3-W30 AromaticContact CE2-CH2 3.68Å; Y3-W30 HydrophobicContact CE2-CH2 3.68Å; Y3-W30 AromaticContact CE2-CZ2 3.42Å; Y3-W30 HydrophobicContact CE2-CZ2 3.42Å; Y3-W30 VanDerWaalsContact CE2-CZ2 3.42Å; Y3-W30 AromaticContact CZ-CZ2 3.99Å; H6-W30 AromaticContact NE2-NE1 3.83Å; L26-W30 VanDerWaalsContact O-CD1 3.32Å; L26-W30 PolarHBondContact O-N 3.39Å; L26-W30 VanDerWaalsContact O-N 3.15Å; L27-W30 PolarHBondContact O-N 3.3Å; W30-G32 VanDerWaalsContact C-N 3.29Å; W30-M33 WeakPolarHBondContact O-CB 3.33Å; W30-M33 WeakPolarHBondContact O-CG 3.42Å; W30-M33 PolarHBondContact O-N 3.48Å; W30-L41 HydrophobicContact CZ3-CD2 4.27Å; W30-F50 HydrophobicContact CH2-CD2 4.18Å; W30-F50 HydrophobicContact CH2-CE2 4.31Å; W30-F50 HydrophobicContact CH2-CG 4.36Å; W30-F50 HydrophobicContact CZ3-CE2 4.5Å; W30-S95 WeakPolarHBondContact CB-O 3.41Å; W30-L96 HydrophobicContact CB-CD2 4.38Å; W30-L96 HydrophobicContact CD2-CD2 3.56Å; W30-L96 HydrophobicContact CE3-CD2 3.93Å; W30-L96 HydrophobicContact CG-CD2 3.77Å; W30-L96 HydrophobicContact CZ2-CD2 4.39Å; W30-L96 HydrophobicContact CZ3-CD2 4.49Å; W30-L99 HydrophobicContact CB-CD1 3.95Å; W30-L99 HydrophobicContact CD2-CD1 4.34Å; W30-L99 HydrophobicContact CE3-CD1 3.77Å; W30-L99 HydrophobicContact CG-CD1 4.46Å; W30-L103 HydrophobicContact CE3-CD2 4.05Å; W30-L103 HydrophobicContact CH2-CD1 4.23Å; W30-L103 HydrophobicContact CH2-CD2 4.34Å; W30-L103 HydrophobicContact CZ3-CD1 4.31Å; W30-L103 HydrophobicContact CZ3-CD2 3.71Å; W30-K107 HydrophobicContact CH2-CD 4.24Å; W30-K107 HydrophobicContact CZ2-CD 4.09Å
31Q94.2Very high92.7Very high90 Ų9062.9 Ų62.942%0.42133%0.331SS..Hα-helixtrans-77-17.6175.5-57.6-62.8-62.200112.4L27 S95 E97L27-Q31 VanDerWaalsContact O-CB 3.3Å; L27-Q31 WeakPolarHBondContact O-CB 3.4Å; L27-Q31 PolarHBondContact O-N 3.04Å; Q31-S95 PolarHBondContact NE2-O 3.31Å; Q31-E97 PolarHBondContact NE2-O 3.36Å
32G91.6Very high92.6Very high50 Ų5065 Ų6552%0.51534%0.341SS..THydrogen-bonded Turntrans-89.58.5173.900000114.8H28 W30 P34H28-G32 VanDerWaalsContact O-CA 3.3Å; H28-G32 WeakPolarHBondContact O-CA 3.28Å; H28-G32 PolarHBondContact O-N 3.3Å; W30-G32 VanDerWaalsContact C-N 3.29Å; G32-P34 WeakPolarHBondContact O-CD 3.45Å
33M90.3Very high92.5Very high25 Ų2568.1 Ų68.112%0.12336%0.358CS..  trans-65.8121.1178.4-80.3-64.6-6600111.4F29 W30 L37 L38 L41F29-M33 HydrophobicContact CE1-SD 4.24Å; F29-M33 HydrophobicContact CZ-SD 4.02Å; F29-M33 WeakPolarHBondContact O-CG 3.43Å; W30-M33 WeakPolarHBondContact O-CB 3.33Å; W30-M33 WeakPolarHBondContact O-CG 3.42Å; W30-M33 PolarHBondContact O-N 3.48Å; M33-L37 HydrophobicContact CE-CB 3.76Å; M33-L37 HydrophobicContact CE-CD1 4.18Å; M33-L38 HydrophobicContact CB-CD2 3.91Å; M33-L41 HydrophobicContact CE-CD2 4.37Å
34P91.4Very high92.3Very high56 Ų5668.5 Ų68.536%0.36437%0.366SS..  trans-59.4138.5177.2-2634.5000113.5G32 H36 L37G32-P34 WeakPolarHBondContact O-CD 3.45Å; P34-H36 VanDerWaalsContact CB-CE1 3.45Å; P34-H36 WeakPolarHBondContact CB-CE1 3.44Å; P34-H36 PolarHBondContact O-N 3.03Å; P34-L37 HydrophobicContact CG-CD1 4.35Å; P34-L37 WeakPolarHBondContact O-CB 3.47Å; P34-L37 PolarHBondContact O-N 2.89Å
35D89.8Confident92.1Very high137 Ų13767.1 Ų67.173%0.73336%0.358SS*.G310 helixtrans-48.1-42-174.7-52.4-43.4000114.1L37 L38 P39D35-L37 PolarHBondContact O-N 3.33Å; D35-L37 VanDerWaalsContact O-N 3.1Å; D35-L38 WeakPolarHBondContact O-CB 3.3Å; D35-L38 PolarHBondContact O-N 2.93Å; D35-L38 VanDerWaalsContact O-N 3.09Å; D35-P39 WeakPolarHBondContact O-CD 3.22Å
36H91.1Very high92Very high148 Ų14866.1 Ų66.169%0.68536%0.355SS*.G310 helixtrans-67.5-8-178.868.7-90.8000114.3P34P34-H36 VanDerWaalsContact CB-CE1 3.45Å; P34-H36 WeakPolarHBondContact CB-CE1 3.44Å; P34-H36 PolarHBondContact O-N 3.03Å
37L89.9Confident91.9Very high30 Ų3066 Ų6616%0.15736%0.355CS..G310 helixtrans-105.6-13.4174.8-55.4-178.4000112.8M2 M33 P34 D35 L40M2-L37 HydrophobicContact CE-CD1 3.64Å; M33-L37 HydrophobicContact CE-CB 3.76Å; M33-L37 HydrophobicContact CE-CD1 4.18Å; P34-L37 HydrophobicContact CG-CD1 4.35Å; P34-L37 WeakPolarHBondContact O-CB 3.47Å; P34-L37 PolarHBondContact O-N 2.89Å; D35-L37 PolarHBondContact O-N 3.33Å; D35-L37 VanDerWaalsContact O-N 3.1Å; L37-L40 HydrophobicContact CB-CD1 4.39Å; L37-L40 HydrophobicContact CD2-CD1 3.8Å; L37-L40 VanDerWaalsContact O-CB 3.25Å; L37-L40 WeakPolarHBondContact O-CB 3.4Å; L37-L40 PolarHBondContact O-N 3.26Å
38L90.4Very high91.8Very high53 Ų5364.1 Ų64.128%0.27735%0.345SS..G310 helixtrans-58-40178.2-59.6176.9000112.9M33 D35 L40 L41 L99M33-L38 HydrophobicContact CB-CD2 3.91Å; D35-L38 WeakPolarHBondContact O-CB 3.3Å; D35-L38 PolarHBondContact O-N 2.93Å; D35-L38 VanDerWaalsContact O-N 3.09Å; L38-L40 PolarHBondContact O-N 3.31Å; L38-L40 VanDerWaalsContact O-N 3.1Å; L38-L41 HydrophobicContact CD2-CD1 3.93Å; L38-L41 VanDerWaalsContact O-CB 3.29Å; L38-L41 WeakPolarHBondContact O-CB 3.24Å; L38-L41 PolarHBondContact O-N 3.02Å; L38-L99 HydrophobicContact CD2-CD2 3.77Å
39P91.9Very high91.7Very high82 Ų8260.1 Ų60.153%0.53233%0.328SS..G310 helixtrans-62.7-16.9174.6-24.335.6000114.7D35 L41D35-P39 WeakPolarHBondContact O-CD 3.22Å; P39-L41 VanDerWaalsContact C-N 3.3Å
40L90.6Very high91.6Very high79 Ų7959.9 Ų59.941%0.41433%0.327SS..G310 helixtrans-75.2-22.3173.7-56.6178.1000112L37 L38 E42 N43 I46L37-L40 HydrophobicContact CB-CD1 4.39Å; L37-L40 HydrophobicContact CD2-CD1 3.8Å; L37-L40 VanDerWaalsContact O-CB 3.25Å; L37-L40 WeakPolarHBondContact O-CB 3.4Å; L37-L40 PolarHBondContact O-N 3.26Å; L38-L40 PolarHBondContact O-N 3.31Å; L38-L40 VanDerWaalsContact O-N 3.1Å; L40-E42 VanDerWaalsContact C-N 3.28Å; L40-N43 WeakPolarHBondContact O-CB 3.48Å; L40-N43 PolarHBondContact O-N 3.45Å; L40-I46 HydrophobicContact CB-CD1 3.85Å; L40-I46 HydrophobicContact CD2-CD1 4.06Å; L40-I46 HydrophobicContact CG-CD1 4.45Å; L40-I46 WeakPolarHBondContact O-CB 3.44Å
41L91Very high91.6Very high1 Ų159.9 Ų59.91%0.00533%0.327CS..THydrogen-bonded Turntrans-75.5-18.4178.8-53.4-179.9000112.4W30 M33 L38 P39 V47 F50 L99 P100 L103W30-L41 HydrophobicContact CZ3-CD2 4.27Å; M33-L41 HydrophobicContact CE-CD2 4.37Å; L38-L41 HydrophobicContact CD2-CD1 3.93Å; L38-L41 VanDerWaalsContact O-CB 3.29Å; L38-L41 WeakPolarHBondContact O-CB 3.24Å; L38-L41 PolarHBondContact O-N 3.02Å; P39-L41 VanDerWaalsContact C-N 3.3Å; L41-V47 WeakPolarHBondContact O-CG2 3.29Å; L41-F50 HydrophobicContact CD2-CE2 3.68Å; L41-F50 HydrophobicContact CD2-CZ 4.27Å; L41-L99 HydrophobicContact CD1-CD1 4.29Å; L41-L99 HydrophobicContact CD1-CD2 4.03Å; L41-P100 HydrophobicContact CB-CG 4.11Å; L41-L103 HydrophobicContact CB-CD2 4.42Å; L41-L103 HydrophobicContact CD1-CD2 4.13Å; L41-L103 HydrophobicContact CD2-CD2 4.35Å
42E90.8Very high91.6Very high132 Ų13256 Ų5662%0.61731%0.31SS*.THydrogen-bonded Turntrans-78.2-20.5171.2-62.6-179.5-17200112.6L40 P44 P100L40-E42 VanDerWaalsContact C-N 3.28Å; E42-P44 WeakPolarHBondContact O-CD 3.1Å; E42-P100 HydrophobicContact CG-CB 4.17Å; E42-P100 HydrophobicContact CG-CG 3.96Å
43N91.9Very high91.7Very high66 Ų6655.7 Ų55.735%0.35330%0.299SS..  trans-74.7116.7-177.5-174.8-37.7000110.4L40 I45 I46 V47L40-N43 WeakPolarHBondContact O-CB 3.48Å; L40-N43 PolarHBondContact O-N 3.45Å; N43-I45 PolarHBondContact O-N 3.14Å; N43-I45 VanDerWaalsContact O-N 3.15Å; N43-I45 WeakPolarHBondContact OD1-CB 3.27Å; N43-I45 PolarHBondContact OD1-N 3.25Å; N43-I46 HydrophobicContact CB-CB 4.26Å; N43-I46 HydrophobicContact CB-CD1 4Å; N43-I46 HydrophobicContact CB-CG1 4.06Å; N43-I46 PolarHBondContact O-N 2.69Å; N43-V47 PolarHBondContact O-N 3.17Å; N43-V47 VanDerWaalsContact O-N 3.12Å
44P89.4Confident92Very high77 Ų7754.6 Ų54.650%0.529%0.294SS..Hα-helixtrans-61-32.6-17324-34.1000112.9E42 I46 V47 D48E42-P44 WeakPolarHBondContact O-CD 3.1Å; P44-I46 VanDerWaalsContact C-N 3.33Å; P44-I46 PolarHBondContact O-N 2.72Å; P44-V47 PolarHBondContact O-N 3.3Å; P44-D48 WeakPolarHBondContact O-CB 3.43Å; P44-D48 VanDerWaalsContact O-CG 3.25Å; P44-D48 PolarHBondContact O-N 3.46Å
45I91.2Very high92.1Very high72 Ų7252.7 Ų52.737%0.36928%0.282SS..Hα-helixtrans-65.8-38.7178.8-54-177.8000110.6N43 D48 I49 Y290N43-I45 PolarHBondContact O-N 3.14Å; N43-I45 VanDerWaalsContact O-N 3.15Å; N43-I45 WeakPolarHBondContact OD1-CB 3.27Å; N43-I45 PolarHBondContact OD1-N 3.25Å; I45-D48 PolarHBondContact O-N 3.49Å; I45-I49 HydrophobicContact CG2-CD1 4.1Å; I45-I49 WeakPolarHBondContact O-CD1 3.5Å; I45-I49 VanDerWaalsContact O-CG1 3.26Å; I45-I49 WeakPolarHBondContact O-CG1 3.33Å; I45-I49 PolarHBondContact O-N 3.37Å; I45-Y290 HydrophobicContact CB-CE1 4.27Å; I45-Y290 HydrophobicContact CD1-CD1 4.27Å; I45-Y290 HydrophobicContact CD1-CE1 4.1Å; I45-Y290 HydrophobicContact CG1-CD1 4.27Å; I45-Y290 HydrophobicContact CG1-CE1 3.72Å; I45-Y290 HydrophobicContact CG2-CD1 3.87Å; I45-Y290 HydrophobicContact CG2-CD2 3.89Å; I45-Y290 HydrophobicContact CG2-CE1 3.95Å; I45-Y290 HydrophobicContact CG2-CE2 3.96Å; I45-Y290 HydrophobicContact CG2-CG 3.86Å
46I91.5Very high92.2Very high46 Ų4650.6 Ų50.624%0.23627%0.269CS..Hα-helixtrans-72.5-40.2-180-61.5-178.2000110L40 N43 P44 I49 F50L40-I46 HydrophobicContact CB-CD1 3.85Å; L40-I46 HydrophobicContact CD2-CD1 4.06Å; L40-I46 HydrophobicContact CG-CD1 4.45Å; L40-I46 WeakPolarHBondContact O-CB 3.44Å; N43-I46 HydrophobicContact CB-CB 4.26Å; N43-I46 HydrophobicContact CB-CD1 4Å; N43-I46 HydrophobicContact CB-CG1 4.06Å; N43-I46 PolarHBondContact O-N 2.69Å; P44-I46 VanDerWaalsContact C-N 3.33Å; P44-I46 PolarHBondContact O-N 2.72Å; I46-I49 PolarHBondContact O-N 3.13Å; I46-F50 HydrophobicContact CG2-CD2 4.32Å; I46-F50 HydrophobicContact CG2-CE2 3.68Å; I46-F50 HydrophobicContact CG2-CZ 3.96Å; I46-F50 WeakPolarHBondContact O-CD2 3.37Å; I46-F50 PolarHBondContact O-N 3.45Å
47V93.1Very high92.4Very high1 Ų144.1 Ų44.11%0.00624%0.24CC..Hα-helixtrans-60.6-45.6171.5-177.20000111.3L41 N43 P44 I49 F50 C51 L103 K106L41-V47 WeakPolarHBondContact O-CG2 3.29Å; N43-V47 PolarHBondContact O-N 3.17Å; N43-V47 VanDerWaalsContact O-N 3.12Å; P44-V47 PolarHBondContact O-N 3.3Å; V47-I49 VanDerWaalsContact C-N 3.31Å; V47-I49 PolarHBondContact O-N 3.06Å; V47-F50 WeakPolarHBondContact O-CB 3.37Å; V47-F50 PolarHBondContact O-N 3.17Å; V47-F50 VanDerWaalsContact O-N 3.13Å; V47-C51 PolarHBondContact O-N 3.5Å; V47-C51 PolarHBondContact O-SG 3.24Å; V47-C51 VanDerWaalsContact O-SG 3.32Å; V47-L103 HydrophobicContact CG1-CD1 4.13Å; V47-L103 HydrophobicContact CG2-CD1 4.18Å; V47-K106 HydrophobicContact CB-CD 4.33Å; V47-K106 HydrophobicContact CG1-CB 3.77Å; V47-K106 HydrophobicContact CG1-CD 3.6Å; V47-K106 HydrophobicContact CG1-CG 4.2Å
48D92.3Very high92.7Very high16 Ų1643.2 Ų43.29%0.08623%0.234CC..Hα-helixtrans-64.8-33.8178.5-72.4-39.4000112.3P44 I45 C51 V52 K106 L286 Y290P44-D48 WeakPolarHBondContact O-CB 3.43Å; P44-D48 VanDerWaalsContact O-CG 3.25Å; P44-D48 PolarHBondContact O-N 3.46Å; I45-D48 PolarHBondContact O-N 3.49Å; D48-C51 WeakPolarHBondContact O-CB 3.35Å; D48-C51 PolarHBondContact O-N 2.87Å; D48-V52 VanDerWaalsContact O-CG2 3.32Å; D48-V52 WeakPolarHBondContact O-CG2 3.32Å; D48-V52 PolarHBondContact O-N 3.26Å; D48-K106 WeakPolarHBondContact OD1-CD 3.37Å; D48-K106 WeakPolarHBondContact OD1-CE 3.46Å; D48-K106 IonicContact OD1-NZ 2.65Å; D48-K106 PolarHBondContact OD1-NZ 2.87Å; D48-K106 IonicContact OD2-NZ 2.83Å; D48-K106 PolarHBondContact OD2-NZ 3.49Å; D48-L286 HydrophobicContact CB-CD2 3.9Å; D48-Y290 HydrophobicContact CB-CE2 3.87Å; D48-Y290 PolarHBondContact OD2-OH 3.32Å; D48-Y290 VanDerWaalsContact OD2-OH 3.05Å
49I92.5Very high92.7Very high68 Ų6844.4 Ų44.435%0.34924%0.237SC..Hα-helixtrans-65-42.2171.2-71.6163.8000111.5I45 I46 V47 C51 V52 C53 L287I45-I49 HydrophobicContact CG2-CD1 4.1Å; I45-I49 WeakPolarHBondContact O-CD1 3.5Å; I45-I49 VanDerWaalsContact O-CG1 3.26Å; I45-I49 WeakPolarHBondContact O-CG1 3.33Å; I45-I49 PolarHBondContact O-N 3.37Å; I46-I49 PolarHBondContact O-N 3.13Å; V47-I49 VanDerWaalsContact C-N 3.31Å; V47-I49 PolarHBondContact O-N 3.06Å; I49-C51 VanDerWaalsContact C-N 3.32Å; I49-C51 PolarHBondContact O-N 3.22Å; I49-V52 PolarHBondContact O-N 3.11Å; I49-C53 PolarHBondContact O-N 3.26Å; I49-C53 PolarHBondContact O-SG 3.46Å; I49-L287 HydrophobicContact CG1-CD1 4.29Å
50F94.3Very high92.7Very high27 Ų2743.2 Ų43.212%0.11823%0.228CC..Hα-helixtrans-61.1-41.9172.9-65.1-46.4000111.6Y3 W30 L41 I46 V47 V52 C53 D54 L103Y3-F50 AromaticContact CD1-CD1 3.69Å; Y3-F50 HydrophobicContact CD1-CD1 3.69Å; Y3-F50 HydrophobicContact CD1-CE1 4.23Å; Y3-F50 AromaticContact CD2-CD1 3.59Å; Y3-F50 HydrophobicContact CD2-CD1 3.59Å; Y3-F50 AromaticContact CD2-CE1 3.55Å; Y3-F50 HydrophobicContact CD2-CE1 3.55Å; Y3-F50 HydrophobicContact CE1-CB 4.4Å; Y3-F50 AromaticContact CE1-CD1 3.85Å; Y3-F50 HydrophobicContact CE1-CD1 3.85Å; Y3-F50 AromaticContact CE2-CD1 3.79Å; Y3-F50 HydrophobicContact CE2-CD1 3.79Å; Y3-F50 HydrophobicContact CE2-CE1 4.13Å; Y3-F50 HydrophobicContact CE2-CG 4.46Å; Y3-F50 AromaticContact CG-CD1 3.55Å; Y3-F50 HydrophobicContact CG-CD1 3.55Å; Y3-F50 AromaticContact CG-CE1 3.62Å; Y3-F50 HydrophobicContact CG-CE1 3.62Å; Y3-F50 AromaticContact CZ-CD1 3.91Å; W30-F50 HydrophobicContact CH2-CD2 4.18Å; W30-F50 HydrophobicContact CH2-CE2 4.31Å; W30-F50 HydrophobicContact CH2-CG 4.36Å; W30-F50 HydrophobicContact CZ3-CE2 4.5Å; L41-F50 HydrophobicContact CD2-CE2 3.68Å; L41-F50 HydrophobicContact CD2-CZ 4.27Å; I46-F50 HydrophobicContact CG2-CD2 4.32Å; I46-F50 HydrophobicContact CG2-CE2 3.68Å; I46-F50 HydrophobicContact CG2-CZ 3.96Å; I46-F50 WeakPolarHBondContact O-CD2 3.37Å; I46-F50 PolarHBondContact O-N 3.45Å; V47-F50 WeakPolarHBondContact O-CB 3.37Å; V47-F50 PolarHBondContact O-N 3.17Å; V47-F50 VanDerWaalsContact O-N 3.13Å; F50-V52 VanDerWaalsContact C-N 3.34Å; F50-V52 PolarHBondContact O-N 2.99Å; F50-C53 PolarHBondContact O-N 3.21Å; F50-D54 PolarHBondContact O-N 2.67Å; F50-L103 HydrophobicContact CD2-CD1 3.98Å
51C94.6Very high92.9Very high2 Ų239.4 Ų39.41%0.01421%0.209CC..Hα-helixtrans-60.8-37.4176.4-730000113.5V47 D48 I49 S55 I110 L283V47-C51 PolarHBondContact O-N 3.5Å; V47-C51 PolarHBondContact O-SG 3.24Å; V47-C51 VanDerWaalsContact O-SG 3.32Å; D48-C51 WeakPolarHBondContact O-CB 3.35Å; D48-C51 PolarHBondContact O-N 2.87Å; I49-C51 VanDerWaalsContact C-N 3.32Å; I49-C51 PolarHBondContact O-N 3.22Å; C51-S55 PolarHBondContact O-N 3.41Å; C51-I110 HydrophobicContact CB-CD1 3.32Å; C51-I110 VanDerWaalsContact SG-CD1 3.54Å; C51-L283 HydrophobicContact CB-CD2 4.25Å
52V93.4Very high92.8Very high8 Ų840 Ų405%0.04821%0.212CC..Hα-helixtrans-68.8-42.5173177.10000111.1D48 I49 F50 D54 S55 I56 L283 L287D48-V52 VanDerWaalsContact O-CG2 3.32Å; D48-V52 WeakPolarHBondContact O-CG2 3.32Å; D48-V52 PolarHBondContact O-N 3.26Å; I49-V52 PolarHBondContact O-N 3.11Å; F50-V52 VanDerWaalsContact C-N 3.34Å; F50-V52 PolarHBondContact O-N 2.99Å; V52-D54 VanDerWaalsContact C-N 3.34Å; V52-D54 PolarHBondContact O-N 2.56Å; V52-S55 PolarHBondContact O-N 3.32Å; V52-I56 HydrophobicContact CG1-CD1 4.05Å; V52-I56 WeakPolarHBondContact O-CG1 3.31Å; V52-I56 PolarHBondContact O-N 2.93Å; V52-I56 VanDerWaalsContact O-N 3.09Å; V52-L283 HydrophobicContact CG2-CB 4.01Å; V52-L283 WeakPolarHBondContact CG2-O 3.44Å; V52-L287 HydrophobicContact CG1-CD2 3.95Å; V52-L287 HydrophobicContact CG2-CB 4.21Å
53C94.4Very high92.7Very high44 Ų4438.6 Ų38.630%0.29721%0.209SC..Hα-helixtrans-63.6-39.1177-65.40000112.2Y3 I49 F50 I56 L57Y3-C53 HydrophobicContact CD1-CB 3.77Å; Y3-C53 HydrophobicContact CE1-CB 3.63Å; I49-C53 PolarHBondContact O-N 3.26Å; I49-C53 PolarHBondContact O-SG 3.46Å; F50-C53 PolarHBondContact O-N 3.21Å; C53-I56 PolarHBondContact O-N 3.37Å; C53-L57 WeakPolarHBondContact O-CB 3.41Å; C53-L57 PolarHBondContact O-N 3.36Å
54D95.6Very high92.6Very high2 Ų238.3 Ų38.31%0.01121%0.209CC..Hα-helixtrans-60.4-48.3172-68.1-17.9000111Y3 F50 V52 I56 L57 Y58 K107 I110Y3-D54 PolarHBondContact OH-OD1 3.48Å; F50-D54 PolarHBondContact O-N 2.67Å; V52-D54 VanDerWaalsContact C-N 3.34Å; V52-D54 PolarHBondContact O-N 2.56Å; D54-I56 VanDerWaalsContact C-N 3.26Å; D54-I56 PolarHBondContact O-N 3.14Å; D54-L57 PolarHBondContact O-N 3.12Å; D54-L57 VanDerWaalsContact O-N 3.17Å; D54-Y58 HydrophobicContact CB-CD2 4.38Å; D54-Y58 HydrophobicContact CB-CE1 4.41Å; D54-Y58 HydrophobicContact CB-CE2 3.87Å; D54-Y58 WeakPolarHBondContact O-CB 3.42Å; D54-Y58 WeakPolarHBondContact O-CD1 3.39Å; D54-Y58 WeakPolarHBondContact O-CD2 3.49Å; D54-Y58 PolarHBondContact O-N 3.06Å; D54-K107 IonicContact OD1-NZ 2.71Å; D54-K107 PolarHBondContact OD1-NZ 3.26Å; D54-K107 IonicContact OD2-NZ 2.71Å; D54-K107 PolarHBondContact OD2-NZ 3.5Å; D54-I110 HydrophobicContact CB-CG2 4.34Å
55S94.1Very high92.6Very high15 Ų1535 Ų3511%0.10519%0.188CC..Hα-helixtrans-60.1-37.2-179-1570000112.2C51 V52 K59C51-S55 PolarHBondContact O-N 3.41Å; V52-S55 PolarHBondContact O-N 3.32Å; S55-K59 WeakPolarHBondContact O-CB 3.44Å; S55-K59 PolarHBondContact O-N 2.64Å
56I92.9Very high92.3Very high93 Ų9332.5 Ų32.548%0.47718%0.175SC..Hα-helixtrans-70.3-46.9174.7-64.2164.6000110.9V52 C53 D54 Y58 K59 V60V52-I56 HydrophobicContact CG1-CD1 4.05Å; V52-I56 WeakPolarHBondContact O-CG1 3.31Å; V52-I56 PolarHBondContact O-N 2.93Å; V52-I56 VanDerWaalsContact O-N 3.09Å; C53-I56 PolarHBondContact O-N 3.37Å; D54-I56 VanDerWaalsContact C-N 3.26Å; D54-I56 PolarHBondContact O-N 3.14Å; I56-Y58 VanDerWaalsContact C-N 3.35Å; I56-Y58 PolarHBondContact O-N 3.23Å; I56-K59 PolarHBondContact O-N 2.69Å; I56-V60 WeakPolarHBondContact O-CG2 3.14Å; I56-V60 PolarHBondContact O-N 3.26Å; I56-V60 VanDerWaalsContact O-N 3.11Å
57L95.3Very high91.4Very high12 Ų1233.2 Ų33.26%0.06318%0.182CC..Hα-helixtrans-58.1-46.7177.6172.762.2000111.4C7 I10 L11 C53 D54 K59 V60 L61C7-L57 HydrophobicContact CB-CD1 4.27Å; C7-L57 HydrophobicContact CB-CD2 4Å; C7-L57 WeakPolarHBondContact O-CD1 3.35Å; I10-L57 HydrophobicContact CB-CD2 4.34Å; I10-L57 HydrophobicContact CD1-CD2 4.08Å; I10-L57 HydrophobicContact CG2-CD1 4.49Å; I10-L57 HydrophobicContact CG2-CD2 4.21Å; L11-L57 HydrophobicContact CB-CD1 4.1Å; C53-L57 WeakPolarHBondContact O-CB 3.41Å; C53-L57 PolarHBondContact O-N 3.36Å; D54-L57 PolarHBondContact O-N 3.12Å; D54-L57 VanDerWaalsContact O-N 3.17Å; L57-K59 VanDerWaalsContact C-N 3.34Å; L57-K59 PolarHBondContact O-N 3.41Å; L57-V60 PolarHBondContact O-N 2.94Å; L57-L61 HydrophobicContact CD1-CD1 4.09Å; L57-L61 HydrophobicContact CD1-CG 4.07Å; L57-L61 HydrophobicContact CG-CD1 3.93Å; L57-L61 HydrophobicContact CG-CG 4.35Å; L57-L61 WeakPolarHBondContact O-CB 3.32Å; L57-L61 VanDerWaalsContact O-CG 3.3Å; L57-L61 WeakPolarHBondContact O-CG 3.32Å; L57-L61 PolarHBondContact O-N 3.24Å
58Y94.9Very high90.1Very high11 Ų1138.1 Ų38.14%0.04322%0.223CC..Hα-helixtrans-67.5-34.5-176.9-64.8-7.4000112.4D54 I56 L61 T62 W88 I110 A111 F114D54-Y58 HydrophobicContact CB-CD2 4.38Å; D54-Y58 HydrophobicContact CB-CE1 4.41Å; D54-Y58 HydrophobicContact CB-CE2 3.87Å; D54-Y58 WeakPolarHBondContact O-CB 3.42Å; D54-Y58 WeakPolarHBondContact O-CD1 3.39Å; D54-Y58 WeakPolarHBondContact O-CD2 3.49Å; D54-Y58 PolarHBondContact O-N 3.06Å; I56-Y58 VanDerWaalsContact C-N 3.35Å; I56-Y58 PolarHBondContact O-N 3.23Å; Y58-L61 HydrophobicContact CD1-CD1 4.23Å; Y58-T62 PolarHBondContact O-N 3.44Å; Y58-T62 PolarHBondContact O-OG1 3Å; Y58-W88 HydrophobicContact CD1-CZ2 4.33Å; Y58-W88 HydrophobicContact CE1-CH2 4.07Å; Y58-W88 AromaticContact CE1-CZ2 3.38Å; Y58-W88 HydrophobicContact CE1-CZ2 3.38Å; Y58-W88 AromaticContact CZ-CZ2 3.77Å; Y58-I110 HydrophobicContact CD2-CG2 3.91Å; Y58-I110 HydrophobicContact CE2-CB 4.41Å; Y58-I110 HydrophobicContact CE2-CG2 3.88Å; Y58-A111 HydrophobicContact CE2-CB 4.19Å; Y58-F114 HydrophobicContact CD1-CD1 4.07Å; Y58-F114 HydrophobicContact CD1-CE1 4.35Å; Y58-F114 HydrophobicContact CD1-CG 4.22Å; Y58-F114 HydrophobicContact CD2-CB 3.51Å; Y58-F114 HydrophobicContact CD2-CD1 4.26Å; Y58-F114 AromaticContact CD2-CG 3.94Å; Y58-F114 HydrophobicContact CD2-CG 3.94Å; Y58-F114 HydrophobicContact CE1-CD1 4.5Å; Y58-F114 HydrophobicContact CE2-CB 4.25Å; Y58-F114 HydrophobicContact CG-CB 3.75Å; Y58-F114 AromaticContact CG-CD1 3.96Å; Y58-F114 HydrophobicContact CG-CD1 3.96Å; Y58-F114 HydrophobicContact CG-CD2 4.09Å; Y58-F114 AromaticContact CG-CG 3.67Å; Y58-F114 HydrophobicContact CG-CG 3.67Å; Y58-F114 WeakPolarHBondContact O-CE2 3.26Å
59K90.9Very high88.4Confident79 Ų7941.9 Ų41.934%0.34325%0.246SC..Hα-helixtrans-62.8-52.2172-170.2170.9-165.7148.50111.3S55 I56 L57 L61 T62 D63 E280S55-K59 WeakPolarHBondContact O-CB 3.44Å; S55-K59 PolarHBondContact O-N 2.64Å; I56-K59 PolarHBondContact O-N 2.69Å; L57-K59 VanDerWaalsContact C-N 3.34Å; L57-K59 PolarHBondContact O-N 3.41Å; K59-L61 VanDerWaalsContact C-N 3.32Å; K59-L61 PolarHBondContact O-N 3.17Å; K59-T62 WeakPolarHBondContact O-CB 3.45Å; K59-T62 PolarHBondContact O-N 3.08Å; K59-T62 VanDerWaalsContact O-N 3.12Å; K59-D63 VanDerWaalsContact O-CG 3.3Å; K59-D63 PolarHBondContact O-N 3.37Å; K59-E280 WeakPolarHBondContact CD-OE2 3.32Å; K59-E280 IonicContact NZ-OE1 2.92Å; K59-E280 PolarHBondContact NZ-OE1 2.96Å; K59-E280 IonicContact NZ-OE2 3.21Å; K59-E280 PolarHBondContact NZ-OE2 2.91Å
60V92.9Very high86.9Confident56 Ų5641.7 Ų41.734%0.33925%0.245SC..Hα-helixtrans-63.2-36.6178.1177.80000111.9L11 I56 L57 D63 V64L11-V60 HydrophobicContact CD1-CG1 3.89Å; L11-V60 HydrophobicContact CD2-CG1 3.81Å; I56-V60 WeakPolarHBondContact O-CG2 3.14Å; I56-V60 PolarHBondContact O-N 3.26Å; I56-V60 VanDerWaalsContact O-N 3.11Å; L57-V60 PolarHBondContact O-N 2.94Å; V60-D63 PolarHBondContact O-N 3.06Å; V60-V64 HydrophobicContact CG1-CG2 4.27Å; V60-V64 VanDerWaalsContact O-CB 3.26Å; V60-V64 WeakPolarHBondContact O-CB 3.07Å; V60-V64 VanDerWaalsContact O-CG2 3.22Å; V60-V64 WeakPolarHBondContact O-CG2 3.35Å; V60-V64 PolarHBondContact O-N 2.98Å
61L93.1Very high85.5Confident0 Ų047.6 Ų47.60%027%0.273CS..Hα-helixtrans-61.4-44.1172.8-77.7172.7000111.9I10 L11 A14 L57 Y58 K59 V64 L65 F114I10-L61 HydrophobicContact CG2-CD1 4.09Å; L11-L61 HydrophobicContact CD1-CD2 3.95Å; A14-L61 HydrophobicContact CB-CD2 3.28Å; L57-L61 HydrophobicContact CD1-CD1 4.09Å; L57-L61 HydrophobicContact CD1-CG 4.07Å; L57-L61 HydrophobicContact CG-CD1 3.93Å; L57-L61 HydrophobicContact CG-CG 4.35Å; L57-L61 WeakPolarHBondContact O-CB 3.32Å; L57-L61 VanDerWaalsContact O-CG 3.3Å; L57-L61 WeakPolarHBondContact O-CG 3.32Å; L57-L61 PolarHBondContact O-N 3.24Å; Y58-L61 HydrophobicContact CD1-CD1 4.23Å; K59-L61 VanDerWaalsContact C-N 3.32Å; K59-L61 PolarHBondContact O-N 3.17Å; L61-V64 PolarHBondContact O-N 3.4Å; L61-L65 VanDerWaalsContact O-CB 3.26Å; L61-L65 WeakPolarHBondContact O-CB 3.4Å; L61-L65 WeakPolarHBondContact O-CG 3.33Å; L61-L65 PolarHBondContact O-N 3.32Å; L61-F114 HydrophobicContact CB-CE2 3.92Å; L61-F114 HydrophobicContact CB-CZ 3.9Å; L61-F114 HydrophobicContact CD1-CE1 4.35Å; L61-F114 HydrophobicContact CD1-CZ 3.89Å
62T90.6Very high84.4Confident12 Ų1254.3 Ų54.37%0.07430%0.304CS..Hα-helixtrans-61.2-50.7175.5-61.30000111.2Y58 K59 V64 L65 I66Y58-T62 PolarHBondContact O-N 3.44Å; Y58-T62 PolarHBondContact O-OG1 3Å; K59-T62 WeakPolarHBondContact O-CB 3.45Å; K59-T62 PolarHBondContact O-N 3.08Å; K59-T62 VanDerWaalsContact O-N 3.12Å; T62-V64 PolarHBondContact O-N 2.63Å; T62-L65 PolarHBondContact O-N 2.98Å; T62-I66 PolarHBondContact O-N 3Å
63D88.8Confident83.7Confident103 Ų10354.9 Ų54.955%0.55131%0.306SS*.Hα-helixtrans-62.2-27-178.9-60.8-25.3000113.2K59 V60K59-D63 VanDerWaalsContact O-CG 3.3Å; K59-D63 PolarHBondContact O-N 3.37Å; V60-D63 PolarHBondContact O-N 3.06Å
64V89.3Confident83.4Confident60 Ų6056.5 Ų56.536%0.36432%0.316SS..Hα-helixtrans-86.3-42.9178.2162.40000112.5L11 I15 V60 L61 T62L11-V64 HydrophobicContact CD1-CG2 4.34Å; I15-V64 HydrophobicContact CG1-CG1 3.59Å; V60-V64 HydrophobicContact CG1-CG2 4.27Å; V60-V64 VanDerWaalsContact O-CB 3.26Å; V60-V64 WeakPolarHBondContact O-CB 3.07Å; V60-V64 VanDerWaalsContact O-CG2 3.22Å; V60-V64 WeakPolarHBondContact O-CG2 3.35Å; V60-V64 PolarHBondContact O-N 2.98Å; L61-V64 PolarHBondContact O-N 3.4Å; T62-V64 PolarHBondContact O-N 2.63Å
65L88.1Confident82.9Confident9 Ų962.9 Ų62.95%0.04735%0.346CS..Hα-helixtrans-76.2-25.6-178.6-68.8175.2000112.5A14 F19 L61 T62 I81 F84 L118A14-L65 HydrophobicContact CB-CD2 4.36Å; F19-L65 HydrophobicContact CE1-CD1 4.34Å; F19-L65 HydrophobicContact CE1-CD2 3.87Å; F19-L65 HydrophobicContact CZ-CD2 3.82Å; L61-L65 VanDerWaalsContact O-CB 3.26Å; L61-L65 WeakPolarHBondContact O-CB 3.4Å; L61-L65 WeakPolarHBondContact O-CG 3.33Å; L61-L65 PolarHBondContact O-N 3.32Å; T62-L65 PolarHBondContact O-N 2.98Å; L65-I81 HydrophobicContact CB-CD1 4.21Å; L65-I81 HydrophobicContact CB-CG1 4.47Å; L65-I81 HydrophobicContact CD2-CG1 4.45Å; L65-I81 VanDerWaalsContact O-CD1 3.22Å; L65-I81 WeakPolarHBondContact O-CD1 3.47Å; L65-F84 HydrophobicContact CD1-CD1 4.08Å; L65-F84 HydrophobicContact CD1-CE1 3.73Å; L65-L118 HydrophobicContact CB-CD1 4.49Å; L65-L118 HydrophobicContact CD1-CD1 4.47Å; L65-L118 HydrophobicContact CD1-CD2 4.18Å
66I85.5Confident82.7Confident19 Ų1965.9 Ų65.910%0.09737%0.367CS..SBendtrans-128.391.5178.9-56.4-176.9000108T62 A68 M73 L118 Q121 T122 L125T62-I66 PolarHBondContact O-N 3Å; I66-A68 PolarHBondContact O-N 3.21Å; I66-M73 HydrophobicContact CG1-CE 4.49Å; I66-L118 HydrophobicContact CD1-CD1 3.77Å; I66-L118 HydrophobicContact CG1-CD1 4.22Å; I66-Q121 HydrophobicContact CD1-CB 3.44Å; I66-Q121 VanDerWaalsContact CD1-CB 3.44Å; I66-T122 HydrophobicContact CD1-CG2 3.78Å; I66-L125 HydrophobicContact CG2-CD2 4.12Å
67P73.4Confident82.6Confident61 Ų6163.3 Ų63.340%0.39635%0.354SS..  trans-56.6134.3180-26.335.9000112.1T69 M73P67-T69 CarbonylContact O-C 3.32Å; P67-T69 PolarHBondContact O-N 3.26Å; P67-T69 VanDerWaalsContact O-O 3.11Å; P67-M73 VanDerWaalsContact CD-SD 3.56Å; P67-M73 HydrophobicContact CG-SD 4.48Å
68A64.3Low82.3Confident104 Ų10462.8 Ų62.886%0.8635%0.351SS*.SBendtrans-58.3-23.5-179.200000113.8I66 M70I66-A68 PolarHBondContact O-N 3.21Å; A68-M70 PolarHBondContact O-N 2.84Å
69T57.4Low82.1Confident94 Ų9463.9 Ų63.958%0.57736%0.362SS*.SBendtrans-71.7106.9162.949.20000109.5P67 Q71P67-T69 CarbonylContact O-C 3.32Å; P67-T69 PolarHBondContact O-N 3.26Å; P67-T69 VanDerWaalsContact O-O 3.11Å; T69-Q71 PolarHBondContact O-N 2.86Å
70M60.6Low82.1Confident65 Ų6563.1 Ų63.132%0.3236%0.362SS..  trans-69.832.6179.1-58.4-170.7178.200114.7A68 F124 L125 R132 I201A68-M70 PolarHBondContact O-N 2.84Å; M70-F124 HydrophobicContact CE-CE1 3.87Å; M70-F124 HydrophobicContact SD-CE1 3.88Å; M70-L125 HydrophobicContact CB-CD1 4.39Å; M70-R132 VanDerWaalsContact CB-NH2 3.31Å; M70-R132 PolarHBondContact O-NH1 2.94Å; M70-R132 PolarHBondContact O-NH2 3.21Å; M70-I201 HydrophobicContact CE-CD1 3.88Å; M70-I201 HydrophobicContact SD-CD1 3.6Å
71Q65.8Low82.1Confident151 Ų15160.5 Ų60.571%0.70635%0.346SS*.  trans-58.6158.5171.3-169.9168.94.600110.5T69 M73T69-Q71 PolarHBondContact O-N 2.86Å; Q71-M73 PolarHBondContact O-N 3.42Å
72E70.6Confident82.1Confident143 Ų14363.9 Ų63.967%0.66836%0.359SS*.  trans-66.7100.1-174.7-64.7174.2173.500111.7
73M80Confident82.2Confident19 Ų1967.1 Ų67.19%0.09438%0.376CS..  trans-72.8141.4171-65.9-145.6-46.700110.9I66 P67 Q71 E75 L77 L78 I81 L125 Q129I66-M73 HydrophobicContact CG1-CE 4.49Å; P67-M73 VanDerWaalsContact CD-SD 3.56Å; P67-M73 HydrophobicContact CG-SD 4.48Å; Q71-M73 PolarHBondContact O-N 3.42Å; M73-E75 PolarHBondContact O-N 3.47Å; M73-L77 HydrophobicContact CE-CD2 4.44Å; M73-L77 HydrophobicContact SD-CD2 4.04Å; M73-L78 HydrophobicContact CB-CD1 4.4Å; M73-L78 HydrophobicContact CB-CG 4.27Å; M73-L78 HydrophobicContact CE-CD2 3.57Å; M73-L78 HydrophobicContact CE-CG 3.98Å; M73-I81 HydrophobicContact CE-CD1 3.87Å; M73-L125 HydrophobicContact CE-CD2 3.84Å; M73-L125 HydrophobicContact CG-CD2 4.07Å; M73-L125 HydrophobicContact SD-CD2 4.37Å; M73-Q129 PolarHBondContact O-NE2 2.81Å
74P87.4Confident82.5Confident78 Ų7862.4 Ų62.451%0.50635%0.35SS..  trans-55.7138.6174.2-25.935000112.5S76 L77 L78P74-S76 PolarHBondContact O-N 2.8Å; P74-L77 HydrophobicContact CB-CB 4.32Å; P74-L77 PolarHBondContact O-N 2.96Å; P74-L77 VanDerWaalsContact O-N 3.12Å; P74-L78 PolarHBondContact O-N 3.27Å
75E85.8Confident82.8Confident137 Ų13759.6 Ų59.664%0.6433%0.333SS*.Hα-helixtrans-61.5-31.1179.9-167.4-176.517600112.3M73 L78 A79M73-E75 PolarHBondContact O-N 3.47Å; E75-L78 PolarHBondContact O-N 3.02Å; E75-A79 WeakPolarHBondContact O-CB 3.45Å; E75-A79 PolarHBondContact O-N 3.34Å
76S89.8Confident83Confident77 Ų7765.4 Ų65.454%0.53836%0.359SS..Hα-helixtrans-59.5-54.1171.251.20000111.6P74 L78 A79 D80P74-S76 PolarHBondContact O-N 2.8Å; S76-L78 VanDerWaalsContact C-N 3.26Å; S76-L78 PolarHBondContact O-N 3Å; S76-A79 CarbonylContact O-C 3.36Å; S76-A79 WeakPolarHBondContact O-CA 3.47Å; S76-A79 WeakPolarHBondContact O-CB 3.4Å; S76-A79 PolarHBondContact O-N 2.84Å; S76-D80 VanDerWaalsContact O-CG 3.23Å; S76-D80 PolarHBondContact O-N 3.25Å; S76-D80 VanDerWaalsContact O-OD2 3.11Å
77L89.4Confident83.4Confident40 Ų4067.5 Ų67.521%0.20937%0.368CS..Hα-helixtrans-57.8-40.2177.417960.8000111.6I17 M73 P74 D80 I81I17-L77 HydrophobicContact CD1-CD1 3.91Å; I17-L77 HydrophobicContact CG1-CD1 4.17Å; I17-L77 HydrophobicContact CG2-CD1 4.46Å; M73-L77 HydrophobicContact CE-CD2 4.44Å; M73-L77 HydrophobicContact SD-CD2 4.04Å; P74-L77 HydrophobicContact CB-CB 4.32Å; P74-L77 PolarHBondContact O-N 2.96Å; P74-L77 VanDerWaalsContact O-N 3.12Å; L77-D80 PolarHBondContact O-N 2.59Å; L77-I81 HydrophobicContact CD1-CD1 3.9Å; L77-I81 HydrophobicContact CD1-CG1 4.14Å; L77-I81 HydrophobicContact CG-CD1 3.83Å; L77-I81 HydrophobicContact CG-CG1 4.48Å; L77-I81 WeakPolarHBondContact O-CB 3.1Å; L77-I81 WeakPolarHBondContact O-CD1 3.49Å; L77-I81 VanDerWaalsContact O-CG1 3.25Å; L77-I81 WeakPolarHBondContact O-CG1 3.42Å; L77-I81 PolarHBondContact O-N 2.84Å
78L89.5Confident84.5Confident0 Ų064.6 Ų64.60%035%0.349CS..Hα-helixtrans-64.1-36.9172.6-78.8169000112.6M73 P74 E75 S76 R82 T122 L125M73-L78 HydrophobicContact CB-CD1 4.4Å; M73-L78 HydrophobicContact CB-CG 4.27Å; M73-L78 HydrophobicContact CE-CD2 3.57Å; M73-L78 HydrophobicContact CE-CG 3.98Å; P74-L78 PolarHBondContact O-N 3.27Å; E75-L78 PolarHBondContact O-N 3.02Å; S76-L78 VanDerWaalsContact C-N 3.26Å; S76-L78 PolarHBondContact O-N 3Å; L78-R82 WeakPolarHBondContact O-CB 3.17Å; L78-R82 WeakPolarHBondContact O-CG 3.48Å; L78-R82 PolarHBondContact O-N 2.79Å; L78-R82 VanDerWaalsContact O-N 3.16Å; L78-R82 PolarHBondContact O-NE 3.5Å; L78-T122 HydrophobicContact CD2-CG2 3.83Å; L78-L125 HydrophobicContact CD2-CD2 4.26Å
79A90.8Very high85.9Confident34 Ų3462.7 Ų62.728%0.28132%0.322SS..Hα-helixtrans-67.1-41.917300000111.8E75 S76 R82 N83E75-A79 WeakPolarHBondContact O-CB 3.45Å; E75-A79 PolarHBondContact O-N 3.34Å; S76-A79 CarbonylContact O-C 3.36Å; S76-A79 WeakPolarHBondContact O-CA 3.47Å; S76-A79 WeakPolarHBondContact O-CB 3.4Å; S76-A79 PolarHBondContact O-N 2.84Å; A79-R82 PolarHBondContact O-N 3.41Å; A79-N83 WeakPolarHBondContact O-CB 3.22Å; A79-N83 PolarHBondContact O-N 3.28Å; A79-N83 PolarHBondContact O-ND2 3.45Å
80D92Very high87.7Confident64 Ų6463.9 Ų63.934%0.34232%0.321SS..Hα-helixtrans-67.9-43.1-178.9-60.5-34.7000111.6F19 S76 L77 R82 N83 F84F19-D80 HydrophobicContact CD2-CB 4.29Å; F19-D80 HydrophobicContact CE2-CB 3.91Å; S76-D80 VanDerWaalsContact O-CG 3.23Å; S76-D80 PolarHBondContact O-N 3.25Å; S76-D80 VanDerWaalsContact O-OD2 3.11Å; L77-D80 PolarHBondContact O-N 2.59Å; D80-R82 VanDerWaalsContact C-N 3.35Å; D80-R82 PolarHBondContact O-N 3.4Å; D80-N83 WeakPolarHBondContact O-CB 3.38Å; D80-N83 PolarHBondContact O-N 2.84Å; D80-F84 WeakPolarHBondContact O-CB 3.4Å; D80-F84 PolarHBondContact O-N 3.18Å
81I92.7Very high89.4Confident0 Ų062.1 Ų62.10%031%0.311CS..Hα-helixtrans-62.4-40.7172.4-65.6163.9000111.1F19 L65 M73 L77 F84 A85 L118 T122F19-I81 HydrophobicContact CE2-CG1 4.49Å; F19-I81 HydrophobicContact CZ-CG1 4.09Å; L65-I81 HydrophobicContact CB-CD1 4.21Å; L65-I81 HydrophobicContact CB-CG1 4.47Å; L65-I81 HydrophobicContact CD2-CG1 4.45Å; L65-I81 VanDerWaalsContact O-CD1 3.22Å; L65-I81 WeakPolarHBondContact O-CD1 3.47Å; M73-I81 HydrophobicContact CE-CD1 3.87Å; L77-I81 HydrophobicContact CD1-CD1 3.9Å; L77-I81 HydrophobicContact CD1-CG1 4.14Å; L77-I81 HydrophobicContact CG-CD1 3.83Å; L77-I81 HydrophobicContact CG-CG1 4.48Å; L77-I81 WeakPolarHBondContact O-CB 3.1Å; L77-I81 WeakPolarHBondContact O-CD1 3.49Å; L77-I81 VanDerWaalsContact O-CG1 3.25Å; L77-I81 WeakPolarHBondContact O-CG1 3.42Å; L77-I81 PolarHBondContact O-N 2.84Å; I81-F84 PolarHBondContact O-N 3.4Å; I81-A85 WeakPolarHBondContact O-CB 3.48Å; I81-A85 PolarHBondContact O-N 3.39Å; I81-L118 HydrophobicContact CG2-CD1 3.89Å; I81-L118 HydrophobicContact CG2-CD2 4.03Å; I81-L118 HydrophobicContact CG2-CG 3.82Å; I81-T122 HydrophobicContact CB-CG2 4.18Å; I81-T122 HydrophobicContact CG2-CG2 3.59Å
82R92.1Very high90.9Very high72 Ų7255 Ų5527%0.27228%0.277SS..Hα-helixtrans-65.2-37.1174.8-75.9175.5-66.2179.30.3111.9L78 A79 D80 K86 T122L78-R82 WeakPolarHBondContact O-CB 3.17Å; L78-R82 WeakPolarHBondContact O-CG 3.48Å; L78-R82 PolarHBondContact O-N 2.79Å; L78-R82 VanDerWaalsContact O-N 3.16Å; L78-R82 PolarHBondContact O-NE 3.5Å; A79-R82 PolarHBondContact O-N 3.41Å; D80-R82 VanDerWaalsContact C-N 3.35Å; D80-R82 PolarHBondContact O-N 3.4Å; R82-K86 WeakPolarHBondContact O-CB 3.3Å; R82-K86 PolarHBondContact O-N 2.92Å; R82-T122 HydrophobicContact CG-CG2 4.38Å; R82-T122 WeakPolarHBondContact CG-OG1 3.22Å
83N93.5Very high92.1Very high80 Ų8049.7 Ų49.743%0.42826%0.258SS..Hα-helixtrans-67.9-43.3174.2-77.6-36.2000111.9A79 D80 K86 H87A79-N83 WeakPolarHBondContact O-CB 3.22Å; A79-N83 PolarHBondContact O-N 3.28Å; A79-N83 PolarHBondContact O-ND2 3.45Å; D80-N83 WeakPolarHBondContact O-CB 3.38Å; D80-N83 PolarHBondContact O-N 2.84Å; N83-K86 WeakPolarHBondContact O-CB 3.35Å; N83-K86 PolarHBondContact O-N 3.11Å; N83-H87 PolarHBondContact O-N 3.37Å; N83-H87 PolarHBondContact O-ND1 3.09Å
84F94.4Very high92.9Very high3 Ų350.3 Ų50.31%0.01327%0.265CS..Hα-helixtrans-58.1-52.1172.8167.7-109000111.5F19 I22 L65 D80 I81 K86 H87 W88 W91 F114 L118F19-F84 HydrophobicContact CB-CB 4.28Å; F19-F84 HydrophobicContact CB-CD2 3.96Å; F19-F84 HydrophobicContact CB-CG 4.49Å; F19-F84 HydrophobicContact CD1-CB 3.79Å; F19-F84 HydrophobicContact CD1-CD1 4.15Å; F19-F84 AromaticContact CD1-CD2 3.27Å; F19-F84 HydrophobicContact CD1-CD2 3.27Å; F19-F84 AromaticContact CD1-CE2 3.78Å; F19-F84 HydrophobicContact CD1-CE2 3.78Å; F19-F84 AromaticContact CD1-CG 3.48Å; F19-F84 HydrophobicContact CD1-CG 3.48Å; F19-F84 VanDerWaalsContact CD1-CG 3.48Å; F19-F84 HydrophobicContact CD1-CZ 4.4Å; F19-F84 HydrophobicContact CD2-CB 3.96Å; F19-F84 HydrophobicContact CE1-CB 4.03Å; F19-F84 AromaticContact CE1-CD1 3.93Å; F19-F84 HydrophobicContact CE1-CD1 3.93Å; F19-F84 AromaticContact CE1-CD2 3.91Å; F19-F84 HydrophobicContact CE1-CD2 3.91Å; F19-F84 HydrophobicContact CE1-CE1 4.33Å; F19-F84 HydrophobicContact CE1-CE2 4.31Å; F19-F84 AromaticContact CE1-CG 3.69Å; F19-F84 HydrophobicContact CE1-CG 3.69Å; F19-F84 HydrophobicContact CE2-CB 4.17Å; F19-F84 HydrophobicContact CG-CB 3.76Å; F19-F84 AromaticContact CG-CD2 3.79Å; F19-F84 HydrophobicContact CG-CD2 3.79Å; F19-F84 AromaticContact CG-CG 3.95Å; F19-F84 HydrophobicContact CG-CG 3.95Å; F19-F84 HydrophobicContact CZ-CB 4.22Å; F19-F84 HydrophobicContact CZ-CG 4.32Å; I22-F84 HydrophobicContact CD1-CE2 3.72Å; I22-F84 HydrophobicContact CD1-CZ 4.35Å; I22-F84 HydrophobicContact CG2-CE2 4.4Å; L65-F84 HydrophobicContact CD1-CD1 4.08Å; L65-F84 HydrophobicContact CD1-CE1 3.73Å; D80-F84 WeakPolarHBondContact O-CB 3.4Å; D80-F84 PolarHBondContact O-N 3.18Å; I81-F84 PolarHBondContact O-N 3.4Å; F84-K86 PolarHBondContact O-N 3.3Å; F84-H87 PolarHBondContact O-N 3.4Å; F84-H87 VanDerWaalsContact O-N 3.14Å; F84-W88 HydrophobicContact CE1-CE3 4.37Å; F84-W88 AromaticContact CE2-CE3 3.5Å; F84-W88 HydrophobicContact CE2-CE3 3.5Å; F84-W88 VanDerWaalsContact CE2-CE3 3.5Å; F84-W88 AromaticContact CE2-CZ3 3.87Å; F84-W88 HydrophobicContact CE2-CZ3 3.87Å; F84-W88 HydrophobicContact CZ-CD2 4.45Å; F84-W88 AromaticContact CZ-CE3 3.41Å; F84-W88 HydrophobicContact CZ-CE3 3.41Å; F84-W88 VanDerWaalsContact CZ-CE3 3.41Å; F84-W88 AromaticContact CZ-CZ3 3.7Å; F84-W88 HydrophobicContact CZ-CZ3 3.7Å; F84-W88 PolarHBondContact O-N 3.05Å; F84-W91 AromaticContact CD2-CZ3 3.9Å; F84-W91 HydrophobicContact CD2-CZ3 3.9Å; F84-W91 HydrophobicContact CE2-CZ3 4.31Å; F84-F114 HydrophobicContact CE1-CE1 4.21Å; F84-F114 AromaticContact CE1-CZ 3.99Å; F84-F114 HydrophobicContact CE1-CZ 3.99Å; F84-F114 HydrophobicContact CZ-CE1 4.43Å; F84-F114 HydrophobicContact CZ-CZ 4.44Å; F84-L118 HydrophobicContact CD1-CD2 3.83Å; F84-L118 HydrophobicContact CE1-CD2 3.87Å
85A94.8Very high93.3Very high1 Ų146.6 Ų46.61%0.00824%0.241CC..Hα-helixtrans-59.8-31.7177.200000113.1I81 V115 L118 K119I81-A85 WeakPolarHBondContact O-CB 3.48Å; I81-A85 PolarHBondContact O-N 3.39Å; A85-V115 WeakPolarHBondContact O-CG1 3.3Å; A85-L118 HydrophobicContact CB-CB 4.42Å; A85-L118 HydrophobicContact CB-CD2 4.03Å; A85-L118 HydrophobicContact CB-CG 4.33Å; A85-K119 HydrophobicContact CB-CG 4.09Å
86K93.6Very high93.8Very high132 Ų13240.5 Ų40.557%0.57421%0.212SC*.Hα-helixtrans-67.2-37.8176.6177.1-175.7167.9-119.60112.8R82 N83 F84R82-K86 WeakPolarHBondContact O-CB 3.3Å; R82-K86 PolarHBondContact O-N 2.92Å; N83-K86 WeakPolarHBondContact O-CB 3.35Å; N83-K86 PolarHBondContact O-N 3.11Å; F84-K86 PolarHBondContact O-N 3.3Å
87H94.2Very high94Very high62 Ų6241.8 Ų41.829%0.28721%0.21SC..Hα-helixtrans-97.4-21.5-173.7-55111.9000114N83 F84 E89 H90 W91N83-H87 PolarHBondContact O-N 3.37Å; N83-H87 PolarHBondContact O-ND1 3.09Å; F84-H87 PolarHBondContact O-N 3.4Å; F84-H87 VanDerWaalsContact O-N 3.14Å; H87-E89 PolarHBondContact O-N 3.49Å; H87-H90 PolarHBondContact O-N 2.83Å; H87-W91 HydrophobicContact CB-CD2 3.91Å; H87-W91 VanDerWaalsContact CB-CE2 3.44Å; H87-W91 HydrophobicContact CB-CE3 4.4Å; H87-W91 HydrophobicContact CB-CG 4.48Å; H87-W91 HydrophobicContact CB-CH2 4.14Å; H87-W91 HydrophobicContact CB-CZ2 3.59Å; H87-W91 PolarHBondContact O-N 3.1Å
88W95.6Very high94Very high1 Ų147 Ų470%0.00424%0.238CC..Hα-helixtrans-46.8-48.5-176.7178.1-86.9000114.9I10 I22 L26 Y58 F84 H90 W91 L92 F114 V115I10-W88 HydrophobicContact CD1-CH2 4.41Å; I10-W88 HydrophobicContact CG2-CH2 3.99Å; I10-W88 HydrophobicContact CG2-CZ3 4.11Å; I22-W88 HydrophobicContact CG2-CE3 4.4Å; I22-W88 HydrophobicContact CG2-CH2 4.46Å; I22-W88 HydrophobicContact CG2-CZ3 3.69Å; L26-W88 HydrophobicContact CD1-CH2 4.42Å; L26-W88 HydrophobicContact CD1-CZ3 4.5Å; Y58-W88 HydrophobicContact CD1-CZ2 4.33Å; Y58-W88 HydrophobicContact CE1-CH2 4.07Å; Y58-W88 AromaticContact CE1-CZ2 3.38Å; Y58-W88 HydrophobicContact CE1-CZ2 3.38Å; Y58-W88 AromaticContact CZ-CZ2 3.77Å; F84-W88 HydrophobicContact CE1-CE3 4.37Å; F84-W88 AromaticContact CE2-CE3 3.5Å; F84-W88 HydrophobicContact CE2-CE3 3.5Å; F84-W88 VanDerWaalsContact CE2-CE3 3.5Å; F84-W88 AromaticContact CE2-CZ3 3.87Å; F84-W88 HydrophobicContact CE2-CZ3 3.87Å; F84-W88 HydrophobicContact CZ-CD2 4.45Å; F84-W88 AromaticContact CZ-CE3 3.41Å; F84-W88 HydrophobicContact CZ-CE3 3.41Å; F84-W88 VanDerWaalsContact CZ-CE3 3.41Å; F84-W88 AromaticContact CZ-CZ3 3.7Å; F84-W88 HydrophobicContact CZ-CZ3 3.7Å; F84-W88 PolarHBondContact O-N 3.05Å; W88-H90 PolarHBondContact O-N 2.86Å; W88-W91 PolarHBondContact O-N 2.89Å; W88-L92 WeakPolarHBondContact O-CB 3.17Å; W88-L92 PolarHBondContact O-N 3Å; W88-F114 HydrophobicContact CD2-CD1 4.32Å; W88-F114 AromaticContact CD2-CE1 3.94Å; W88-F114 HydrophobicContact CD2-CE1 3.94Å; W88-F114 HydrophobicContact CE3-CE1 4.24Å; W88-F114 HydrophobicContact CG-CD1 4.35Å; W88-F114 HydrophobicContact CG-CE1 4.24Å; W88-F114 AromaticContact NE1-CD1 3.97Å; W88-V115 HydrophobicContact CB-CG2 3.77Å; W88-V115 HydrophobicContact CG-CG2 3.94Å
89E94.8Very high94.2Very high63 Ų6348.3 Ų48.329%0.29424%0.244SC..Hα-helixtrans-63-41.8-178.8-177.2179.1162.800112H87 A93 R112H87-E89 PolarHBondContact O-N 3.49Å; E89-A93 VanDerWaalsContact O-CB 3.26Å; E89-A93 WeakPolarHBondContact O-CB 3.4Å; E89-A93 PolarHBondContact O-N 3.12Å; E89-R112 IonicContact OE1-CZ 3.13Å; E89-R112 IonicContact OE1-NE 2.74Å; E89-R112 PolarHBondContact OE1-NE 3.27Å; E89-R112 IonicContact OE1-NH2 2.69Å; E89-R112 PolarHBondContact OE1-NH2 3.12Å; E89-R112 VanDerWaalsContact OE2-CG 3.25Å; E89-R112 WeakPolarHBondContact OE2-CG 3.14Å; E89-R112 IonicContact OE2-NE 3.59Å
90H95.1Very high94.3Very high120 Ų12048.1 Ų48.156%0.55624%0.24SC*.Hα-helixtrans-67.7-44.3178.6173.629.8000111.3H87 W88 L92 A93 S94H87-H90 PolarHBondContact O-N 2.83Å; W88-H90 PolarHBondContact O-N 2.86Å; H90-L92 VanDerWaalsContact C-N 3.34Å; H90-L92 PolarHBondContact O-N 3.12Å; H90-A93 PolarHBondContact O-N 3.36Å; H90-S94 PolarHBondContact CE1-OG 3.29Å; H90-S94 PolarHBondContact O-N 3.19Å
91W96.4Very high94.4Very high27 Ų2753.1 Ų53.110%0.10226%0.262CS..Hα-helixtrans-59-44.7176.1-63.7-22.8000112F19 Q23 L26 F84 H87 W88 S95F19-W91 WeakPolarHBondContact O-CH2 3.44Å; F19-W91 WeakPolarHBondContact O-CZ3 3.45Å; Q23-W91 HydrophobicContact CB-CD2 3.85Å; Q23-W91 HydrophobicContact CB-CE3 4.33Å; Q23-W91 HydrophobicContact CB-CG 3.97Å; Q23-W91 HydrophobicContact CB-CZ2 4.39Å; Q23-W91 HydrophobicContact CG-CB 4.26Å; Q23-W91 HydrophobicContact CG-CD2 4.19Å; Q23-W91 HydrophobicContact CG-CG 3.79Å; L26-W91 HydrophobicContact CD1-CB 3.98Å; F84-W91 AromaticContact CD2-CZ3 3.9Å; F84-W91 HydrophobicContact CD2-CZ3 3.9Å; F84-W91 HydrophobicContact CE2-CZ3 4.31Å; H87-W91 HydrophobicContact CB-CD2 3.91Å; H87-W91 VanDerWaalsContact CB-CE2 3.44Å; H87-W91 HydrophobicContact CB-CE3 4.4Å; H87-W91 HydrophobicContact CB-CG 4.48Å; H87-W91 HydrophobicContact CB-CH2 4.14Å; H87-W91 HydrophobicContact CB-CZ2 3.59Å; H87-W91 PolarHBondContact O-N 3.1Å; W88-W91 PolarHBondContact O-N 2.89Å; W91-S95 WeakPolarHBondContact O-CB 3.25Å; W91-S95 PolarHBondContact O-N 3.25Å; W91-S95 PolarHBondContact O-OG 3.31Å
92L96.6Very high94.3Very high1 Ų155.8 Ų55.81%0.00528%0.28CS..Hα-helixtrans-66.1-45.4175.9-177.264.6000111.3L26 W88 H90 S94 S95 L96 L108 A111L26-L92 HydrophobicContact CD2-CD1 4.01Å; W88-L92 WeakPolarHBondContact O-CB 3.17Å; W88-L92 PolarHBondContact O-N 3Å; H90-L92 VanDerWaalsContact C-N 3.34Å; H90-L92 PolarHBondContact O-N 3.12Å; L92-S94 PolarHBondContact O-N 3.15Å; L92-S95 WeakPolarHBondContact CA-OG 3.43Å; L92-S95 PolarHBondContact O-N 3.45Å; L92-S95 PolarHBondContact O-OG 2.69Å; L92-L96 HydrophobicContact CD1-CD1 4.09Å; L92-L96 HydrophobicContact CD1-CG 4.36Å; L92-L96 HydrophobicContact CG-CD1 4.05Å; L92-L96 WeakPolarHBondContact O-CG 3.42Å; L92-L96 PolarHBondContact O-N 2.66Å; L92-L96 VanDerWaalsContact O-N 3.17Å; L92-L108 HydrophobicContact CD2-CD2 4.19Å; L92-L108 HydrophobicContact CG-CD2 4.22Å; L92-A111 HydrophobicContact CD2-CB 3.45Å; L92-A111 VanDerWaalsContact CD2-CB 3.45Å
93A96.1Very high94.4Very high33 Ų3352.4 Ų52.427%0.27327%0.267SS..Hα-helixtrans-57.5-49.5178.800000111.9E89 H90 S95 L96 E97 L108E89-A93 VanDerWaalsContact O-CB 3.26Å; E89-A93 WeakPolarHBondContact O-CB 3.4Å; E89-A93 PolarHBondContact O-N 3.12Å; H90-A93 PolarHBondContact O-N 3.36Å; A93-S95 VanDerWaalsContact C-N 3.34Å; A93-S95 PolarHBondContact O-N 3Å; A93-L96 PolarHBondContact O-N 3.47Å; A93-E97 PolarHBondContact O-N 3.33Å; A93-L108 HydrophobicContact CB-CD1 4.44Å; A93-L108 HydrophobicContact CB-CD2 3.99Å
94S96.1Very high94.5Very high32 Ų3249.7 Ų49.722%0.22426%0.256CS..Hα-helixtrans-71.7-25.6178.8-71.20000113.8H90 L92 L96 E97H90-S94 PolarHBondContact CE1-OG 3.29Å; H90-S94 PolarHBondContact O-N 3.19Å; L92-S94 PolarHBondContact O-N 3.15Å; S94-L96 PolarHBondContact O-N 2.8Å; S94-E97 WeakPolarHBondContact CA-OE1 3.07Å; S94-E97 WeakPolarHBondContact CB-OE1 3.5Å; S94-E97 PolarHBondContact O-N 2.87Å; S94-E97 PolarHBondContact OG-OE1 3.45Å
95S96.1Very high94.5Very high0 Ų052.8 Ų52.80%028%0.282CS..Hα-helixtrans-66.6-23.3168.375.50000113.6W30 Q31 W91 L92 A93W30-S95 WeakPolarHBondContact CB-O 3.41Å; Q31-S95 PolarHBondContact NE2-O 3.31Å; W91-S95 WeakPolarHBondContact O-CB 3.25Å; W91-S95 PolarHBondContact O-N 3.25Å; W91-S95 PolarHBondContact O-OG 3.31Å; L92-S95 WeakPolarHBondContact CA-OG 3.43Å; L92-S95 PolarHBondContact O-N 3.45Å; L92-S95 PolarHBondContact O-OG 2.69Å; A93-S95 VanDerWaalsContact C-N 3.34Å; A93-S95 PolarHBondContact O-N 3Å
96L95.8Very high94.5Very high8 Ų856.4 Ų56.44%0.04230%0.297CS..THydrogen-bonded Turntrans-98.35-179.4-62.7174.8000113.7W30 L92 A93 S94 L99 L103 A104 K107W30-L96 HydrophobicContact CB-CD2 4.38Å; W30-L96 HydrophobicContact CD2-CD2 3.56Å; W30-L96 HydrophobicContact CE3-CD2 3.93Å; W30-L96 HydrophobicContact CG-CD2 3.77Å; W30-L96 HydrophobicContact CZ2-CD2 4.39Å; W30-L96 HydrophobicContact CZ3-CD2 4.49Å; L92-L96 HydrophobicContact CD1-CD1 4.09Å; L92-L96 HydrophobicContact CD1-CG 4.36Å; L92-L96 HydrophobicContact CG-CD1 4.05Å; L92-L96 WeakPolarHBondContact O-CG 3.42Å; L92-L96 PolarHBondContact O-N 2.66Å; L92-L96 VanDerWaalsContact O-N 3.17Å; A93-L96 PolarHBondContact O-N 3.47Å; S94-L96 PolarHBondContact O-N 2.8Å; L96-L99 HydrophobicContact CD2-CD1 4.02Å; L96-L99 PolarHBondContact O-N 3.45Å; L96-L103 HydrophobicContact CD2-CD2 3.84Å; L96-L103 HydrophobicContact CD2-CG 4.22Å; L96-A104 HydrophobicContact CB-CB 4.35Å; L96-A104 HydrophobicContact CD1-CB 4.27Å; L96-K107 HydrophobicContact CD1-CB 4.23Å; L96-K107 HydrophobicContact CD1-CD 4.13Å; L96-K107 HydrophobicContact CD2-CD 4.43Å
97E93.6Very high94.6Very high104 Ų10450.1 Ų50.149%0.48627%0.27SS..THydrogen-bonded Turntrans-58.6147171.5-75.4171.3-144.200110.9Q31 A93 S94 L99Q31-E97 PolarHBondContact NE2-O 3.36Å; A93-E97 PolarHBondContact O-N 3.33Å; S94-E97 WeakPolarHBondContact CA-OE1 3.07Å; S94-E97 WeakPolarHBondContact CB-OE1 3.5Å; S94-E97 PolarHBondContact O-N 2.87Å; S94-E97 PolarHBondContact OG-OE1 3.45Å; E97-L99 PolarHBondContact O-N 3.49Å
98N91.3Very high94.6Very high150 Ų15048.3 Ų48.380%0.80226%0.263SS*.THydrogen-bonded Turntrans62.71.5-177-43.5-68.2000116.5
99L93.3Very high94.6Very high27 Ų2749.4 Ų49.414%0.14127%0.269CS..SBendtrans-94.1163.3172.2-62.5-175.3000111.8W30 L38 L41 L96 E97 E101 L103W30-L99 HydrophobicContact CB-CD1 3.95Å; W30-L99 HydrophobicContact CD2-CD1 4.34Å; W30-L99 HydrophobicContact CE3-CD1 3.77Å; W30-L99 HydrophobicContact CG-CD1 4.46Å; L38-L99 HydrophobicContact CD2-CD2 3.77Å; L41-L99 HydrophobicContact CD1-CD1 4.29Å; L41-L99 HydrophobicContact CD1-CD2 4.03Å; L96-L99 HydrophobicContact CD2-CD1 4.02Å; L96-L99 PolarHBondContact O-N 3.45Å; E97-L99 PolarHBondContact O-N 3.49Å; L99-E101 PolarHBondContact O-N 3.05Å; L99-L103 HydrophobicContact CB-CD2 4.22Å; L99-L103 HydrophobicContact CD1-CD2 3.9Å
100P93.2Very high94.6Very high30 Ų3046.9 Ų46.920%0.19526%0.258CS..  trans-56128.6-178.7-28.637.2000113.4L41 E42 C102 L103L41-P100 HydrophobicContact CB-CG 4.11Å; E42-P100 HydrophobicContact CG-CB 4.17Å; E42-P100 HydrophobicContact CG-CG 3.96Å; P100-C102 PolarHBondContact O-N 3.28Å; P100-L103 VanDerWaalsContact O-CB 3.25Å; P100-L103 WeakPolarHBondContact O-CB 3.35Å; P100-L103 PolarHBondContact O-N 2.74Å
101E92.2Very high94.7Very high170 Ų17041.2 Ų41.279%0.79423%0.232SC*.Hα-helixtrans-55.5-30.7-173.2-63.7-175.9173.600113.7L99 L103 A104 A105L99-E101 PolarHBondContact O-N 3.05Å; E101-L103 PolarHBondContact O-N 2.98Å; E101-A104 PolarHBondContact O-N 2.88Å; E101-A105 VanDerWaalsContact O-CB 3.25Å; E101-A105 WeakPolarHBondContact O-CB 3.4Å; E101-A105 PolarHBondContact O-N 3.01Å
102C92.6Very high94.6Very high56 Ų5645 Ų4538%0.37825%0.246SC..Hα-helixtrans-60.6-29.1177.258.70000113.6P100 K106P100-C102 PolarHBondContact O-N 3.28Å; C102-K106 PolarHBondContact O-N 3.14Å
103L93.9Very high94.4Very high0 Ų047.8 Ų47.80%026%0.256CS..Hα-helixtrans-69.5-51175-179.466.6000110.5W30 L41 V47 F50 L96 L99 P100 E101 K106 K107W30-L103 HydrophobicContact CE3-CD2 4.05Å; W30-L103 HydrophobicContact CH2-CD1 4.23Å; W30-L103 HydrophobicContact CH2-CD2 4.34Å; W30-L103 HydrophobicContact CZ3-CD1 4.31Å; W30-L103 HydrophobicContact CZ3-CD2 3.71Å; L41-L103 HydrophobicContact CB-CD2 4.42Å; L41-L103 HydrophobicContact CD1-CD2 4.13Å; L41-L103 HydrophobicContact CD2-CD2 4.35Å; V47-L103 HydrophobicContact CG1-CD1 4.13Å; V47-L103 HydrophobicContact CG2-CD1 4.18Å; F50-L103 HydrophobicContact CD2-CD1 3.98Å; L96-L103 HydrophobicContact CD2-CD2 3.84Å; L96-L103 HydrophobicContact CD2-CG 4.22Å; L99-L103 HydrophobicContact CB-CD2 4.22Å; L99-L103 HydrophobicContact CD1-CD2 3.9Å; P100-L103 VanDerWaalsContact O-CB 3.25Å; P100-L103 WeakPolarHBondContact O-CB 3.35Å; P100-L103 PolarHBondContact O-N 2.74Å; E101-L103 PolarHBondContact O-N 2.98Å; L103-K106 PolarHBondContact O-N 2.84Å; L103-K107 HydrophobicContact CD1-CD 3.56Å; L103-K107 HydrophobicContact CD1-CG 4.31Å; L103-K107 HydrophobicContact CG-CD 3.89Å; L103-K107 WeakPolarHBondContact O-CB 3.07Å; L103-K107 WeakPolarHBondContact O-CG 3.15Å; L103-K107 PolarHBondContact O-N 3.13Å
104A94.9Very high94.3Very high23 Ų2346.6 Ų46.619%0.1925%0.245CC..Hα-helixtrans-65-42.517800000112L96 E101 K106 K107 L108L96-A104 HydrophobicContact CB-CB 4.35Å; L96-A104 HydrophobicContact CD1-CB 4.27Å; E101-A104 PolarHBondContact O-N 2.88Å; A104-K106 VanDerWaalsContact C-N 3.26Å; A104-K106 PolarHBondContact O-N 3.34Å; A104-K107 PolarHBondContact O-N 3.34Å; A104-L108 HydrophobicContact CB-CD1 4.23Å; A104-L108 WeakPolarHBondContact O-CB 3.28Å; A104-L108 WeakPolarHBondContact O-CG 3.08Å; A104-L108 PolarHBondContact O-N 2.95Å
105A94.9Very high94.2Very high68 Ų6845.3 Ų45.356%0.56224%0.236SC*.Hα-helixtrans-59.5-32.8178.900000113.2E101 P109E101-A105 VanDerWaalsContact O-CB 3.25Å; E101-A105 WeakPolarHBondContact O-CB 3.4Å; E101-A105 PolarHBondContact O-N 3.01Å; A105-P109 WeakPolarHBondContact O-CD 3.47Å; A105-P109 VanDerWaalsContact O-CG 3.25Å; A105-P109 WeakPolarHBondContact O-CG 3.38Å
106K93.7Very high94.1Very high77 Ų7746.4 Ų46.434%0.33524%0.243SC..Hα-helixtrans-89.1-37.7175.5-73.8-172.4168.9-171.70113.9V47 D48 C102 L103 A104V47-K106 HydrophobicContact CB-CD 4.33Å; V47-K106 HydrophobicContact CG1-CB 3.77Å; V47-K106 HydrophobicContact CG1-CD 3.6Å; V47-K106 HydrophobicContact CG1-CG 4.2Å; D48-K106 WeakPolarHBondContact OD1-CD 3.37Å; D48-K106 WeakPolarHBondContact OD1-CE 3.46Å; D48-K106 IonicContact OD1-NZ 2.65Å; D48-K106 PolarHBondContact OD1-NZ 2.87Å; D48-K106 IonicContact OD2-NZ 2.83Å; D48-K106 PolarHBondContact OD2-NZ 3.49Å; C102-K106 PolarHBondContact O-N 3.14Å; L103-K106 PolarHBondContact O-N 2.84Å; A104-K106 VanDerWaalsContact C-N 3.26Å; A104-K106 PolarHBondContact O-N 3.34Å
107K95.4Very high93.9Very high1 Ų146.6 Ų46.60%0.00425%0.245CC..Hα-helixtrans-74-44.2-178.2-70.5177.163.2690113.6Y3 W30 D54 L96 L103 A104 I110 A111Y3-K107 PolarHBondContact OH-NZ 3.3Å; W30-K107 HydrophobicContact CH2-CD 4.24Å; W30-K107 HydrophobicContact CZ2-CD 4.09Å; D54-K107 IonicContact OD1-NZ 2.71Å; D54-K107 PolarHBondContact OD1-NZ 3.26Å; D54-K107 IonicContact OD2-NZ 2.71Å; D54-K107 PolarHBondContact OD2-NZ 3.5Å; L96-K107 HydrophobicContact CD1-CB 4.23Å; L96-K107 HydrophobicContact CD1-CD 4.13Å; L96-K107 HydrophobicContact CD2-CD 4.43Å; L103-K107 HydrophobicContact CD1-CD 3.56Å; L103-K107 HydrophobicContact CD1-CG 4.31Å; L103-K107 HydrophobicContact CG-CD 3.89Å; L103-K107 WeakPolarHBondContact O-CB 3.07Å; L103-K107 WeakPolarHBondContact O-CG 3.15Å; L103-K107 PolarHBondContact O-N 3.13Å; A104-K107 PolarHBondContact O-N 3.34Å; K107-I110 WeakPolarHBondContact O-CB 3.44Å; K107-I110 PolarHBondContact O-N 2.96Å; K107-A111 PolarHBondContact O-N 2.83Å; K107-A111 VanDerWaalsContact O-N 3.11Å
108L96Very high93.8Very high24 Ų2441.6 Ų41.613%0.12622%0.222CC..Hα-helixtrans-61-39.7-174.6-66.7173.4000113.7L92 A93 A104 I110 A111 R112L92-L108 HydrophobicContact CD2-CD2 4.19Å; L92-L108 HydrophobicContact CG-CD2 4.22Å; A93-L108 HydrophobicContact CB-CD1 4.44Å; A93-L108 HydrophobicContact CB-CD2 3.99Å; A104-L108 HydrophobicContact CB-CD1 4.23Å; A104-L108 WeakPolarHBondContact O-CB 3.28Å; A104-L108 WeakPolarHBondContact O-CG 3.08Å; A104-L108 PolarHBondContact O-N 2.95Å; L108-I110 PolarHBondContact O-N 3.34Å; L108-A111 PolarHBondContact O-N 3.47Å; L108-R112 WeakPolarHBondContact O-CB 3.37Å; L108-R112 WeakPolarHBondContact O-CG 3.41Å; L108-R112 PolarHBondContact O-N 3.03Å
109P94.9Very high93.9Very high23 Ų2337.4 Ų37.415%0.14920%0.197CC..Hα-helixtrans-61.3-20.3171.5-26.636.6000115.5A105 R113 P636A105-P109 WeakPolarHBondContact O-CD 3.47Å; A105-P109 VanDerWaalsContact O-CG 3.25Å; A105-P109 WeakPolarHBondContact O-CG 3.38Å; P109-R113 WeakPolarHBondContact O-CG 3.41Å; P109-R113 PolarHBondContact O-NH1 3.48Å; P109-P636 HydrophobicContact CB-CB 4.17Å; P109-P636 HydrophobicContact CB-CG 4.07Å; P109-P636 HydrophobicContact CG-CB 4.44Å
110I95Very high93.8Very high11 Ų1136.1 Ų36.16%0.05619%0.19CC..Hα-helixtrans-85.7-44.9177-53.3177.1000109.6C51 D54 Y58 K107 L108 R112 R113 F114 L283C51-I110 HydrophobicContact CB-CD1 3.32Å; C51-I110 VanDerWaalsContact SG-CD1 3.54Å; D54-I110 HydrophobicContact CB-CG2 4.34Å; Y58-I110 HydrophobicContact CD2-CG2 3.91Å; Y58-I110 HydrophobicContact CE2-CB 4.41Å; Y58-I110 HydrophobicContact CE2-CG2 3.88Å; K107-I110 WeakPolarHBondContact O-CB 3.44Å; K107-I110 PolarHBondContact O-N 2.96Å; L108-I110 PolarHBondContact O-N 3.34Å; I110-R112 VanDerWaalsContact C-N 3.28Å; I110-R112 PolarHBondContact O-N 3.02Å; I110-R113 PolarHBondContact O-N 3.19Å; I110-R113 VanDerWaalsContact O-N 3.15Å; I110-F114 PolarHBondContact O-N 3.42Å; I110-F114 VanDerWaalsContact O-N 3.1Å; I110-L283 HydrophobicContact CD1-CD1 4.12Å
111A96.1Very high93.8Very high0 Ų036.5 Ų36.50%019%0.189CC..Hα-helixtrans-58.7-38.2172.900000112.7Y58 L92 K107 L108 F114 V115Y58-A111 HydrophobicContact CE2-CB 4.19Å; L92-A111 HydrophobicContact CD2-CB 3.45Å; L92-A111 VanDerWaalsContact CD2-CB 3.45Å; K107-A111 PolarHBondContact O-N 2.83Å; K107-A111 VanDerWaalsContact O-N 3.11Å; L108-A111 PolarHBondContact O-N 3.47Å; A111-F114 PolarHBondContact O-N 2.98Å; A111-V115 WeakPolarHBondContact O-CB 3.5Å; A111-V115 WeakPolarHBondContact O-CG2 3.44Å; A111-V115 PolarHBondContact O-N 3.13Å
112R94.7Very high93.8Very high107 Ų10728.4 Ų28.440%0.40415%0.152SC..Hα-helixtrans-59.1-44.6173-78.8171.1-172.5133.712.7113E89 L108 I110 V115 S116E89-R112 IonicContact OE1-CZ 3.13Å; E89-R112 IonicContact OE1-NE 2.74Å; E89-R112 PolarHBondContact OE1-NE 3.27Å; E89-R112 IonicContact OE1-NH2 2.69Å; E89-R112 PolarHBondContact OE1-NH2 3.12Å; E89-R112 VanDerWaalsContact OE2-CG 3.25Å; E89-R112 WeakPolarHBondContact OE2-CG 3.14Å; E89-R112 IonicContact OE2-NE 3.59Å; L108-R112 WeakPolarHBondContact O-CB 3.37Å; L108-R112 WeakPolarHBondContact O-CG 3.41Å; L108-R112 PolarHBondContact O-N 3.03Å; I110-R112 VanDerWaalsContact C-N 3.28Å; I110-R112 PolarHBondContact O-N 3.02Å; R112-V115 PolarHBondContact O-N 3.37Å; R112-S116 WeakPolarHBondContact O-CB 3.27Å; R112-S116 PolarHBondContact O-N 3.5Å
113R92.7Very high93.7Very high59 Ų5926 Ų2622%0.22314%0.135CC..Hα-helixtrans-65.1-41.9178.3-69.7-169.7-40-9113.4112P109 I110 S116 S117 N276P109-R113 WeakPolarHBondContact O-CG 3.41Å; P109-R113 PolarHBondContact O-NH1 3.48Å; I110-R113 PolarHBondContact O-N 3.19Å; I110-R113 VanDerWaalsContact O-N 3.15Å; R113-S116 PolarHBondContact O-N 3.49Å; R113-S117 WeakPolarHBondContact O-CB 3.41Å; R113-S117 PolarHBondContact O-N 2.91Å; R113-N276 WeakPolarHBondContact CB-OD1 3.36Å; R113-N276 VanDerWaalsContact CD-OD1 3.29Å; R113-N276 WeakPolarHBondContact CD-OD1 3.47Å
114F94.3Very high93.7Very high9 Ų926.2 Ų26.24%0.03914%0.136CC..Hα-helixtrans-59-51.1172.2168.5-122.2000112Y58 L61 F84 W88 I110 A111 S116 S117 L118Y58-F114 HydrophobicContact CD1-CD1 4.07Å; Y58-F114 HydrophobicContact CD1-CE1 4.35Å; Y58-F114 HydrophobicContact CD1-CG 4.22Å; Y58-F114 HydrophobicContact CD2-CB 3.51Å; Y58-F114 HydrophobicContact CD2-CD1 4.26Å; Y58-F114 AromaticContact CD2-CG 3.94Å; Y58-F114 HydrophobicContact CD2-CG 3.94Å; Y58-F114 HydrophobicContact CE1-CD1 4.5Å; Y58-F114 HydrophobicContact CE2-CB 4.25Å; Y58-F114 HydrophobicContact CG-CB 3.75Å; Y58-F114 AromaticContact CG-CD1 3.96Å; Y58-F114 HydrophobicContact CG-CD1 3.96Å; Y58-F114 HydrophobicContact CG-CD2 4.09Å; Y58-F114 AromaticContact CG-CG 3.67Å; Y58-F114 HydrophobicContact CG-CG 3.67Å; Y58-F114 WeakPolarHBondContact O-CE2 3.26Å; L61-F114 HydrophobicContact CB-CE2 3.92Å; L61-F114 HydrophobicContact CB-CZ 3.9Å; L61-F114 HydrophobicContact CD1-CE1 4.35Å; L61-F114 HydrophobicContact CD1-CZ 3.89Å; F84-F114 HydrophobicContact CE1-CE1 4.21Å; F84-F114 AromaticContact CE1-CZ 3.99Å; F84-F114 HydrophobicContact CE1-CZ 3.99Å; F84-F114 HydrophobicContact CZ-CE1 4.43Å; F84-F114 HydrophobicContact CZ-CZ 4.44Å; W88-F114 HydrophobicContact CD2-CD1 4.32Å; W88-F114 AromaticContact CD2-CE1 3.94Å; W88-F114 HydrophobicContact CD2-CE1 3.94Å; W88-F114 HydrophobicContact CE3-CE1 4.24Å; W88-F114 HydrophobicContact CG-CD1 4.35Å; W88-F114 HydrophobicContact CG-CE1 4.24Å; W88-F114 AromaticContact NE1-CD1 3.97Å; I110-F114 PolarHBondContact O-N 3.42Å; I110-F114 VanDerWaalsContact O-N 3.1Å; A111-F114 PolarHBondContact O-N 2.98Å; F114-S116 VanDerWaalsContact C-N 3.33Å; F114-S116 PolarHBondContact O-N 3.49Å; F114-S117 PolarHBondContact O-N 3.31Å; F114-L118 HydrophobicContact CE2-CD2 4.11Å; F114-L118 HydrophobicContact CZ-CD2 3.89Å; F114-L118 WeakPolarHBondContact O-CB 3.4Å; F114-L118 PolarHBondContact O-N 2.83Å
115V94.7Very high93.5Very high5 Ų525.5 Ų25.53%0.0313%0.129CC..Hα-helixtrans-60.6-40.2178.5163.10000112.3A85 W88 A111 R112 K119A85-V115 WeakPolarHBondContact O-CG1 3.3Å; W88-V115 HydrophobicContact CB-CG2 3.77Å; W88-V115 HydrophobicContact CG-CG2 3.94Å; A111-V115 WeakPolarHBondContact O-CB 3.5Å; A111-V115 WeakPolarHBondContact O-CG2 3.44Å; A111-V115 PolarHBondContact O-N 3.13Å; R112-V115 PolarHBondContact O-N 3.37Å; V115-K119 HydrophobicContact CG1-CD 4.01Å; V115-K119 VanDerWaalsContact CG1-CE 3.49Å; V115-K119 WeakPolarHBondContact O-CB 3.44Å; V115-K119 WeakPolarHBondContact O-CD 3.47Å; V115-K119 VanDerWaalsContact O-CG 3.22Å; V115-K119 WeakPolarHBondContact O-CG 3.45Å; V115-K119 PolarHBondContact O-N 2.88Å; V115-K119 VanDerWaalsContact O-N 3.09Å
116S92.6Very high93.4Very high22 Ų2224.4 Ų24.415%0.15411%0.112CC..Hα-helixtrans-63.6-52.1175.6-1630000111R112 R113 F114 L118 K119 R120 E272R112-S116 WeakPolarHBondContact O-CB 3.27Å; R112-S116 PolarHBondContact O-N 3.5Å; R113-S116 PolarHBondContact O-N 3.49Å; F114-S116 VanDerWaalsContact C-N 3.33Å; F114-S116 PolarHBondContact O-N 3.49Å; S116-L118 VanDerWaalsContact C-N 3.34Å; S116-L118 PolarHBondContact O-N 3.33Å; S116-K119 WeakPolarHBondContact O-CB 3.43Å; S116-K119 PolarHBondContact O-N 3.4Å; S116-R120 WeakPolarHBondContact O-CB 3.37Å; S116-R120 PolarHBondContact O-N 3.01Å; S116-E272 VanDerWaalsContact CB-OE1 3.24Å; S116-E272 WeakPolarHBondContact CB-OE1 3.44Å; S116-E272 PolarHBondContact OG-OE1 2.84Å
117S91.9Very high93.3Very high12 Ų1221.8 Ų21.88%0.08410%0.102CC..Hα-helixtrans-59.3-41.3179.2-167.80000112.6R113 F114 R120 Q121R113-S117 WeakPolarHBondContact O-CB 3.41Å; R113-S117 PolarHBondContact O-N 2.91Å; F114-S117 PolarHBondContact O-N 3.31Å; S117-R120 WeakPolarHBondContact O-CB 3.33Å; S117-R120 PolarHBondContact O-N 3.42Å; S117-Q121 WeakPolarHBondContact O-CB 3.27Å; S117-Q121 WeakPolarHBondContact O-CG 3.37Å; S117-Q121 PolarHBondContact O-N 3.01Å
118L92.6Very high93.2Very high0 Ų021.7 Ų21.70%010%0.101CC..Hα-helixtrans-69.7-36.9179.2-166.163.6000112.2L65 I66 I81 F84 A85 F114 S116 T122L65-L118 HydrophobicContact CB-CD1 4.49Å; L65-L118 HydrophobicContact CD1-CD1 4.47Å; L65-L118 HydrophobicContact CD1-CD2 4.18Å; I66-L118 HydrophobicContact CD1-CD1 3.77Å; I66-L118 HydrophobicContact CG1-CD1 4.22Å; I81-L118 HydrophobicContact CG2-CD1 3.89Å; I81-L118 HydrophobicContact CG2-CD2 4.03Å; I81-L118 HydrophobicContact CG2-CG 3.82Å; F84-L118 HydrophobicContact CD1-CD2 3.83Å; F84-L118 HydrophobicContact CE1-CD2 3.87Å; A85-L118 HydrophobicContact CB-CB 4.42Å; A85-L118 HydrophobicContact CB-CD2 4.03Å; A85-L118 HydrophobicContact CB-CG 4.33Å; F114-L118 HydrophobicContact CE2-CD2 4.11Å; F114-L118 HydrophobicContact CZ-CD2 3.89Å; F114-L118 WeakPolarHBondContact O-CB 3.4Å; F114-L118 PolarHBondContact O-N 2.83Å; S116-L118 VanDerWaalsContact C-N 3.34Å; S116-L118 PolarHBondContact O-N 3.33Å; L118-T122 WeakPolarHBondContact O-CG2 3.23Å; L118-T122 PolarHBondContact O-N 2.81Å; L118-T122 VanDerWaalsContact O-N 3.13Å; L118-T122 PolarHBondContact O-OG1 3.33Å
119K92.2Very high93Very high61 Ų6122.4 Ų22.427%0.26510%0.104SC..Hα-helixtrans-65.4-43170-73.8167.8-179.9172.30111.7A85 V115 S116 T122 S123 V626A85-K119 HydrophobicContact CB-CG 4.09Å; V115-K119 HydrophobicContact CG1-CD 4.01Å; V115-K119 VanDerWaalsContact CG1-CE 3.49Å; V115-K119 WeakPolarHBondContact O-CB 3.44Å; V115-K119 WeakPolarHBondContact O-CD 3.47Å; V115-K119 VanDerWaalsContact O-CG 3.22Å; V115-K119 WeakPolarHBondContact O-CG 3.45Å; V115-K119 PolarHBondContact O-N 2.88Å; V115-K119 VanDerWaalsContact O-N 3.09Å; S116-K119 WeakPolarHBondContact O-CB 3.43Å; S116-K119 PolarHBondContact O-N 3.4Å; K119-T122 PolarHBondContact O-OG1 2.91Å; K119-T122 VanDerWaalsContact O-OG1 3.09Å; K119-S123 VanDerWaalsContact O-CB 3.31Å; K119-S123 WeakPolarHBondContact O-CB 3.32Å; K119-S123 PolarHBondContact O-N 2.87Å; K119-V626 HydrophobicContact CB-CG1 3.79Å; K119-V626 HydrophobicContact CD-CB 4.3Å; K119-V626 HydrophobicContact CD-CG1 4.23Å
120R92.3Very high92.8Very high0 Ų025.2 Ų25.20%012%0.117CC..Hα-helixtrans-62.3-49.4178.8-17868.664.3-168.4-3.3111.7S116 S117 S123 F124 E265 L269 E272 V626 H627S116-R120 WeakPolarHBondContact O-CB 3.37Å; S116-R120 PolarHBondContact O-N 3.01Å; S117-R120 WeakPolarHBondContact O-CB 3.33Å; S117-R120 PolarHBondContact O-N 3.42Å; R120-S123 PolarHBondContact O-N 2.68Å; R120-F124 WeakPolarHBondContact O-CB 3.36Å; R120-F124 PolarHBondContact O-N 3.29Å; R120-E265 WeakPolarHBondContact CD-OE1 3.33Å; R120-E265 IonicContact CZ-OE2 2.75Å; R120-E265 IonicContact NH1-OE1 2.89Å; R120-E265 IonicContact NH1-OE2 3.31Å; R120-E265 PolarHBondContact NH1-OE2 3.02Å; R120-L269 HydrophobicContact CB-CD1 4.42Å; R120-L269 HydrophobicContact CG-CB 3.7Å; R120-L269 HydrophobicContact CG-CD1 3.72Å; R120-L269 HydrophobicContact CG-CG 4.27Å; R120-E272 WeakPolarHBondContact CB-OE2 3.15Å; R120-E272 WeakPolarHBondContact CG-OE2 3.25Å; R120-E272 IonicContact NE-OE2 3.95Å; R120-V626 PolarHBondContact NH2-O 3.26Å; R120-H627 PolarHBondContact NH1-ND1 3.07Å; R120-H627 VanDerWaalsContact NH1-ND1 3.19Å
121Q91.6Very high92.8Very high39 Ų3924.8 Ų24.818%0.18212%0.115CC..Hα-helixtrans-65.2-41.9178.9-71.6-175.315.800112.5I66 S117 F124 L125 L269I66-Q121 HydrophobicContact CD1-CB 3.44Å; I66-Q121 VanDerWaalsContact CD1-CB 3.44Å; S117-Q121 WeakPolarHBondContact O-CB 3.27Å; S117-Q121 WeakPolarHBondContact O-CG 3.37Å; S117-Q121 PolarHBondContact O-N 3.01Å; Q121-F124 PolarHBondContact O-N 2.91Å; Q121-L125 VanDerWaalsContact O-CB 3.3Å; Q121-L125 WeakPolarHBondContact O-CB 3.14Å; Q121-L125 PolarHBondContact O-N 2.82Å; Q121-L269 HydrophobicContact CG-CD1 3.45Å; Q121-L269 VanDerWaalsContact CG-CD1 3.45Å; Q121-L269 HydrophobicContact CG-CD2 4.2Å; Q121-L269 HydrophobicContact CG-CG 4.49Å
122T92.1Very high92.7Very high0 Ų027 Ų270%012%0.123CC..Hα-helixtrans-66.7-35.5176.248.30000113I66 L78 I81 R82 L118 K119 H126I66-T122 HydrophobicContact CD1-CG2 3.78Å; L78-T122 HydrophobicContact CD2-CG2 3.83Å; I81-T122 HydrophobicContact CB-CG2 4.18Å; I81-T122 HydrophobicContact CG2-CG2 3.59Å; R82-T122 HydrophobicContact CG-CG2 4.38Å; R82-T122 WeakPolarHBondContact CG-OG1 3.22Å; L118-T122 WeakPolarHBondContact O-CG2 3.23Å; L118-T122 PolarHBondContact O-N 2.81Å; L118-T122 VanDerWaalsContact O-N 3.13Å; L118-T122 PolarHBondContact O-OG1 3.33Å; K119-T122 PolarHBondContact O-OG1 2.91Å; K119-T122 VanDerWaalsContact O-OG1 3.09Å; T122-H126 WeakPolarHBondContact O-CB 3.49Å; T122-H126 PolarHBondContact O-N 2.97Å; T122-H126 VanDerWaalsContact O-N 3.13Å
123S92.3Very high92.7Very high5 Ų525.8 Ų25.84%0.03513%0.129CC..Hα-helixtrans-64.9-49.9172167.30000111.9K119 R120 L125 H126 L127 E265 Y623 H627K119-S123 VanDerWaalsContact O-CB 3.31Å; K119-S123 WeakPolarHBondContact O-CB 3.32Å; K119-S123 PolarHBondContact O-N 2.87Å; R120-S123 PolarHBondContact O-N 2.68Å; S123-L125 PolarHBondContact O-N 3.38Å; S123-H126 PolarHBondContact O-N 3.39Å; S123-L127 PolarHBondContact O-N 3.16Å; S123-E265 WeakPolarHBondContact CB-OE1 3.31Å; S123-E265 PolarHBondContact OG-OE1 3.31Å; S123-Y623 PolarHBondContact OG-OH 2.89Å; S123-H627 PolarHBondContact OG-CE1 2.81Å
124F93.1Very high92.7Very high5 Ų523.8 Ų23.82%0.02213%0.125CC..Hα-helixtrans-56.8-48.1176.5172.8-103.4000112.2M70 R120 Q121 H126 L127 A128 I201 L262 E265 Y266 L269M70-F124 HydrophobicContact CE-CE1 3.87Å; M70-F124 HydrophobicContact SD-CE1 3.88Å; R120-F124 WeakPolarHBondContact O-CB 3.36Å; R120-F124 PolarHBondContact O-N 3.29Å; Q121-F124 PolarHBondContact O-N 2.91Å; F124-H126 VanDerWaalsContact C-N 3.33Å; F124-H126 PolarHBondContact O-N 3.35Å; F124-L127 PolarHBondContact O-N 2.89Å; F124-A128 HydrophobicContact CE1-CB 4.45Å; F124-A128 HydrophobicContact CZ-CB 4.32Å; F124-A128 PolarHBondContact O-N 3.3Å; F124-I201 HydrophobicContact CE1-CD1 4.22Å; F124-I201 HydrophobicContact CZ-CD1 3.78Å; F124-I201 HydrophobicContact CZ-CG1 4.05Å; F124-L262 HydrophobicContact CD2-CD1 4.05Å; F124-L262 HydrophobicContact CE2-CD1 3.43Å; F124-L262 VanDerWaalsContact CE2-CD1 3.43Å; F124-L262 HydrophobicContact CE2-CG 4.14Å; F124-L262 HydrophobicContact CZ-CD1 4.1Å; F124-E265 HydrophobicContact CB-CG 3.92Å; F124-Y266 HydrophobicContact CD1-CD2 4.43Å; F124-Y266 HydrophobicContact CD2-CD2 4.04Å; F124-Y266 HydrophobicContact CE1-CD2 4.01Å; F124-Y266 AromaticContact CE2-CD2 3.59Å; F124-Y266 HydrophobicContact CE2-CD2 3.59Å; F124-Y266 HydrophobicContact CE2-CG 4.05Å; F124-Y266 HydrophobicContact CG-CD2 4.46Å; F124-Y266 AromaticContact CZ-CD2 3.58Å; F124-Y266 HydrophobicContact CZ-CD2 3.58Å; F124-Y266 HydrophobicContact CZ-CE2 4.36Å; F124-Y266 HydrophobicContact CZ-CG 4.4Å; F124-L269 HydrophobicContact CB-CD2 4.03Å; F124-L269 HydrophobicContact CD1-CD2 3.9Å; F124-L269 HydrophobicContact CG-CD2 3.94Å
125L91.1Very high92.7Very high8 Ų823.6 Ų23.64%0.04213%0.125CC..Hα-helixtrans-64.5-37.4-178.6-179.154.2000112.3I66 M70 M73 L78 Q121 S123 A128 Q129I66-L125 HydrophobicContact CG2-CD2 4.12Å; M70-L125 HydrophobicContact CB-CD1 4.39Å; M73-L125 HydrophobicContact CE-CD2 3.84Å; M73-L125 HydrophobicContact CG-CD2 4.07Å; M73-L125 HydrophobicContact SD-CD2 4.37Å; L78-L125 HydrophobicContact CD2-CD2 4.26Å; Q121-L125 VanDerWaalsContact O-CB 3.3Å; Q121-L125 WeakPolarHBondContact O-CB 3.14Å; Q121-L125 PolarHBondContact O-N 2.82Å; S123-L125 PolarHBondContact O-N 3.38Å; L125-A128 WeakPolarHBondContact O-CB 3.25Å; L125-A128 PolarHBondContact O-N 3.47Å; L125-Q129 WeakPolarHBondContact O-CG 3.36Å; L125-Q129 PolarHBondContact O-N 2.85Å
126H91.4Very high92.6Very high44 Ų4431.8 Ų31.820%0.20416%0.16CC..Hα-helixtrans-63.9-42.1172.6173.9-98.4000112.1T122 S123 F124 Q129 I130T122-H126 WeakPolarHBondContact O-CB 3.49Å; T122-H126 PolarHBondContact O-N 2.97Å; T122-H126 VanDerWaalsContact O-N 3.13Å; S123-H126 PolarHBondContact O-N 3.39Å; F124-H126 VanDerWaalsContact C-N 3.33Å; F124-H126 PolarHBondContact O-N 3.35Å; H126-Q129 PolarHBondContact O-N 3.33Å; H126-I130 WeakPolarHBondContact O-CG1 3.3Å; H126-I130 PolarHBondContact O-N 2.9Å
127L93Very high92.8Very high22 Ų2234 Ų3412%0.11517%0.17CC..Hα-helixtrans-64.2-39.4172.3-72.3171.4000112S123 F124 Q129 I130 A131 L258 M261 L262 E265S123-L127 PolarHBondContact O-N 3.16Å; F124-L127 PolarHBondContact O-N 2.89Å; L127-Q129 PolarHBondContact O-N 3.15Å; L127-I130 PolarHBondContact O-N 3.47Å; L127-A131 VanDerWaalsContact O-CB 3.26Å; L127-A131 WeakPolarHBondContact O-CB 3.48Å; L127-A131 PolarHBondContact O-N 3.38Å; L127-L258 HydrophobicContact CD2-CD1 4.47Å; L127-M261 HydrophobicContact CD1-CB 4.26Å; L127-M261 HydrophobicContact CD2-CB 4.17Å; L127-L262 HydrophobicContact CB-CD1 3.92Å; L127-E265 HydrophobicContact CD1-CB 3.73Å; L127-E265 HydrophobicContact CD1-CG 4.02Å
128A92.8Very high92.9Very high0 Ų038.9 Ų38.90%019%0.192CC..Hα-helixtrans-62.4-41.4176.800000112.1F124 L125 I130 A131 R132 V197 L262F124-A128 HydrophobicContact CE1-CB 4.45Å; F124-A128 HydrophobicContact CZ-CB 4.32Å; F124-A128 PolarHBondContact O-N 3.3Å; L125-A128 WeakPolarHBondContact O-CB 3.25Å; L125-A128 PolarHBondContact O-N 3.47Å; A128-I130 PolarHBondContact O-N 3.36Å; A128-A131 PolarHBondContact O-N 3.1Å; A128-R132 WeakPolarHBondContact O-CG 3.38Å; A128-R132 PolarHBondContact O-N 3.31Å; A128-V197 HydrophobicContact CB-CG1 4.03Å; A128-L262 HydrophobicContact CB-CD1 3.99Å
129Q91.4Very high93Very high39 Ų3943.7 Ų43.718%0.18222%0.221CC..Hα-helixtrans-60.3-42.9174.3-73.8173.8-50.600112.4M73 L125 H126 L127 P133M73-Q129 PolarHBondContact O-NE2 2.81Å; L125-Q129 WeakPolarHBondContact O-CG 3.36Å; L125-Q129 PolarHBondContact O-N 2.85Å; H126-Q129 PolarHBondContact O-N 3.33Å; L127-Q129 PolarHBondContact O-N 3.15Å; Q129-P133 WeakPolarHBondContact O-CD 3.47Å
130I92.1Very high93.2Very high82 Ų8242.6 Ų42.642%0.42122%0.219SC..Hα-helixtrans-72.5-34.5178.7-59.3166.2000111.1H126 L127 A128 L258H126-I130 WeakPolarHBondContact O-CG1 3.3Å; H126-I130 PolarHBondContact O-N 2.9Å; L127-I130 PolarHBondContact O-N 3.47Å; A128-I130 PolarHBondContact O-N 3.36Å; I130-L258 HydrophobicContact CB-CD1 4.13Å; I130-L258 HydrophobicContact CG2-CD1 3.74Å; I130-L258 HydrophobicContact CG2-CD2 3.86Å; I130-L258 HydrophobicContact CG2-CG 4.47Å
131A94.2Very high93.4Very high1 Ų142.7 Ų42.71%0.00822%0.22CC..Hα-helixtrans-74.9-32.3-178.800000114.4L127 A128 A134 L135 V197 L258 L262L127-A131 VanDerWaalsContact O-CB 3.26Å; L127-A131 WeakPolarHBondContact O-CB 3.48Å; L127-A131 PolarHBondContact O-N 3.38Å; A128-A131 PolarHBondContact O-N 3.1Å; A131-A134 PolarHBondContact O-N 3.01Å; A131-A134 VanDerWaalsContact O-N 3.14Å; A131-L135 PolarHBondContact O-N 2.93Å; A131-V197 HydrophobicContact CB-CG2 4.13Å; A131-L258 HydrophobicContact CB-CD1 4.48Å; A131-L258 HydrophobicContact CB-CD2 4.49Å; A131-L258 HydrophobicContact CB-CG 4.24Å; A131-L262 HydrophobicContact CB-CD2 3.8Å
132R93.9Very high93.6Very high47 Ų4744 Ų4418%0.17723%0.231CC..Hα-helixtrans-56.4-49.1-177.9-82.2-177.4-169.3116.92.1113.6M70 A128 A134 L135 F136 V197 E198M70-R132 VanDerWaalsContact CB-NH2 3.31Å; M70-R132 PolarHBondContact O-NH1 2.94Å; M70-R132 PolarHBondContact O-NH2 3.21Å; A128-R132 WeakPolarHBondContact O-CG 3.38Å; A128-R132 PolarHBondContact O-N 3.31Å; R132-A134 VanDerWaalsContact C-N 3.32Å; R132-A134 PolarHBondContact O-N 2.89Å; R132-L135 PolarHBondContact O-N 2.96Å; R132-F136 WeakPolarHBondContact O-CB 3.42Å; R132-F136 PolarHBondContact O-N 2.89Å; R132-V197 HydrophobicContact CG-CB 4.2Å; R132-V197 HydrophobicContact CG-CG2 3.65Å; R132-E198 IonicContact CZ-OE1 2.72Å; R132-E198 IonicContact NE-OE1 2.69Å; R132-E198 PolarHBondContact NE-OE1 3.34Å; R132-E198 IonicContact NH2-OE1 2.94Å; R132-E198 PolarHBondContact NH2-OE1 3.43Å
133P93.5Very high93.8Very high81 Ų8144.7 Ų44.753%0.52624%0.238SC..Hα-helixtrans-57.8-40.6174.4-27.135.5000113.6Q129 L135 F136 D137Q129-P133 WeakPolarHBondContact O-CD 3.47Å; P133-L135 VanDerWaalsContact C-N 3.32Å; P133-L135 PolarHBondContact O-N 3.05Å; P133-F136 PolarHBondContact O-N 3.01Å; P133-D137 PolarHBondContact O-N 3.42Å
134A93.8Very high94Very high17 Ų1744.4 Ų44.414%0.1424%0.236CC..Hα-helixtrans-70.9-24.8-179.200000113.8A131 R132 L258A131-A134 PolarHBondContact O-N 3.01Å; A131-A134 VanDerWaalsContact O-N 3.14Å; R132-A134 VanDerWaalsContact C-N 3.32Å; R132-A134 PolarHBondContact O-N 2.89Å; A134-L258 HydrophobicContact CB-CD2 4.03Å
135L93.8Very high94.1Very high6 Ų645.4 Ų45.43%0.03124%0.243CC..Hα-helixtrans-89.9-18171.8-73.4173000113.2A131 R132 P133 V141 M144 L191 N194 V197 F200 I259A131-L135 PolarHBondContact O-N 2.93Å; R132-L135 PolarHBondContact O-N 2.96Å; P133-L135 VanDerWaalsContact C-N 3.32Å; P133-L135 PolarHBondContact O-N 3.05Å; L135-V141 WeakPolarHBondContact O-CG2 3.32Å; L135-M144 HydrophobicContact CD2-CE 4.21Å; L135-L191 HydrophobicContact CD2-CD2 4.41Å; L135-N194 PolarHBondContact O-ND2 3.09Å; L135-V197 HydrophobicContact CD1-CG2 3.78Å; L135-F200 HydrophobicContact CD1-CD2 3.83Å; L135-F200 HydrophobicContact CD1-CE2 3.8Å; L135-F200 HydrophobicContact CD2-CE2 3.72Å; L135-F200 HydrophobicContact CD2-CZ 4.37Å; L135-F200 HydrophobicContact CG-CE2 4.44Å; L135-I259 HydrophobicContact CD2-CD1 3.68Å; L135-I259 HydrophobicContact CD2-CG1 4.33Å; L135-I259 HydrophobicContact CG-CD1 4.41Å
136F93.8Very high94.3Very high177 Ų17750.3 Ų50.378%0.77627%0.268SS*.Hα-helixtrans-86.5-27.7174.9-169.2-98000112.7R132 P133 Q138R132-F136 WeakPolarHBondContact O-CB 3.42Å; R132-F136 PolarHBondContact O-N 2.89Å; P133-F136 PolarHBondContact O-N 3.01Å; F136-Q138 PolarHBondContact O-N 3.48Å; F136-Q138 VanDerWaalsContact O-N 3.12Å
137D95.1Very high94.5Very high68 Ų6849.3 Ų49.336%0.36426%0.264SS..  trans-73.4102.3174.8-170.4-29.6000111.4P133 T139 V140 V141P133-D137 PolarHBondContact O-N 3.42Å; D137-T139 PolarHBondContact O-N 3.47Å; D137-T139 VanDerWaalsContact O-N 3.11Å; D137-T139 WeakPolarHBondContact OD1-CA 3.1Å; D137-T139 VanDerWaalsContact OD1-CB 3.31Å; D137-T139 WeakPolarHBondContact OD1-CB 3.38Å; D137-T139 PolarHBondContact OD1-N 3.12Å; D137-T139 PolarHBondContact OD1-OG1 3.34Å; D137-V140 HydrophobicContact CB-CB 4.09Å; D137-V140 HydrophobicContact CB-CG2 3.87Å; D137-V140 PolarHBondContact O-N 2.81Å; D137-V140 PolarHBondContact OD1-N 3.36Å; D137-V141 PolarHBondContact O-N 3.3Å
138Q94.9Very high94.5Very high114 Ų11448.3 Ų48.353%0.53326%0.259SS..Hα-helixtrans-53.9-29.6177.3-172.665.182.400113.3F136 T142 N194F136-Q138 PolarHBondContact O-N 3.48Å; F136-Q138 VanDerWaalsContact O-N 3.12Å; Q138-T142 VanDerWaalsContact O-CB 3.29Å; Q138-T142 WeakPolarHBondContact O-CB 3.41Å; Q138-T142 PolarHBondContact O-N 2.99Å; Q138-T142 PolarHBondContact O-OG1 2.95Å; Q138-N194 PolarHBondContact NE2-OD1 2.88Å
139T95.3Very high94.5Very high102 Ų10251.8 Ų51.863%0.62628%0.278SS*.Hα-helixtrans-72.1-42.3178.372.40000111.1D137 T142 G143D137-T139 PolarHBondContact O-N 3.47Å; D137-T139 VanDerWaalsContact O-N 3.11Å; D137-T139 WeakPolarHBondContact OD1-CA 3.1Å; D137-T139 VanDerWaalsContact OD1-CB 3.31Å; D137-T139 WeakPolarHBondContact OD1-CB 3.38Å; D137-T139 PolarHBondContact OD1-N 3.12Å; D137-T139 PolarHBondContact OD1-OG1 3.34Å; T139-T142 PolarHBondContact O-N 2.92Å; T139-G143 PolarHBondContact O-N 3.36Å
140V95.8Very high94.4Very high37 Ų3753.9 Ų53.922%0.22430%0.296CS..Hα-helixtrans-66.4-44.7175.7-179.30000110.4D137 T142 G143 M144 S255D137-V140 HydrophobicContact CB-CB 4.09Å; D137-V140 HydrophobicContact CB-CG2 3.87Å; D137-V140 PolarHBondContact O-N 2.81Å; D137-V140 PolarHBondContact OD1-N 3.36Å; V140-T142 PolarHBondContact O-N 3.43Å; V140-G143 PolarHBondContact O-N 2.82Å; V140-M144 HydrophobicContact CG1-CE 4.12Å; V140-M144 WeakPolarHBondContact O-CG 3.35Å; V140-M144 PolarHBondContact O-N 2.92Å; V140-S255 WeakPolarHBondContact CG1-OG 3.41Å
141V96.3Very high94.2Very high2 Ų250.3 Ų50.31%0.01228%0.278CS..Hα-helixtrans-63.7-40.3175.9177.70000112L135 D137 G143 M144 V145 L191 N194L135-V141 WeakPolarHBondContact O-CG2 3.32Å; D137-V141 PolarHBondContact O-N 3.3Å; V141-G143 PolarHBondContact O-N 3.05Å; V141-M144 HydrophobicContact CB-CE 4.3Å; V141-M144 HydrophobicContact CG2-CE 3.84Å; V141-M144 PolarHBondContact O-N 3.1Å; V141-V145 WeakPolarHBondContact O-CG2 3.39Å; V141-V145 PolarHBondContact O-N 3.25Å; V141-L191 VanDerWaalsContact CG1-O 3.28Å; V141-L191 WeakPolarHBondContact CG1-O 3.4Å; V141-N194 WeakPolarHBondContact CB-OD1 3.5Å; V141-N194 HydrophobicContact CG1-CB 4.47Å; V141-N194 WeakPolarHBondContact CG1-OD1 3.45Å
142T96Very high93.6Very high67 Ų6754.1 Ų54.141%0.41130%0.298SS..Hα-helixtrans-64-41.8176-54.70000111.3Q138 T139 V140 M144 V145 L146Q138-T142 VanDerWaalsContact O-CB 3.29Å; Q138-T142 WeakPolarHBondContact O-CB 3.41Å; Q138-T142 PolarHBondContact O-N 2.99Å; Q138-T142 PolarHBondContact O-OG1 2.95Å; T139-T142 PolarHBondContact O-N 2.92Å; V140-T142 PolarHBondContact O-N 3.43Å; T142-M144 VanDerWaalsContact C-N 3.34Å; T142-M144 PolarHBondContact O-N 3.43Å; T142-V145 PolarHBondContact O-N 2.8Å; T142-L146 HydrophobicContact CG2-CD1 4.45Å; T142-L146 WeakPolarHBondContact O-CG 3.47Å; T142-L146 PolarHBondContact O-N 3.41Å; T142-L146 VanDerWaalsContact O-N 3.07Å
143G95.6Very high92.7Very high14 Ų1454.9 Ų54.914%0.14431%0.305CS..Hα-helixtrans-59-44.2171.800000112.3T139 V140 V141 V145 L146 D147T139-G143 PolarHBondContact O-N 3.36Å; V140-G143 PolarHBondContact O-N 2.82Å; V141-G143 PolarHBondContact O-N 3.05Å; G143-V145 PolarHBondContact O-N 3.5Å; G143-L146 PolarHBondContact O-N 3.29Å; G143-D147 WeakPolarHBondContact O-CB 3.45Å; G143-D147 PolarHBondContact O-N 2.83Å
144M96.4Very high91.7Very high0 Ų054.9 Ų54.90%031%0.307CS..Hα-helixtrans-61.2-42.8175.9-73.2-173-62.500112.8L135 V140 V141 T142 D147 I148 L191 S252 S255 F256 I259L135-M144 HydrophobicContact CD2-CE 4.21Å; V140-M144 HydrophobicContact CG1-CE 4.12Å; V140-M144 WeakPolarHBondContact O-CG 3.35Å; V140-M144 PolarHBondContact O-N 2.92Å; V141-M144 HydrophobicContact CB-CE 4.3Å; V141-M144 HydrophobicContact CG2-CE 3.84Å; V141-M144 PolarHBondContact O-N 3.1Å; T142-M144 VanDerWaalsContact C-N 3.34Å; T142-M144 PolarHBondContact O-N 3.43Å; M144-D147 PolarHBondContact O-N 2.65Å; M144-I148 WeakPolarHBondContact O-CG2 3.43Å; M144-I148 PolarHBondContact O-N 2.96Å; M144-L191 HydrophobicContact CB-CD2 4.41Å; M144-L191 HydrophobicContact CE-CD2 4.17Å; M144-L191 HydrophobicContact SD-CD2 4.5Å; M144-S252 WeakPolarHBondContact CA-OG 3.2Å; M144-S252 VanDerWaalsContact CG-CB 3.49Å; M144-S255 WeakPolarHBondContact SD-CB 3.35Å; M144-F256 HydrophobicContact CB-CD2 4.3Å; M144-F256 HydrophobicContact CB-CE2 3.6Å; M144-F256 HydrophobicContact CB-CZ 3.7Å; M144-F256 HydrophobicContact CG-CD2 3.91Å; M144-F256 HydrophobicContact CG-CE2 3.74Å; M144-F256 HydrophobicContact CG-CG 4.48Å; M144-F256 HydrophobicContact CG-CZ 4.12Å; M144-F256 VanDerWaalsContact O-CE2 3.24Å; M144-F256 WeakPolarHBondContact O-CE2 3.29Å; M144-F256 VanDerWaalsContact O-CZ 3.3Å; M144-F256 WeakPolarHBondContact O-CZ 3.45Å; M144-I259 HydrophobicContact CE-CD1 3.82Å; M144-I259 HydrophobicContact SD-CD1 3.45Å; M144-I259 WeakPolarHBondContact SD-CD1 3.4Å
145V96.3Very high90.5Very high26 Ų2655.4 Ų55.416%0.15831%0.31CS..Hα-helixtrans-62.5-42.1176.6171.60000111.6V141 T142 G143 I148 D149 L191 R192V141-V145 WeakPolarHBondContact O-CG2 3.39Å; V141-V145 PolarHBondContact O-N 3.25Å; T142-V145 PolarHBondContact O-N 2.8Å; G143-V145 PolarHBondContact O-N 3.5Å; V145-I148 WeakPolarHBondContact O-CG2 3.3Å; V145-D149 WeakPolarHBondContact O-CB 3.42Å; V145-D149 PolarHBondContact O-N 3.42Å; V145-L191 HydrophobicContact CG2-CB 3.85Å; V145-R192 HydrophobicContact CG1-CG 3.77Å; V145-R192 HydrophobicContact CG2-CG 4.08Å
146L95.2Very high89.3Confident110 Ų11055.5 Ų55.558%0.57631%0.31SS*.Hα-helixtrans-66.4-46177.2-68.1171.3000112T142 G143 I148 D149 C150T142-L146 HydrophobicContact CG2-CD1 4.45Å; T142-L146 WeakPolarHBondContact O-CG 3.47Å; T142-L146 PolarHBondContact O-N 3.41Å; T142-L146 VanDerWaalsContact O-N 3.07Å; G143-L146 PolarHBondContact O-N 3.29Å; L146-I148 PolarHBondContact O-N 2.85Å; L146-D149 PolarHBondContact O-N 3.22Å; L146-C150 PolarHBondContact O-N 3.28Å; L146-C150 PolarHBondContact O-SG 2.96Å; L146-C150 VanDerWaalsContact O-SG 3.39Å
147D95Very high87.6Confident23 Ų2349 Ų4912%0.12328%0.284CS..Hα-helixtrans-66.6-34.4-178.3-73.2-37.5000112.3G143 M144 C150 L245 A250 S251 S252 F256G143-D147 WeakPolarHBondContact O-CB 3.45Å; G143-D147 PolarHBondContact O-N 2.83Å; M144-D147 PolarHBondContact O-N 2.65Å; D147-C150 WeakPolarHBondContact O-CB 3.25Å; D147-C150 PolarHBondContact O-N 2.7Å; D147-L245 HydrophobicContact CB-CD2 3.95Å; D147-A250 HydrophobicContact CB-CB 3.82Å; D147-A250 WeakPolarHBondContact OD1-CA 3.4Å; D147-S251 PolarHBondContact OD1-N 2.87Å; D147-S251 PolarHBondContact OD2-N 3.17Å; D147-S251 PolarHBondContact OD2-OG 3.01Å; D147-S252 WeakPolarHBondContact CB-OG 3.42Å; D147-S252 VanDerWaalsContact OD2-CB 3.3Å; D147-S252 WeakPolarHBondContact OD2-CB 3.39Å; D147-S252 PolarHBondContact OD2-N 3.35Å; D147-S252 PolarHBondContact OD2-OG 2.95Å; D147-F256 HydrophobicContact CB-CE2 4.3Å
148I93.3Very high85.6Confident2 Ų247.8 Ų47.81%0.0128%0.281CS..Hα-helixtrans-82.8-18.3175.6-158.6169.8000114.1M144 V145 L146 V151 F184 L187 K188 L191 F256M144-I148 WeakPolarHBondContact O-CG2 3.43Å; M144-I148 PolarHBondContact O-N 2.96Å; V145-I148 WeakPolarHBondContact O-CG2 3.3Å; L146-I148 PolarHBondContact O-N 2.85Å; I148-V151 PolarHBondContact O-N 2.65Å; I148-F184 HydrophobicContact CD1-CE2 3.8Å; I148-F184 HydrophobicContact CD1-CZ 4.27Å; I148-F184 HydrophobicContact CG1-CE2 3.71Å; I148-F184 HydrophobicContact CG1-CZ 3.72Å; I148-L187 HydrophobicContact CD1-CD2 4.11Å; I148-L187 HydrophobicContact CD1-CG 4.12Å; I148-K188 HydrophobicContact CD1-CD 4.5Å; I148-K188 HydrophobicContact CD1-CG 3.7Å; I148-K188 HydrophobicContact CG1-CD 4.16Å; I148-K188 HydrophobicContact CG1-CG 3.81Å; I148-K188 HydrophobicContact CG2-CG 3.94Å; I148-K188 PolarHBondContact O-NZ 3.47Å; I148-L191 HydrophobicContact CD1-CD1 4.06Å; I148-L191 HydrophobicContact CG2-CD1 4.26Å; I148-F256 HydrophobicContact CB-CE1 4.47Å; I148-F256 HydrophobicContact CB-CE2 4.21Å; I148-F256 HydrophobicContact CB-CZ 3.65Å; I148-F256 HydrophobicContact CD1-CE1 3.93Å; I148-F256 HydrophobicContact CD1-CZ 3.96Å; I148-F256 HydrophobicContact CG1-CZ 4.27Å; I148-F256 HydrophobicContact CG2-CZ 4.12Å
149D92.7Very high83.7Confident73 Ų7347.8 Ų47.839%0.3928%0.281SS..Hα-helixtrans-72.9-18.6165.5-90.7-38.9000112.6V145 L146 K188 R192V145-D149 WeakPolarHBondContact O-CB 3.42Å; V145-D149 PolarHBondContact O-N 3.42Å; L146-D149 PolarHBondContact O-N 3.22Å; D149-K188 WeakPolarHBondContact OD1-CE 3.49Å; D149-K188 IonicContact OD1-NZ 3.97Å; D149-K188 PolarHBondContact OD1-NZ 3.23Å; D149-R192 VanDerWaalsContact CG-NH2 3.25Å; D149-R192 IonicContact OD1-CZ 3.83Å; D149-R192 IonicContact OD1-NH2 2.86Å; D149-R192 PolarHBondContact OD1-NH2 3.38Å; D149-R192 IonicContact OD2-CZ 2.83Å; D149-R192 IonicContact OD2-NE 3.64Å; D149-R192 IonicContact OD2-NH2 3.98Å; D149-R192 PolarHBondContact OD2-NH2 2.99Å
150C89.8Confident81.4Confident83 Ų8344.9 Ų44.956%0.56126%0.263SS*.THydrogen-bonded Turntrans-87.2-4.2171.5-64.50000115.1L146 D147 N248L146-C150 PolarHBondContact O-N 3.28Å; L146-C150 PolarHBondContact O-SG 2.96Å; L146-C150 VanDerWaalsContact O-SG 3.39Å; D147-C150 WeakPolarHBondContact O-CB 3.25Å; D147-C150 PolarHBondContact O-N 2.7Å; C150-N248 PolarHBondContact O-ND2 3.37Å
151V88.5Confident78.8Confident7 Ų751 Ų514%0.04229%0.294CS..SBendtrans-82.8122.5-180170.20000110.5I148 L153 I156 F184 N244 L245I148-V151 PolarHBondContact O-N 2.65Å; V151-L153 PolarHBondContact O-N 2.94Å; V151-I156 HydrophobicContact CG1-CD1 4.18Å; V151-F184 HydrophobicContact CB-CZ 3.93Å; V151-F184 HydrophobicContact CG1-CE2 4.12Å; V151-F184 HydrophobicContact CG1-CZ 3.72Å; V151-N244 HydrophobicContact CB-CB 4.29Å; V151-N244 HydrophobicContact CG1-CB 3.83Å; V151-N244 HydrophobicContact CG2-CB 3.91Å; V151-L245 HydrophobicContact CG2-CD2 3.92Å; V151-L245 HydrophobicContact CG2-CG 4.25Å
152D80.2Confident76.4Confident80 Ų8056.6 Ų56.643%0.42832%0.323SS..  trans-76.1122.2-177.4172.336.2000112.9S154 S155D152-S154 VanDerWaalsContact C-N 3.29Å; D152-S154 VanDerWaalsContact CG-N 3.35Å; D152-S154 PolarHBondContact O-N 3.17Å; D152-S154 PolarHBondContact OD1-N 3.27Å; D152-S154 VanDerWaalsContact OD2-CB 3.32Å; D152-S154 WeakPolarHBondContact OD2-CB 3.3Å; D152-S154 PolarHBondContact OD2-N 3.43Å; D152-S154 PolarHBondContact OD2-OG 3.26Å; D152-S155 WeakPolarHBondContact O-CB 3.31Å; D152-S155 PolarHBondContact O-N 3.21Å; D152-S155 PolarHBondContact O-OG 2.82Å; D152-S155 PolarHBondContact OD2-N 2.87Å
153L76.6Confident73.8Confident63 Ų6356.3 Ų56.333%0.3332%0.324SS..Hα-helixtrans-57.2-37.7173.3-65.8170.2000112.6V151 S155 I156 N157 F184V151-L153 PolarHBondContact O-N 2.94Å; L153-S155 PolarHBondContact O-N 3.11Å; L153-I156 WeakPolarHBondContact O-CB 3.44Å; L153-I156 PolarHBondContact O-N 3.33Å; L153-N157 PolarHBondContact O-N 2.96Å; L153-N157 PolarHBondContact O-OD1 3.24Å; L153-N157 VanDerWaalsContact O-OD1 3.11Å; L153-F184 HydrophobicContact CD2-CD1 3.37Å; L153-F184 HydrophobicContact CD2-CE1 3.56Å; L153-F184 HydrophobicContact CD2-CG 4.5Å
154S71.6Confident71Confident82 Ų8261.3 Ų61.357%0.57335%0.352SS*.Hα-helixtrans-63.7-31.8-177.5970000111.9D152 I156 N157D152-S154 VanDerWaalsContact C-N 3.29Å; D152-S154 VanDerWaalsContact CG-N 3.35Å; D152-S154 PolarHBondContact O-N 3.17Å; D152-S154 PolarHBondContact OD1-N 3.27Å; D152-S154 VanDerWaalsContact OD2-CB 3.32Å; D152-S154 WeakPolarHBondContact OD2-CB 3.3Å; D152-S154 PolarHBondContact OD2-N 3.43Å; D152-S154 PolarHBondContact OD2-OG 3.26Å; S154-I156 VanDerWaalsContact C-N 3.35Å; S154-I156 PolarHBondContact O-N 2.92Å; S154-N157 PolarHBondContact O-N 3.38Å
155S68.9Low68.2Low27 Ų2766.8 Ų66.819%0.18939%0.39CS..Hα-helixtrans-67.1-32.1173.483.10000113.4D152 L153 S158 N244D152-S155 WeakPolarHBondContact O-CB 3.31Å; D152-S155 PolarHBondContact O-N 3.21Å; D152-S155 PolarHBondContact O-OG 2.82Å; D152-S155 PolarHBondContact OD2-N 2.87Å; L153-S155 PolarHBondContact O-N 3.11Å; S155-S158 PolarHBondContact O-OG 3.31Å; S155-N244 PolarHBondContact OG-ND2 2.81Å; S155-N244 PolarHBondContact OG-OD1 3.09Å
156I67.1Low65.2Low9 Ų969.4 Ų69.45%0.04642%0.415CS..Hα-helixtrans-73.4-36.9178.9-57.9177.8000110.3V151 L153 S154 S158 F184 F237V151-I156 HydrophobicContact CG1-CD1 4.18Å; L153-I156 WeakPolarHBondContact O-CB 3.44Å; L153-I156 PolarHBondContact O-N 3.33Å; S154-I156 VanDerWaalsContact C-N 3.35Å; S154-I156 PolarHBondContact O-N 2.92Å; I156-S158 PolarHBondContact O-N 3.28Å; I156-F184 HydrophobicContact CD1-CD1 3.92Å; I156-F184 HydrophobicContact CD1-CD2 3.72Å; I156-F184 HydrophobicContact CD1-CE1 3.94Å; I156-F184 HydrophobicContact CD1-CE2 3.79Å; I156-F184 HydrophobicContact CD1-CG 3.79Å; I156-F184 HydrophobicContact CD1-CZ 3.89Å; I156-F237 HydrophobicContact CG2-CD2 4.02Å; I156-F237 HydrophobicContact CG2-CE2 4.14Å
157N58.9Low62.5Low40 Ų4069.5 Ų69.521%0.21443%0.431CS..Hα-helixtrans-69.7-16.4179-66.821.9000113.9L153 S154 Q159 E177 I181L153-N157 PolarHBondContact O-N 2.96Å; L153-N157 PolarHBondContact O-OD1 3.24Å; L153-N157 VanDerWaalsContact O-OD1 3.11Å; S154-N157 PolarHBondContact O-N 3.38Å; N157-Q159 PolarHBondContact O-N 3.5Å; N157-E177 HydrophobicContact CB-CG 3.97Å; N157-E177 WeakPolarHBondContact CB-OE1 3.22Å; N157-E177 PolarHBondContact ND2-OE1 2.86Å; N157-I181 WeakPolarHBondContact OD1-CG1 3.38Å
158S54.3Low59.8Low43 Ų4372.5 Ų72.530%0.30147%0.467SS..SBendtrans-62.8102.7-177.264.10000111.9S155 I156 F236 R240S155-S158 PolarHBondContact O-OG 3.31Å; I156-S158 PolarHBondContact O-N 3.28Å; S158-F236 WeakPolarHBondContact O-CE1 3.42Å; S158-F236 VanDerWaalsContact O-CZ 3.27Å; S158-F236 WeakPolarHBondContact O-CZ 3.08Å; S158-R240 VanDerWaalsContact OG-CZ 3.24Å; S158-R240 PolarHBondContact OG-NE 3.07Å; S158-R240 PolarHBondContact OG-NH2 2.86Å
159Q53.2Low57Low114 Ų11476.6 Ų76.653%0.53349%0.489SS..  trans-53.8139.5-169.4-69.8-159.18.800113.2N157 L161 S163N157-Q159 PolarHBondContact O-N 3.5Å; Q159-L161 PolarHBondContact O-N 3.41Å; Q159-S163 PolarHBondContact OE1-OG 2.93Å
160P47.4Very low54.5Low40 Ų4081.9 Ų81.926%0.2651%0.512SS..  trans-60135.2160.4-13.426.4000109.4L162 S163 F236P160-L162 HydrophobicContact CB-CB 4.41Å; P160-L162 PolarHBondContact O-N 2.79Å; P160-S163 PolarHBondContact O-N 3.49Å; P160-F236 HydrophobicContact CB-CD2 4.32Å; P160-F236 HydrophobicContact CB-CE2 4.19Å; P160-F236 HydrophobicContact CB-CZ 4.39Å; P160-F236 HydrophobicContact CG-CD1 3.79Å; P160-F236 HydrophobicContact CG-CD2 4.03Å; P160-F236 HydrophobicContact CG-CE1 3.79Å; P160-F236 HydrophobicContact CG-CE2 4.03Å; P160-F236 HydrophobicContact CG-CG 3.9Å; P160-F236 HydrophobicContact CG-CZ 3.89Å
161L42.5Very low52.2Low166 Ų16683 Ų8387%0.86951%0.512SS*.THydrogen-bonded Turntrans-63.710.2173.5-78.7163.2000114.4Q159Q159-L161 PolarHBondContact O-N 3.41Å
162L44.7Very low50.2Low119 Ų11984.9 Ų84.962%0.62353%0.526SS*.THydrogen-bonded Turntrans-98-7.3-176.2-57.6177.5000113.2P160 T164 L232P160-L162 HydrophobicContact CB-CB 4.41Å; P160-L162 PolarHBondContact O-N 2.79Å; L162-T164 PolarHBondContact O-N 3.48Å; L162-L232 HydrophobicContact CD1-CD1 4.44Å; L162-L232 HydrophobicContact CD1-CD2 4.12Å
163S41.8Very low48.6Very low61 Ų6186.8 Ų86.843%0.42754%0.536SS..SBendtrans-60.5-25.8172.8-560000112.6Q159 P160 S165Q159-S163 PolarHBondContact OE1-OG 2.93Å; P160-S163 PolarHBondContact O-N 3.49Å; S163-S165 VanDerWaalsContact C-N 3.3Å; S163-S165 PolarHBondContact O-N 3.46Å; S163-S165 VanDerWaalsContact O-N 3.1Å
164T36.7Very low47.2Very low119 Ų11990.6 Ų90.673%0.7356%0.555SS**THydrogen-bonded Turntrans-87.836-165.8-24.70000114.2L162L162-T164 PolarHBondContact O-N 3.48Å
165S37Very low46.2Very low116 Ų11689.6 Ų89.681%0.81154%0.539SS*.THydrogen-bonded Turntrans-141.521.4-174.4-69.10000115.5S163S163-S165 VanDerWaalsContact C-N 3.3Å; S163-S165 PolarHBondContact O-N 3.46Å; S163-S165 VanDerWaalsContact O-N 3.1Å
166A34.5Very low45.8Very low81 Ų8190.7 Ų90.767%0.66955%0.546SS*.  trans-124.896.3169.100000110.1G168A166-G168 PolarHBondContact O-N 3.49Å
167A38.8Very low45.3Very low112 Ų11294.3 Ų94.393%0.92656%0.563SS**  trans-76.5124.1179.700000111.6
168G36.7Very low45.4Very low85 Ų85101.3 Ų101.388%0.87659%0.588SS**SBendtrans95.322.4153.800000118.7A166A166-G168 PolarHBondContact O-N 3.49Å
169D34.8Very low46.3Very low89 Ų89101 Ų10148%0.47658%0.583SS.*  trans-135.499.8175.9-1635.8000111.3D171 S172 R221D169-D171 PolarHBondContact O-N 3Å; D169-D171 VanDerWaalsContact O-N 3.14Å; D169-S172 PolarHBondContact O-N 2.96Å; D169-S172 PolarHBondContact O-OG 3.39Å; D169-R221 IonicContact OD2-CZ 2.67Å; D169-R221 IonicContact OD2-NE 2.69Å; D169-R221 IonicContact OD2-NH2 3.54Å; D169-R221 PolarHBondContact OD2-NH2 3.15Å
170Q41Very low47.6Very low184 Ų18497.8 Ų97.886%0.8657%0.573SS**G310 helixtrans-68.9-9.7-167.7-78.3-178.680.800114.8S172Q170-S172 PolarHBondContact O-N 3.05Å
171D41.9Very low49.3Very low105 Ų10597.9 Ų97.956%0.56157%0.571SS**G310 helixtrans-73-0.3174.4-82.8-13.7000113.8D169 D173D169-D171 PolarHBondContact O-N 3Å; D169-D171 VanDerWaalsContact O-N 3.14Å; D171-D173 VanDerWaalsContact C-N 3.32Å; D171-D173 PolarHBondContact O-N 2.92Å
172S46.1Very low51.4Low48 Ų4891.5 Ų91.534%0.33654%0.54SS..G310 helixtrans-67.3-29.8174.756.30000114D169 Q170 Y175D169-S172 PolarHBondContact O-N 2.96Å; D169-S172 PolarHBondContact O-OG 3.39Å; Q170-S172 PolarHBondContact O-N 3.05Å; S172-Y175 PolarHBondContact O-N 3.5Å
173D45.8Very low53.5Low119 Ų11986.4 Ų86.464%0.63651%0.514SS*.G310 helixtrans-90.5-11.8-162.6-67.61.6000113.5D171 Y175 S176D171-D173 VanDerWaalsContact C-N 3.32Å; D171-D173 PolarHBondContact O-N 2.92Å; D173-Y175 PolarHBondContact O-N 3.02Å; D173-S176 WeakPolarHBondContact O-CB 3.4Å; D173-S176 PolarHBondContact O-N 3.07Å
174I46.5Very low55.8Low143 Ų14383.5 Ų83.573%0.73349%0.494SS*.G310 helixtrans-66.3-20.4170.3-59.1176.5000110.8S176I174-S176 VanDerWaalsContact C-N 3.28Å; I174-S176 PolarHBondContact O-N 3.05Å
175Y52.2Low58.4Low62 Ų6281.2 Ų81.224%0.24348%0.475CS..G310 helixtrans-91.523.2179.1-134.9-89.1000113.6S172 D173 K211 R233S172-Y175 PolarHBondContact O-N 3.5Å; D173-Y175 PolarHBondContact O-N 3.02Å; Y175-K211 WeakPolarHBondContact OH-CA 3.47Å; Y175-K211 WeakPolarHBondContact OH-CB 3.32Å; Y175-K211 WeakPolarHBondContact OH-CD 3.47Å; Y175-K211 PolarHBondContact OH-O 3.43Å; Y175-R233 PolarHBondContact O-NH1 2.92Å; Y175-R233 VanDerWaalsContact O-NH1 3.13Å
176S60.3Low61.1Low49 Ų4979.3 Ų79.334%0.34345%0.453SS..SBendtrans-100.4131.5-168.4-168.70000112.8D173 I174 Y178D173-S176 WeakPolarHBondContact O-CB 3.4Å; D173-S176 PolarHBondContact O-N 3.07Å; I174-S176 VanDerWaalsContact C-N 3.28Å; I174-S176 PolarHBondContact O-N 3.05Å; S176-Y178 VanDerWaalsContact C-N 3.26Å; S176-Y178 PolarHBondContact O-N 3.22Å
177E55.9Low63.9Low86 Ų8675.9 Ų75.940%0.40242%0.423SS..SBendtrans58.5-59.9161.5-156.6171.7146.400117.6N157 D179 S180 I181N157-E177 HydrophobicContact CB-CG 3.97Å; N157-E177 WeakPolarHBondContact CB-OE1 3.22Å; N157-E177 PolarHBondContact ND2-OE1 2.86Å; E177-D179 PolarHBondContact O-N 3.44Å; E177-S180 WeakPolarHBondContact O-CB 3.26Å; E177-S180 PolarHBondContact O-N 2.7Å; E177-I181 HydrophobicContact CG-CD1 4.47Å; E177-I181 PolarHBondContact O-N 3.49Å
178Y60.3Low66.5Low186 Ų18671.2 Ų71.273%0.72938%0.382SS*.Hα-helixtrans-54.4-37.4-179.3-163.8-96000113.2S176 I181 S182S176-Y178 VanDerWaalsContact C-N 3.26Å; S176-Y178 PolarHBondContact O-N 3.22Å; Y178-I181 WeakPolarHBondContact O-CB 3.43Å; Y178-I181 PolarHBondContact O-N 3.05Å; Y178-S182 PolarHBondContact O-N 3.37Å
179D74.3Confident69.3Low37 Ų3770.3 Ų70.320%0.19836%0.355CS..Hα-helixtrans-63.6-39.2176.7-95.13.7000113.3E177 I181 S182 V183 K211E177-D179 PolarHBondContact O-N 3.44Å; D179-I181 VanDerWaalsContact C-N 3.3Å; D179-S182 PolarHBondContact O-N 3Å; D179-S182 PolarHBondContact O-OG 3.34Å; D179-V183 VanDerWaalsContact O-CG2 3.32Å; D179-V183 WeakPolarHBondContact O-CG2 3.39Å; D179-V183 PolarHBondContact O-N 2.89Å; D179-K211 IonicContact OD1-NZ 2.86Å; D179-K211 PolarHBondContact OD1-NZ 3.44Å; D179-K211 WeakPolarHBondContact OD2-CE 3.39Å; D179-K211 IonicContact OD2-NZ 3.6Å; D179-K211 PolarHBondContact OD2-NZ 2.86Å
180S80.5Confident72.2Confident46 Ų4667.4 Ų67.432%0.32234%0.34SS..Hα-helixtrans-68.3-34.8176-58.40000111.1E177 F184 F237E177-S180 WeakPolarHBondContact O-CB 3.26Å; E177-S180 PolarHBondContact O-N 2.7Å; S180-F184 WeakPolarHBondContact O-CB 3.22Å; S180-F184 PolarHBondContact O-N 3.21Å; S180-F184 VanDerWaalsContact O-N 3.14Å; S180-F237 WeakPolarHBondContact O-CE2 3.42Å
181I82.4Confident74.7Confident43 Ų4358.8 Ų58.822%0.22130%0.299CS..Hα-helixtrans-69.4-43.5176.6-60.3160.7000110.3N157 E177 Y178 D179 F184 Q185N157-I181 WeakPolarHBondContact OD1-CG1 3.38Å; E177-I181 HydrophobicContact CG-CD1 4.47Å; E177-I181 PolarHBondContact O-N 3.49Å; Y178-I181 WeakPolarHBondContact O-CB 3.43Å; Y178-I181 PolarHBondContact O-N 3.05Å; D179-I181 VanDerWaalsContact C-N 3.3Å; I181-F184 PolarHBondContact O-N 3.43Å; I181-Q185 HydrophobicContact CG2-CG 4.38Å; I181-Q185 WeakPolarHBondContact O-CG 3.33Å; I181-Q185 PolarHBondContact O-N 2.94Å
182S86.6Confident77.3Confident31 Ų3159 Ų5922%0.21729%0.292CS..Hα-helixtrans-63.3-48.5-179.787.30000111.3Y178 D179 F184 Q185 E186Y178-S182 PolarHBondContact O-N 3.37Å; D179-S182 PolarHBondContact O-N 3Å; D179-S182 PolarHBondContact O-OG 3.34Å; S182-F184 PolarHBondContact O-N 3.46Å; S182-Q185 PolarHBondContact O-N 3.02Å; S182-Q185 VanDerWaalsContact O-N 3.12Å; S182-E186 WeakPolarHBondContact O-CB 3.46Å; S182-E186 VanDerWaalsContact O-CG 3.26Å; S182-E186 WeakPolarHBondContact O-CG 3.36Å; S182-E186 PolarHBondContact O-N 3.49Å; S182-E186 PolarHBondContact OG-OE1 3.34Å
183V89.1Confident79.6Confident13 Ų1363.4 Ų63.48%0.07931%0.305CS..Hα-helixtrans-57.5-36.8175.7170.80000111.5D179 L187 W203 W234 F237D179-V183 VanDerWaalsContact O-CG2 3.32Å; D179-V183 WeakPolarHBondContact O-CG2 3.39Å; D179-V183 PolarHBondContact O-N 2.89Å; V183-L187 WeakPolarHBondContact O-CB 3.32Å; V183-L187 PolarHBondContact O-N 3.38Å; V183-W203 HydrophobicContact CG1-CH2 4.07Å; V183-W203 HydrophobicContact CG1-CZ2 3.78Å; V183-W203 WeakPolarHBondContact O-CZ2 3.32Å; V183-W234 HydrophobicContact CG1-CZ3 3.97Å; V183-F237 HydrophobicContact CB-CZ 4.4Å; V183-F237 HydrophobicContact CG1-CE1 3.74Å; V183-F237 HydrophobicContact CG1-CZ 3.8Å
184F90.5Very high81.9Confident0 Ų059.8 Ų59.80%029%0.286CS..Hα-helixtrans-70.5-41.6175.5-174.5-110.4000113.6I148 V151 L153 I156 S180 I181 S182 L187 K188 F237 I241I148-F184 HydrophobicContact CD1-CE2 3.8Å; I148-F184 HydrophobicContact CD1-CZ 4.27Å; I148-F184 HydrophobicContact CG1-CE2 3.71Å; I148-F184 HydrophobicContact CG1-CZ 3.72Å; V151-F184 HydrophobicContact CB-CZ 3.93Å; V151-F184 HydrophobicContact CG1-CE2 4.12Å; V151-F184 HydrophobicContact CG1-CZ 3.72Å; L153-F184 HydrophobicContact CD2-CD1 3.37Å; L153-F184 HydrophobicContact CD2-CE1 3.56Å; L153-F184 HydrophobicContact CD2-CG 4.5Å; I156-F184 HydrophobicContact CD1-CD1 3.92Å; I156-F184 HydrophobicContact CD1-CD2 3.72Å; I156-F184 HydrophobicContact CD1-CE1 3.94Å; I156-F184 HydrophobicContact CD1-CE2 3.79Å; I156-F184 HydrophobicContact CD1-CG 3.79Å; I156-F184 HydrophobicContact CD1-CZ 3.89Å; S180-F184 WeakPolarHBondContact O-CB 3.22Å; S180-F184 PolarHBondContact O-N 3.21Å; S180-F184 VanDerWaalsContact O-N 3.14Å; I181-F184 PolarHBondContact O-N 3.43Å; S182-F184 PolarHBondContact O-N 3.46Å; F184-L187 PolarHBondContact O-N 2.99Å; F184-K188 HydrophobicContact CD1-CD 3.84Å; F184-K188 HydrophobicContact CE1-CD 3.4Å; F184-K188 HydrophobicContact CE1-CG 4.38Å; F184-K188 HydrophobicContact CE2-CD 4.41Å; F184-K188 HydrophobicContact CZ-CD 3.71Å; F184-K188 HydrophobicContact CZ-CG 4.38Å; F184-K188 WeakPolarHBondContact O-CG 3.42Å; F184-K188 PolarHBondContact O-N 3.12Å; F184-F237 HydrophobicContact CB-CE2 3.92Å; F184-F237 HydrophobicContact CB-CZ 3.94Å; F184-F237 HydrophobicContact CD2-CE2 4.38Å; F184-F237 HydrophobicContact CD2-CZ 4.25Å; F184-I241 HydrophobicContact CD2-CD1 3.81Å; F184-I241 HydrophobicContact CD2-CG1 4.17Å; F184-I241 HydrophobicContact CE2-CD1 4.04Å; F184-I241 HydrophobicContact CE2-CG1 4.03Å
185Q90.6Very high84.1Confident70 Ų7053.4 Ų53.433%0.32725%0.254SS..Hα-helixtrans-67.9-37.8176.2-62.8-62.9-10.400111.4I181 S182 K188 E189I181-Q185 HydrophobicContact CG2-CG 4.38Å; I181-Q185 WeakPolarHBondContact O-CG 3.33Å; I181-Q185 PolarHBondContact O-N 2.94Å; S182-Q185 PolarHBondContact O-N 3.02Å; S182-Q185 VanDerWaalsContact O-N 3.12Å; Q185-K188 PolarHBondContact O-N 3.38Å; Q185-E189 WeakPolarHBondContact O-CB 3.37Å; Q185-E189 WeakPolarHBondContact O-CG 3.31Å; Q185-E189 PolarHBondContact O-N 3.45Å
186E93.6Very high86.1Confident76 Ų7653.7 Ų53.736%0.35526%0.263SS..Hα-helixtrans-61.6-45.7173.8-69.9160.6-153.300111.5S182 K188 E189 L190 W203S182-E186 WeakPolarHBondContact O-CB 3.46Å; S182-E186 VanDerWaalsContact O-CG 3.26Å; S182-E186 WeakPolarHBondContact O-CG 3.36Å; S182-E186 PolarHBondContact O-N 3.49Å; S182-E186 PolarHBondContact OG-OE1 3.34Å; E186-K188 VanDerWaalsContact C-N 3.35Å; E186-K188 PolarHBondContact O-N 3.11Å; E186-E189 PolarHBondContact O-N 3.02Å; E186-L190 WeakPolarHBondContact O-CG 3.31Å; E186-L190 PolarHBondContact O-N 3.3Å; E186-W203 HydrophobicContact CB-CZ2 4.13Å; E186-W203 PolarHBondContact OE2-NE1 3.28Å
187L93.9Very high87.7Confident10 Ų1051.4 Ų51.45%0.05225%0.247CC..Hα-helixtrans-56.6-44.5172.8172.158.9000112.4I148 V183 F184 E189 L190 L191 F200 W203 I241 L263I148-L187 HydrophobicContact CD1-CD2 4.11Å; I148-L187 HydrophobicContact CD1-CG 4.12Å; V183-L187 WeakPolarHBondContact O-CB 3.32Å; V183-L187 PolarHBondContact O-N 3.38Å; F184-L187 PolarHBondContact O-N 2.99Å; L187-E189 VanDerWaalsContact C-N 3.35Å; L187-L190 PolarHBondContact O-N 3.42Å; L187-L191 HydrophobicContact CD1-CD1 4.29Å; L187-L191 WeakPolarHBondContact O-CG 3.31Å; L187-L191 PolarHBondContact O-N 2.86Å; L187-F200 HydrophobicContact CD1-CE1 3.87Å; L187-W203 HydrophobicContact CB-CH2 4.03Å; L187-W203 HydrophobicContact CB-CZ2 4.37Å; L187-I241 HydrophobicContact CD2-CD1 4.1Å; L187-L263 HydrophobicContact CD1-CD1 4.49Å
188K92.9Very high89.5Confident13 Ų1350.5 Ų50.56%0.05724%0.243CC..Hα-helixtrans-64.3-40.4176.4-71.6177.561.1147.20112.2I148 D149 F184 Q185 E186 L191 R192I148-K188 HydrophobicContact CD1-CD 4.5Å; I148-K188 HydrophobicContact CD1-CG 3.7Å; I148-K188 HydrophobicContact CG1-CD 4.16Å; I148-K188 HydrophobicContact CG1-CG 3.81Å; I148-K188 HydrophobicContact CG2-CG 3.94Å; I148-K188 PolarHBondContact O-NZ 3.47Å; D149-K188 WeakPolarHBondContact OD1-CE 3.49Å; D149-K188 IonicContact OD1-NZ 3.97Å; D149-K188 PolarHBondContact OD1-NZ 3.23Å; F184-K188 HydrophobicContact CD1-CD 3.84Å; F184-K188 HydrophobicContact CE1-CD 3.4Å; F184-K188 HydrophobicContact CE1-CG 4.38Å; F184-K188 HydrophobicContact CE2-CD 4.41Å; F184-K188 HydrophobicContact CZ-CD 3.71Å; F184-K188 HydrophobicContact CZ-CG 4.38Å; F184-K188 WeakPolarHBondContact O-CG 3.42Å; F184-K188 PolarHBondContact O-N 3.12Å; Q185-K188 PolarHBondContact O-N 3.38Å; E186-K188 VanDerWaalsContact C-N 3.35Å; E186-K188 PolarHBondContact O-N 3.11Å; K188-L191 PolarHBondContact O-N 3.3Å; K188-R192 WeakPolarHBondContact O-CB 3.45Å; K188-R192 VanDerWaalsContact O-CG 3.3Å; K188-R192 WeakPolarHBondContact O-CG 3.46Å; K188-R192 PolarHBondContact O-N 3.43Å
189E95.5Very high91.1Very high67 Ų6743.8 Ų43.831%0.31322%0.222SC..Hα-helixtrans-70.1-30.9178.6-80.2-61.8117.800113.4Q185 E186 L187 R192 K193Q185-E189 WeakPolarHBondContact O-CB 3.37Å; Q185-E189 WeakPolarHBondContact O-CG 3.31Å; Q185-E189 PolarHBondContact O-N 3.45Å; E186-E189 PolarHBondContact O-N 3.02Å; L187-E189 VanDerWaalsContact C-N 3.35Å; E189-R192 VanDerWaalsContact OE1-CD 3.25Å; E189-R192 WeakPolarHBondContact OE1-CD 3.11Å; E189-R192 IonicContact OE1-CZ 2.7Å; E189-R192 IonicContact OE1-NE 3.74Å; E189-R192 IonicContact OE1-NH1 3.52Å; E189-R192 PolarHBondContact OE1-NH1 3.04Å; E189-K193 WeakPolarHBondContact O-CB 3.19Å; E189-K193 WeakPolarHBondContact O-CD 3.42Å; E189-K193 VanDerWaalsContact O-CG 3.23Å; E189-K193 WeakPolarHBondContact O-CG 3.47Å; E189-K193 PolarHBondContact O-N 3.13Å; E189-K193 WeakPolarHBondContact OE2-CE 3.37Å; E189-K193 IonicContact OE2-NZ 2.65Å; E189-K193 PolarHBondContact OE2-NZ 3.13Å
190L96Very high92.1Very high28 Ų2842.1 Ų42.115%0.14721%0.213CC..Hα-helixtrans-65.4-47.6170.2-73.5169000111.4E186 L187 R192 K193 N194 A195 F200 W203E186-L190 WeakPolarHBondContact O-CG 3.31Å; E186-L190 PolarHBondContact O-N 3.3Å; L187-L190 PolarHBondContact O-N 3.42Å; L190-R192 PolarHBondContact O-N 2.9Å; L190-K193 PolarHBondContact O-N 2.83Å; L190-K193 VanDerWaalsContact O-N 3.15Å; L190-N194 PolarHBondContact O-N 2.63Å; L190-A195 HydrophobicContact CB-CB 3.86Å; L190-A195 HydrophobicContact CD2-CB 3.8Å; L190-A195 HydrophobicContact CG-CB 4.44Å; L190-A195 WeakPolarHBondContact O-CB 3.43Å; L190-A195 PolarHBondContact O-N 3.27Å; L190-F200 HydrophobicContact CB-CD1 4.44Å; L190-F200 HydrophobicContact CB-CE1 3.76Å; L190-F200 HydrophobicContact CB-CZ 3.85Å; L190-F200 HydrophobicContact CD1-CD1 3.69Å; L190-F200 HydrophobicContact CD1-CE1 3.73Å; L190-F200 HydrophobicContact CD1-CG 4.5Å; L190-F200 HydrophobicContact CG-CE1 4.38Å; L190-W203 HydrophobicContact CD1-CB 3.84Å; L190-W203 HydrophobicContact CD1-CD2 3.51Å; L190-W203 HydrophobicContact CD1-CE3 3.6Å; L190-W203 HydrophobicContact CD1-CG 3.63Å; L190-W203 HydrophobicContact CD1-CZ3 4.31Å
191L94.8Very high92.7Very high2 Ų240.8 Ų40.81%0.0120%0.203CC..Hα-helixtrans-61.7-43.9177.8-69.1164.7000111.9L135 V141 M144 V145 I148 L187 K188 K193 N194 F200 F256 I259L135-L191 HydrophobicContact CD2-CD2 4.41Å; V141-L191 VanDerWaalsContact CG1-O 3.28Å; V141-L191 WeakPolarHBondContact CG1-O 3.4Å; M144-L191 HydrophobicContact CB-CD2 4.41Å; M144-L191 HydrophobicContact CE-CD2 4.17Å; M144-L191 HydrophobicContact SD-CD2 4.5Å; V145-L191 HydrophobicContact CG2-CB 3.85Å; I148-L191 HydrophobicContact CD1-CD1 4.06Å; I148-L191 HydrophobicContact CG2-CD1 4.26Å; L187-L191 HydrophobicContact CD1-CD1 4.29Å; L187-L191 WeakPolarHBondContact O-CG 3.31Å; L187-L191 PolarHBondContact O-N 2.86Å; K188-L191 PolarHBondContact O-N 3.3Å; L191-K193 PolarHBondContact O-N 3.31Å; L191-N194 PolarHBondContact O-N 3.05Å; L191-F200 HydrophobicContact CD2-CZ 4.03Å; L191-F200 HydrophobicContact CG-CZ 4.25Å; L191-F256 HydrophobicContact CD1-CE1 3.66Å; L191-F256 HydrophobicContact CD1-CZ 3.73Å; L191-I259 HydrophobicContact CD2-CD1 4.06Å
192R94.7Very high93.3Very high111 Ų11145.3 Ų45.342%0.41922%0.223SC..Hα-helixtrans-61.6-26.4175.4-75.3168.6174.7174-1.4114.1V145 D149 K188 E189 L190 N194V145-R192 HydrophobicContact CG1-CG 3.77Å; V145-R192 HydrophobicContact CG2-CG 4.08Å; D149-R192 VanDerWaalsContact CG-NH2 3.25Å; D149-R192 IonicContact OD1-CZ 3.83Å; D149-R192 IonicContact OD1-NH2 2.86Å; D149-R192 PolarHBondContact OD1-NH2 3.38Å; D149-R192 IonicContact OD2-CZ 2.83Å; D149-R192 IonicContact OD2-NE 3.64Å; D149-R192 IonicContact OD2-NH2 3.98Å; D149-R192 PolarHBondContact OD2-NH2 2.99Å; K188-R192 WeakPolarHBondContact O-CB 3.45Å; K188-R192 VanDerWaalsContact O-CG 3.3Å; K188-R192 WeakPolarHBondContact O-CG 3.46Å; K188-R192 PolarHBondContact O-N 3.43Å; E189-R192 VanDerWaalsContact OE1-CD 3.25Å; E189-R192 WeakPolarHBondContact OE1-CD 3.11Å; E189-R192 IonicContact OE1-CZ 2.7Å; E189-R192 IonicContact OE1-NE 3.74Å; E189-R192 IonicContact OE1-NH1 3.52Å; E189-R192 PolarHBondContact OE1-NH1 3.04Å; L190-R192 PolarHBondContact O-N 2.9Å; R192-N194 VanDerWaalsContact C-N 3.32Å
193K94.6Very high93.7Very high140 Ų14045 Ų4561%0.60922%0.217SC*.THydrogen-bonded Turntrans-89.31.9176.5-71162.7-165.5146.60113E189 L190 L191 A195E189-K193 WeakPolarHBondContact O-CB 3.19Å; E189-K193 WeakPolarHBondContact O-CD 3.42Å; E189-K193 VanDerWaalsContact O-CG 3.23Å; E189-K193 WeakPolarHBondContact O-CG 3.47Å; E189-K193 PolarHBondContact O-N 3.13Å; E189-K193 WeakPolarHBondContact OE2-CE 3.37Å; E189-K193 IonicContact OE2-NZ 2.65Å; E189-K193 PolarHBondContact OE2-NZ 3.13Å; L190-K193 PolarHBondContact O-N 2.83Å; L190-K193 VanDerWaalsContact O-N 3.15Å; L191-K193 PolarHBondContact O-N 3.31Å; K193-A195 VanDerWaalsContact C-N 3.25Å; K193-A195 PolarHBondContact O-N 3.16Å
194N93.8Very high94Very high42 Ų4244.4 Ų44.423%0.22521%0.213CC..THydrogen-bonded Turntrans51.945.1-171.7-153.1106.8000111.8L135 Q138 V141 L190 L191 R192L135-N194 PolarHBondContact O-ND2 3.09Å; Q138-N194 PolarHBondContact NE2-OD1 2.88Å; V141-N194 WeakPolarHBondContact CB-OD1 3.5Å; V141-N194 HydrophobicContact CG1-CB 4.47Å; V141-N194 WeakPolarHBondContact CG1-OD1 3.45Å; L190-N194 PolarHBondContact O-N 2.63Å; L191-N194 PolarHBondContact O-N 3.05Å; R192-N194 VanDerWaalsContact C-N 3.32Å
195A94.4Very high94Very high9 Ų947.9 Ų47.97%0.07423%0.232CC..  trans-56.1137.8-178.500000112.5L190 K193 F200L190-A195 HydrophobicContact CB-CB 3.86Å; L190-A195 HydrophobicContact CD2-CB 3.8Å; L190-A195 HydrophobicContact CG-CB 4.44Å; L190-A195 WeakPolarHBondContact O-CB 3.43Å; L190-A195 PolarHBondContact O-N 3.27Å; K193-A195 VanDerWaalsContact C-N 3.25Å; K193-A195 PolarHBondContact O-N 3.16Å; A195-F200 HydrophobicContact CB-CD2 4.24Å; A195-F200 HydrophobicContact CB-CE2 3.89Å; A195-F200 HydrophobicContact CB-CZ 4.39Å
196T94Very high94.1Very high68 Ų6847.5 Ų47.542%0.41724%0.237SC..  trans-79.4169.1174.276.60000110.8E198 S199 F200T196-E198 WeakPolarHBondContact CB-OE2 3.34Å; T196-E198 PolarHBondContact O-N 3.41Å; T196-E198 PolarHBondContact OG1-N 2.9Å; T196-E198 PolarHBondContact OG1-OE2 3.28Å; T196-S199 PolarHBondContact O-N 3.4Å; T196-F200 VanDerWaalsContact O-CD2 3.32Å; T196-F200 WeakPolarHBondContact O-CD2 3.45Å; T196-F200 PolarHBondContact O-N 2.9Å; T196-F200 VanDerWaalsContact O-N 3.08Å
197V93.6Very high94Very high1 Ų144.2 Ų44.21%0.00622%0.222CC..Hα-helixtrans-52.3-38.1175.2168.10000111.5A128 A131 R132 L135 F200 I201 L262A128-V197 HydrophobicContact CB-CG1 4.03Å; A131-V197 HydrophobicContact CB-CG2 4.13Å; R132-V197 HydrophobicContact CG-CB 4.2Å; R132-V197 HydrophobicContact CG-CG2 3.65Å; L135-V197 HydrophobicContact CD1-CG2 3.78Å; V197-F200 WeakPolarHBondContact O-CB 3.24Å; V197-F200 PolarHBondContact O-N 3.3Å; V197-I201 HydrophobicContact CG1-CD1 3.97Å; V197-I201 HydrophobicContact CG1-CG1 4.49Å; V197-I201 WeakPolarHBondContact O-CG1 3.29Å; V197-I201 PolarHBondContact O-N 2.9Å; V197-L262 HydrophobicContact CG1-CD2 4.14Å; V197-L262 HydrophobicContact CG2-CD2 4Å
198E92.5Very high93.8Very high68 Ų6843.9 Ų43.932%0.31822%0.22SC..Hα-helixtrans-65.8-39.7179.9-58.568.8-147.900111.7R132 T196 I201 E202R132-E198 IonicContact CZ-OE1 2.72Å; R132-E198 IonicContact NE-OE1 2.69Å; R132-E198 PolarHBondContact NE-OE1 3.34Å; R132-E198 IonicContact NH2-OE1 2.94Å; R132-E198 PolarHBondContact NH2-OE1 3.43Å; T196-E198 WeakPolarHBondContact CB-OE2 3.34Å; T196-E198 PolarHBondContact O-N 3.41Å; T196-E198 PolarHBondContact OG1-N 2.9Å; T196-E198 PolarHBondContact OG1-OE2 3.28Å; E198-I201 WeakPolarHBondContact O-CB 3.22Å; E198-I201 PolarHBondContact O-N 3.33Å; E198-E202 WeakPolarHBondContact O-CG 3.42Å; E198-E202 PolarHBondContact O-N 3.03Å
199S94.6Very high93.6Very high44 Ų4446 Ų4631%0.30823%0.231SC..Hα-helixtrans-71.2-28.5173.2-59.40000113.4T196 W203T196-S199 PolarHBondContact O-N 3.4Å; S199-W203 WeakPolarHBondContact O-CB 3.18Å; S199-W203 PolarHBondContact O-N 2.81Å
200F95Very high93Very high2 Ų247.7 Ų47.71%0.00924%0.238CC..Hα-helixtrans-68.8-37.3169.1-80.8-76.5000111.9L135 L187 L190 L191 A195 T196 V197 W203 L204 L263L135-F200 HydrophobicContact CD1-CD2 3.83Å; L135-F200 HydrophobicContact CD1-CE2 3.8Å; L135-F200 HydrophobicContact CD2-CE2 3.72Å; L135-F200 HydrophobicContact CD2-CZ 4.37Å; L135-F200 HydrophobicContact CG-CE2 4.44Å; L187-F200 HydrophobicContact CD1-CE1 3.87Å; L190-F200 HydrophobicContact CB-CD1 4.44Å; L190-F200 HydrophobicContact CB-CE1 3.76Å; L190-F200 HydrophobicContact CB-CZ 3.85Å; L190-F200 HydrophobicContact CD1-CD1 3.69Å; L190-F200 HydrophobicContact CD1-CE1 3.73Å; L190-F200 HydrophobicContact CD1-CG 4.5Å; L190-F200 HydrophobicContact CG-CE1 4.38Å; L191-F200 HydrophobicContact CD2-CZ 4.03Å; L191-F200 HydrophobicContact CG-CZ 4.25Å; A195-F200 HydrophobicContact CB-CD2 4.24Å; A195-F200 HydrophobicContact CB-CE2 3.89Å; A195-F200 HydrophobicContact CB-CZ 4.39Å; T196-F200 VanDerWaalsContact O-CD2 3.32Å; T196-F200 WeakPolarHBondContact O-CD2 3.45Å; T196-F200 PolarHBondContact O-N 2.9Å; T196-F200 VanDerWaalsContact O-N 3.08Å; V197-F200 WeakPolarHBondContact O-CB 3.24Å; V197-F200 PolarHBondContact O-N 3.3Å; F200-W203 HydrophobicContact CD1-CE3 4.25Å; F200-W203 HydrophobicContact CD1-CZ3 4.46Å; F200-L204 WeakPolarHBondContact O-CB 3.37Å; F200-L204 WeakPolarHBondContact O-CG 3.29Å; F200-L204 PolarHBondContact O-N 2.98Å; F200-L263 HydrophobicContact CB-CD2 4.09Å; F200-L263 HydrophobicContact CD1-CD2 3.92Å; F200-L263 HydrophobicContact CG-CD2 4.31Å
201I94Very high92.3Very high19 Ų1948.1 Ų48.110%0.09724%0.239CC..Hα-helixtrans-62-54.2173.8-71.2163.8000110.7M70 F124 V197 E198 W203 L204 D205 Y266M70-I201 HydrophobicContact CE-CD1 3.88Å; M70-I201 HydrophobicContact SD-CD1 3.6Å; F124-I201 HydrophobicContact CE1-CD1 4.22Å; F124-I201 HydrophobicContact CZ-CD1 3.78Å; F124-I201 HydrophobicContact CZ-CG1 4.05Å; V197-I201 HydrophobicContact CG1-CD1 3.97Å; V197-I201 HydrophobicContact CG1-CG1 4.49Å; V197-I201 WeakPolarHBondContact O-CG1 3.29Å; V197-I201 PolarHBondContact O-N 2.9Å; E198-I201 WeakPolarHBondContact O-CB 3.22Å; E198-I201 PolarHBondContact O-N 3.33Å; I201-W203 PolarHBondContact O-N 2.92Å; I201-L204 CarbonylContact O-C 3.6Å; I201-L204 PolarHBondContact O-N 2.93Å; I201-D205 PolarHBondContact O-N 2.92Å; I201-Y266 HydrophobicContact CB-CE2 4.46Å; I201-Y266 HydrophobicContact CG1-CD2 4.04Å; I201-Y266 HydrophobicContact CG1-CE2 4.02Å; I201-Y266 HydrophobicContact CG1-CG 4.46Å; I201-Y266 HydrophobicContact CG2-CE1 4.17Å; I201-Y266 HydrophobicContact CG2-CE2 3.82Å
202E94.4Very high91.6Very high137 Ų13748 Ų4864%0.6424%0.239SC*.Hα-helixtrans-57.2-36.6-180-71.6176168.100112.5E198 S206E198-E202 WeakPolarHBondContact O-CG 3.42Å; E198-E202 PolarHBondContact O-N 3.03Å; E202-S206 PolarHBondContact O-N 3.33Å
203W95.3Very high90.8Very high24 Ų2443.8 Ų43.89%0.09122%0.224CC..Hα-helixtrans-67.5-46.8172.5170.165.1000112.5V183 E186 L187 L190 S199 F200 I201 D205 S206 V207 W234 L263V183-W203 HydrophobicContact CG1-CH2 4.07Å; V183-W203 HydrophobicContact CG1-CZ2 3.78Å; V183-W203 WeakPolarHBondContact O-CZ2 3.32Å; E186-W203 HydrophobicContact CB-CZ2 4.13Å; E186-W203 PolarHBondContact OE2-NE1 3.28Å; L187-W203 HydrophobicContact CB-CH2 4.03Å; L187-W203 HydrophobicContact CB-CZ2 4.37Å; L190-W203 HydrophobicContact CD1-CB 3.84Å; L190-W203 HydrophobicContact CD1-CD2 3.51Å; L190-W203 HydrophobicContact CD1-CE3 3.6Å; L190-W203 HydrophobicContact CD1-CG 3.63Å; L190-W203 HydrophobicContact CD1-CZ3 4.31Å; S199-W203 WeakPolarHBondContact O-CB 3.18Å; S199-W203 PolarHBondContact O-N 2.81Å; F200-W203 HydrophobicContact CD1-CE3 4.25Å; F200-W203 HydrophobicContact CD1-CZ3 4.46Å; I201-W203 PolarHBondContact O-N 2.92Å; W203-D205 VanDerWaalsContact C-N 3.33Å; W203-D205 PolarHBondContact O-N 3.42Å; W203-S206 WeakPolarHBondContact O-CB 2.79Å; W203-S206 PolarHBondContact O-N 3.03Å; W203-S206 VanDerWaalsContact O-N 3.15Å; W203-V207 HydrophobicContact CD2-CG2 4.36Å; W203-V207 HydrophobicContact CZ2-CG2 4.25Å; W203-V207 WeakPolarHBondContact O-CG2 3.36Å; W203-V207 PolarHBondContact O-N 2.87Å; W203-W234 HydrophobicContact CH2-CH2 4.49Å; W203-L263 HydrophobicContact CZ3-CD1 4.32Å; W203-L263 HydrophobicContact CZ3-CD2 4.27Å
204L94.4Very high90Very high1 Ų140.6 Ų40.61%0.00521%0.21CC..Hα-helixtrans-63.8-36177.7-76.8-174.7000112.9F200 I201 S206 V207 V208 W234 L263 Y266 I267F200-L204 WeakPolarHBondContact O-CB 3.37Å; F200-L204 WeakPolarHBondContact O-CG 3.29Å; F200-L204 PolarHBondContact O-N 2.98Å; I201-L204 CarbonylContact O-C 3.6Å; I201-L204 PolarHBondContact O-N 2.93Å; L204-S206 VanDerWaalsContact C-N 3.34Å; L204-V207 PolarHBondContact O-N 3.5Å; L204-V208 WeakPolarHBondContact O-CG2 3.41Å; L204-V208 PolarHBondContact O-N 3.06Å; L204-W234 HydrophobicContact CD2-CH2 4.23Å; L204-L263 HydrophobicContact CD1-CB 3.98Å; L204-L263 HydrophobicContact CD1-CD2 3.49Å; L204-L263 VanDerWaalsContact CD1-CD2 3.49Å; L204-L263 HydrophobicContact CD1-CG 4.32Å; L204-L263 HydrophobicContact CD2-CD2 4.39Å; L204-L263 HydrophobicContact CG-CD2 3.98Å; L204-Y266 HydrophobicContact CB-CD1 3.72Å; L204-Y266 HydrophobicContact CB-CE1 4.06Å; L204-Y266 HydrophobicContact CD1-CD1 3.68Å; L204-Y266 HydrophobicContact CD1-CG 4.13Å; L204-Y266 HydrophobicContact CG-CD1 4.39Å; L204-I267 HydrophobicContact CD1-CG1 4.2Å; L204-I267 HydrophobicContact CD2-CD1 3.86Å; L204-I267 HydrophobicContact CD2-CG1 4.1Å
205D92.4Very high88.5Confident74 Ų7440 Ų4040%0.39621%0.208SC..Hα-helixtrans-59-46.4171-87.9-34.1000111I201 W203 V207 V208 E209 Y266I201-D205 PolarHBondContact O-N 2.92Å; W203-D205 VanDerWaalsContact C-N 3.33Å; W203-D205 PolarHBondContact O-N 3.42Å; D205-V207 PolarHBondContact O-N 3.15Å; D205-V208 PolarHBondContact O-N 3.36Å; D205-E209 WeakPolarHBondContact O-CB 3.32Å; D205-E209 PolarHBondContact O-N 3.42Å; D205-Y266 PolarHBondContact OD1-OH 2.92Å; D205-Y266 VanDerWaalsContact OD1-OH 3.13Å; D205-Y266 PolarHBondContact OD2-OH 2.99Å
206S92.1Very high86.8Confident61 Ų6139.9 Ų39.943%0.42721%0.208SC..Hα-helixtrans-59.3-45.1174.2-171.80000111.7E202 W203 L204 H210E202-S206 PolarHBondContact O-N 3.33Å; W203-S206 WeakPolarHBondContact O-CB 2.79Å; W203-S206 PolarHBondContact O-N 3.03Å; W203-S206 VanDerWaalsContact O-N 3.15Å; L204-S206 VanDerWaalsContact C-N 3.34Å; S206-H210 VanDerWaalsContact O-CB 3.29Å; S206-H210 WeakPolarHBondContact O-CB 3.19Å; S206-H210 PolarHBondContact O-CD2 3.1Å; S206-H210 VanDerWaalsContact O-CD2 3.26Å; S206-H210 PolarHBondContact O-N 2.87Å
207V91.4Very high85.3Confident7 Ų743.9 Ų43.94%0.04222%0.22CC..Hα-helixtrans-59.8-56.1175.6174.40000110.4W203 L204 D205 E209 H210 K211 F230W203-V207 HydrophobicContact CD2-CG2 4.36Å; W203-V207 HydrophobicContact CZ2-CG2 4.25Å; W203-V207 WeakPolarHBondContact O-CG2 3.36Å; W203-V207 PolarHBondContact O-N 2.87Å; L204-V207 PolarHBondContact O-N 3.5Å; D205-V207 PolarHBondContact O-N 3.15Å; V207-E209 PolarHBondContact O-N 3.04Å; V207-H210 PolarHBondContact O-N 3.31Å; V207-K211 HydrophobicContact CG1-CG 3.98Å; V207-K211 WeakPolarHBondContact O-CA 3.28Å; V207-K211 WeakPolarHBondContact O-CB 3.31Å; V207-K211 WeakPolarHBondContact O-CG 3.45Å; V207-K211 PolarHBondContact O-N 3.49Å; V207-F230 HydrophobicContact CG1-CE2 4.07Å; V207-F230 HydrophobicContact CG1-CZ 3.91Å
208V90.2Very high83.5Confident3 Ų351.5 Ų51.52%0.01826%0.255CS..Hα-helixtrans-62.9-41-176.8174.20000111.8L204 D205 V212 I213 F230 I267 L271L204-V208 WeakPolarHBondContact O-CG2 3.41Å; L204-V208 PolarHBondContact O-N 3.06Å; D205-V208 PolarHBondContact O-N 3.36Å; V208-V212 HydrophobicContact CG1-CB 4.46Å; V208-V212 WeakPolarHBondContact O-CA 3.34Å; V208-V212 WeakPolarHBondContact O-CB 3.3Å; V208-V212 PolarHBondContact O-N 2.92Å; V208-I213 HydrophobicContact CG1-CD1 4.15Å; V208-I213 HydrophobicContact CG1-CG1 4.36Å; V208-I213 PolarHBondContact O-N 3.23Å; V208-F230 HydrophobicContact CG2-CE1 4.32Å; V208-I267 HydrophobicContact CG2-CG1 4.18Å; V208-L271 HydrophobicContact CG1-CD2 3.89Å; V208-L271 HydrophobicContact CG1-CG 4.42Å
209E87.7Confident81.6Confident59 Ų5951 Ų5128%0.27626%0.259SS..Iπ-helixtrans-65.1-44.6176.9171.367.9-175.200111.8D205 V207 I213 K214D205-E209 WeakPolarHBondContact O-CB 3.32Å; D205-E209 PolarHBondContact O-N 3.42Å; V207-E209 PolarHBondContact O-N 3.04Å; E209-I213 PolarHBondContact O-N 3.49Å; E209-I213 VanDerWaalsContact OE2-CB 3.22Å; E209-I213 WeakPolarHBondContact OE2-CB 3.42Å; E209-I213 WeakPolarHBondContact OE2-CG2 3.41Å; E209-K214 HydrophobicContact CG-CD 3.9Å; E209-K214 HydrophobicContact CG-CG 4.17Å; E209-K214 WeakPolarHBondContact O-CB 3.25Å; E209-K214 WeakPolarHBondContact O-CG 3.44Å; E209-K214 PolarHBondContact O-N 3.38Å; E209-K214 WeakPolarHBondContact OE1-CE 3.45Å; E209-K214 VanDerWaalsContact OE1-CG 3.27Å; E209-K214 WeakPolarHBondContact OE1-CG 3.2Å; E209-K214 IonicContact OE1-NZ 2.81Å
210H83.5Confident79.5Confident101 Ų10152.6 Ų52.647%0.46828%0.282SS..Iπ-helixtrans-76.3-31.5179.3-81-104.8000113.8S206 V207 K214 P215S206-H210 VanDerWaalsContact O-CB 3.29Å; S206-H210 WeakPolarHBondContact O-CB 3.19Å; S206-H210 PolarHBondContact O-CD2 3.1Å; S206-H210 VanDerWaalsContact O-CD2 3.26Å; S206-H210 PolarHBondContact O-N 2.87Å; V207-H210 PolarHBondContact O-N 3.31Å; H210-K214 PolarHBondContact CD2-NZ 2.58Å; H210-K214 VanDerWaalsContact CD2-NZ 3.33Å; H210-K214 PolarHBondContact NE2-NZ 2.94Å; H210-P215 WeakPolarHBondContact O-CD 3.49Å; H210-P215 VanDerWaalsContact O-CG 3.31Å; H210-P215 WeakPolarHBondContact O-CG 3.26Å
211K79.9Confident77.7Confident38 Ų3856.8 Ų56.817%0.16530%0.298CS..Iπ-helixtrans-92.2-38.7-174.5-64-49.1178.2-1710112.8Y175 D179 V207 R226 F230Y175-K211 WeakPolarHBondContact OH-CA 3.47Å; Y175-K211 WeakPolarHBondContact OH-CB 3.32Å; Y175-K211 WeakPolarHBondContact OH-CD 3.47Å; Y175-K211 PolarHBondContact OH-O 3.43Å; D179-K211 IonicContact OD1-NZ 2.86Å; D179-K211 PolarHBondContact OD1-NZ 3.44Å; D179-K211 WeakPolarHBondContact OD2-CE 3.39Å; D179-K211 IonicContact OD2-NZ 3.6Å; D179-K211 PolarHBondContact OD2-NZ 2.86Å; V207-K211 HydrophobicContact CG1-CG 3.98Å; V207-K211 WeakPolarHBondContact O-CA 3.28Å; V207-K211 WeakPolarHBondContact O-CB 3.31Å; V207-K211 WeakPolarHBondContact O-CG 3.45Å; V207-K211 PolarHBondContact O-N 3.49Å; K211-R226 WeakPolarHBondContact O-CD 3.36Å; K211-F230 HydrophobicContact CB-CD2 4.05Å; K211-F230 HydrophobicContact CB-CE2 3.94Å; K211-F230 HydrophobicContact CG-CE2 4.33Å
212V80.1Confident76.7Confident0 Ų059.4 Ų59.40%032%0.318CS..Iπ-helixtrans-107.3-52.1-176.5-174.10000112.3V208 G216 V223 R226 A227 F230 L271V208-V212 HydrophobicContact CG1-CB 4.46Å; V208-V212 WeakPolarHBondContact O-CA 3.34Å; V208-V212 WeakPolarHBondContact O-CB 3.3Å; V208-V212 PolarHBondContact O-N 2.92Å; V212-G216 PolarHBondContact O-N 2.98Å; V212-G216 VanDerWaalsContact O-N 3.09Å; V212-V223 HydrophobicContact CG1-CG1 3.85Å; V212-R226 HydrophobicContact CG1-CG 4.41Å; V212-R226 WeakPolarHBondContact O-CD 3.3Å; V212-A227 HydrophobicContact CG1-CB 4.1Å; V212-F230 HydrophobicContact CG2-CB 3.77Å; V212-F230 HydrophobicContact CG2-CD1 3.66Å; V212-F230 HydrophobicContact CG2-CD2 4.24Å; V212-F230 HydrophobicContact CG2-CE1 4.32Å; V212-F230 HydrophobicContact CG2-CG 3.62Å; V212-L271 HydrophobicContact CB-CD2 4.27Å; V212-L271 HydrophobicContact CG1-CD2 3.91Å; V212-L271 HydrophobicContact CG2-CD2 4.24Å
213I78Confident75.9Confident21 Ų2154.3 Ų54.311%0.10830%0.296CS..Iπ-helixtrans-81.9-52.1-162.9-54174.5000112.7V208 E209 G216 K217 Q274V208-I213 HydrophobicContact CG1-CD1 4.15Å; V208-I213 HydrophobicContact CG1-CG1 4.36Å; V208-I213 PolarHBondContact O-N 3.23Å; E209-I213 PolarHBondContact O-N 3.49Å; E209-I213 VanDerWaalsContact OE2-CB 3.22Å; E209-I213 WeakPolarHBondContact OE2-CB 3.42Å; E209-I213 WeakPolarHBondContact OE2-CG2 3.41Å; I213-G216 WeakPolarHBondContact O-CA 3.36Å; I213-G216 PolarHBondContact O-N 3.19Å; I213-G216 VanDerWaalsContact O-N 3.1Å; I213-K217 HydrophobicContact CG2-CD 4.12Å; I213-K217 VanDerWaalsContact CG2-CE 3.46Å; I213-K217 PolarHBondContact O-N 2.74Å; I213-Q274 HydrophobicContact CD1-CG 3.98Å; I213-Q274 HydrophobicContact CG1-CG 4.33Å
214K78.2Confident75.2Confident73 Ų7355.5 Ų55.532%0.31730%0.302SS..Hα-helixtrans-57.8-48.9178-76.8164.5171.4138.40112.1E209 H210 G216 K217 Q218E209-K214 HydrophobicContact CG-CD 3.9Å; E209-K214 HydrophobicContact CG-CG 4.17Å; E209-K214 WeakPolarHBondContact O-CB 3.25Å; E209-K214 WeakPolarHBondContact O-CG 3.44Å; E209-K214 PolarHBondContact O-N 3.38Å; E209-K214 WeakPolarHBondContact OE1-CE 3.45Å; E209-K214 VanDerWaalsContact OE1-CG 3.27Å; E209-K214 WeakPolarHBondContact OE1-CG 3.2Å; E209-K214 IonicContact OE1-NZ 2.81Å; H210-K214 PolarHBondContact CD2-NZ 2.58Å; H210-K214 VanDerWaalsContact CD2-NZ 3.33Å; H210-K214 PolarHBondContact NE2-NZ 2.94Å; K214-G216 VanDerWaalsContact C-N 3.27Å; K214-G216 PolarHBondContact O-N 3.35Å; K214-K217 PolarHBondContact O-N 2.92Å; K214-Q218 WeakPolarHBondContact O-CG 3.26Å; K214-Q218 PolarHBondContact O-N 3.48Å
215P62.5Low74.6Confident29 Ų2960.7 Ų60.719%0.18833%0.325CS..Hα-helixtrans-69.7-24.7175.5-18.734.4000112.7H210 C219 R226H210-P215 WeakPolarHBondContact O-CD 3.49Å; H210-P215 VanDerWaalsContact O-CG 3.31Å; H210-P215 WeakPolarHBondContact O-CG 3.26Å; P215-C219 WeakPolarHBondContact O-CB 3.47Å; P215-C219 PolarHBondContact O-N 3.34Å; P215-R226 VanDerWaalsContact C-NH1 3.27Å; P215-R226 PolarHBondContact O-NH1 3.39Å; P215-R226 PolarHBondContact O-NH2 3.2Å
216G58.2Low74.1Confident7 Ų758.7 Ų58.77%0.07231%0.311CS..Hα-helixtrans-56.9-56.3170.300000112.1V212 I213 K214 Q218V212-G216 PolarHBondContact O-N 2.98Å; V212-G216 VanDerWaalsContact O-N 3.09Å; I213-G216 WeakPolarHBondContact O-CA 3.36Å; I213-G216 PolarHBondContact O-N 3.19Å; I213-G216 VanDerWaalsContact O-N 3.1Å; K214-G216 VanDerWaalsContact C-N 3.27Å; K214-G216 PolarHBondContact O-N 3.35Å; G216-Q218 VanDerWaalsContact C-N 3.28Å; G216-Q218 PolarHBondContact O-N 3.01Å
217K62.6Low73.9Confident152 Ų15255.8 Ų55.866%0.66129%0.291SS*.Hα-helixtrans-67-24-176.1-67165.5-178.2166.80114I213 K214I213-K217 HydrophobicContact CG2-CD 4.12Å; I213-K217 VanDerWaalsContact CG2-CE 3.46Å; I213-K217 PolarHBondContact O-N 2.74Å; K214-K217 PolarHBondContact O-N 2.92Å
218Q57.1Low73.7Confident162 Ų16259.4 Ų59.476%0.75731%0.308SS*.Hα-helixtrans-95.8-26.8-174.4-66.2173.210.700114.6K214 G216K214-Q218 WeakPolarHBondContact O-CG 3.26Å; K214-Q218 PolarHBondContact O-N 3.48Å; G216-Q218 VanDerWaalsContact C-N 3.28Å; G216-Q218 PolarHBondContact O-N 3.01Å
219C51.2Low73.4Confident57 Ų5762.6 Ų62.639%0.38533%0.325SS..Hα-helixtrans-107-1.7-163.6-173.40000114.1P215 R221P215-C219 WeakPolarHBondContact O-CB 3.47Å; P215-C219 PolarHBondContact O-N 3.34Å; C219-R221 PolarHBondContact O-N 3.05Å
220G51.7Low73.4Confident78 Ų7860.6 Ų60.680%0.80432%0.315SS*.  trans69.1-22.1179.800000116S222G220-S222 PolarHBondContact O-N 3.16Å
221R56.9Low73.8Confident89 Ų8956.4 Ų56.434%0.33630%0.296SS..SBendtrans-58.3132.7166.9-63.7-176-178.3175.46.6109.6D169 C219 V223D169-R221 IonicContact OD2-CZ 2.67Å; D169-R221 IonicContact OD2-NE 2.69Å; D169-R221 IonicContact OD2-NH2 3.54Å; D169-R221 PolarHBondContact OD2-NH2 3.15Å; C219-R221 PolarHBondContact O-N 3.05Å; R221-V223 PolarHBondContact O-N 3.49Å
222S72Confident74.2Confident75 Ų7559.2 Ų59.252%0.52431%0.312SS..  trans-57.8134.5-178.660.40000112G220 K224 K225 R226G220-S222 PolarHBondContact O-N 3.16Å; S222-K224 PolarHBondContact O-N 2.9Å; S222-K225 PolarHBondContact O-N 2.74Å; S222-K225 PolarHBondContact OG-N 2.95Å; S222-R226 PolarHBondContact O-N 2.82Å
223V78.1Confident74.5Confident29 Ų2964.3 Ų64.318%0.17633%0.332CS..Hα-helixtrans-54.1-41.1178.3-167.50000110.2V212 R221 K225 R226 A227 F275V212-V223 HydrophobicContact CG1-CG1 3.85Å; R221-V223 PolarHBondContact O-N 3.49Å; V223-K225 PolarHBondContact O-N 2.89Å; V223-R226 PolarHBondContact O-N 2.8Å; V223-R226 VanDerWaalsContact O-N 3.16Å; V223-A227 PolarHBondContact O-N 2.74Å; V223-F275 HydrophobicContact CB-CE1 4.33Å; V223-F275 HydrophobicContact CG1-CE1 4.15Å
224K80.9Confident75.1Confident50 Ų5064 Ų6422%0.21733%0.329CS..Hα-helixtrans-48.5-48.3172.2-169.9157.6178.71470113.6S222 A227 Q228 F275 L633 D634 E635S222-K224 PolarHBondContact O-N 2.9Å; K224-A227 PolarHBondContact O-N 2.91Å; K224-Q228 WeakPolarHBondContact O-CG 3.43Å; K224-Q228 PolarHBondContact O-N 3.24Å; K224-F275 HydrophobicContact CB-CE1 4.49Å; K224-F275 HydrophobicContact CB-CZ 4.42Å; K224-L633 VanDerWaalsContact CE-C 3.43Å; K224-L633 WeakPolarHBondContact CE-O 3.38Å; K224-L633 HydrophobicContact CG-CD2 4Å; K224-L633 PolarHBondContact NZ-O 3.15Å; K224-L633 VanDerWaalsContact NZ-O 3.15Å; K224-D634 PolarHBondContact NZ-O 3.27Å; K224-E635 IonicContact NZ-OE1 2.99Å; K224-E635 PolarHBondContact NZ-OE1 3.47Å
225K81.5Confident75.7Confident110 Ų11063.2 Ų63.248%0.47833%0.333SS..Hα-helixtrans-66-46.8177.7-174.8177.3176.8-178.10111.6S222 V223 A227 Q228 D229S222-K225 PolarHBondContact O-N 2.74Å; S222-K225 PolarHBondContact OG-N 2.95Å; V223-K225 PolarHBondContact O-N 2.89Å; K225-A227 PolarHBondContact O-N 3.4Å; K225-Q228 WeakPolarHBondContact O-CG 3.22Å; K225-Q228 PolarHBondContact O-N 3.11Å; K225-D229 PolarHBondContact O-N 3.27Å; K225-D229 VanDerWaalsContact O-N 3.12Å
226R81.8Confident76.9Confident32 Ų3264.8 Ų64.812%0.12134%0.337CS..Hα-helixtrans-62-32.6179.8-179.6171.5-81.6117.5-16.8112.4K211 V212 P215 S222 V223 D229 F230K211-R226 WeakPolarHBondContact O-CD 3.36Å; V212-R226 HydrophobicContact CG1-CG 4.41Å; V212-R226 WeakPolarHBondContact O-CD 3.3Å; P215-R226 VanDerWaalsContact C-NH1 3.27Å; P215-R226 PolarHBondContact O-NH1 3.39Å; P215-R226 PolarHBondContact O-NH2 3.2Å; S222-R226 PolarHBondContact O-N 2.82Å; V223-R226 PolarHBondContact O-N 2.8Å; V223-R226 VanDerWaalsContact O-N 3.16Å; R226-D229 PolarHBondContact O-N 3.41Å; R226-F230 VanDerWaalsContact O-CB 3.31Å; R226-F230 WeakPolarHBondContact O-CB 3.42Å; R226-F230 PolarHBondContact O-N 2.77Å
227A87.8Confident78.3Confident0 Ų064.9 Ų64.90%034%0.335CS..Hα-helixtrans-65.3-37.9172.900000112.8V212 V223 K224 K225 F230 L231 L271 F275 L633V212-A227 HydrophobicContact CG1-CB 4.1Å; V223-A227 PolarHBondContact O-N 2.74Å; K224-A227 PolarHBondContact O-N 2.91Å; K225-A227 PolarHBondContact O-N 3.4Å; A227-F230 PolarHBondContact O-N 3.21Å; A227-L231 VanDerWaalsContact O-CB 3.31Å; A227-L231 WeakPolarHBondContact O-CB 3.32Å; A227-L231 VanDerWaalsContact O-CG 3.25Å; A227-L231 WeakPolarHBondContact O-CG 3.36Å; A227-L231 PolarHBondContact O-N 3.12Å; A227-L271 HydrophobicContact CB-CD1 4.34Å; A227-L271 HydrophobicContact CB-CD2 4.1Å; A227-F275 HydrophobicContact CB-CE2 4.38Å; A227-F275 HydrophobicContact CB-CZ 3.68Å; A227-L633 HydrophobicContact CB-CD2 4.42Å
228Q86.9Confident79.7Confident83 Ų8357.7 Ų57.739%0.38830%0.304SS..Hα-helixtrans-65.3-47.1174.5-23.8-173-86.100110.6K224 K225 F230 L231 L232 L633K224-Q228 WeakPolarHBondContact O-CG 3.43Å; K224-Q228 PolarHBondContact O-N 3.24Å; K225-Q228 WeakPolarHBondContact O-CG 3.22Å; K225-Q228 PolarHBondContact O-N 3.11Å; Q228-F230 VanDerWaalsContact C-N 3.27Å; Q228-F230 PolarHBondContact O-N 2.91Å; Q228-L231 PolarHBondContact O-N 2.82Å; Q228-L232 WeakPolarHBondContact O-CB 3.43Å; Q228-L232 PolarHBondContact O-N 3.24Å; Q228-L633 HydrophobicContact CB-CD1 4.03Å; Q228-L633 HydrophobicContact CG-CD1 3.71Å; Q228-L633 HydrophobicContact CG-CD2 3.96Å; Q228-L633 HydrophobicContact CG-CG 4.38Å
229D84.6Confident81.3Confident70 Ų7052.9 Ų52.937%0.37429%0.292SS..Hα-helixtrans-59.1-39.3177.5-64.6-35.3000111.4K225 R226 R233K225-D229 PolarHBondContact O-N 3.27Å; K225-D229 VanDerWaalsContact O-N 3.12Å; R226-D229 PolarHBondContact O-N 3.41Å; D229-R233 WeakPolarHBondContact O-CD 3.43Å; D229-R233 VanDerWaalsContact O-CG 3.25Å; D229-R233 WeakPolarHBondContact O-CG 3.31Å; D229-R233 PolarHBondContact O-N 3.05Å
230F88.1Confident83.1Confident17 Ų1753.7 Ų53.78%0.07529%0.287CS..Hα-helixtrans-69.9-50.4175.6174.9-105.3000112.7V207 V208 K211 V212 R226 A227 Q228 L232 R233 W234 I267 L271V207-F230 HydrophobicContact CG1-CE2 4.07Å; V207-F230 HydrophobicContact CG1-CZ 3.91Å; V208-F230 HydrophobicContact CG2-CE1 4.32Å; K211-F230 HydrophobicContact CB-CD2 4.05Å; K211-F230 HydrophobicContact CB-CE2 3.94Å; K211-F230 HydrophobicContact CG-CE2 4.33Å; V212-F230 HydrophobicContact CG2-CB 3.77Å; V212-F230 HydrophobicContact CG2-CD1 3.66Å; V212-F230 HydrophobicContact CG2-CD2 4.24Å; V212-F230 HydrophobicContact CG2-CE1 4.32Å; V212-F230 HydrophobicContact CG2-CG 3.62Å; R226-F230 VanDerWaalsContact O-CB 3.31Å; R226-F230 WeakPolarHBondContact O-CB 3.42Å; R226-F230 PolarHBondContact O-N 2.77Å; A227-F230 PolarHBondContact O-N 3.21Å; Q228-F230 VanDerWaalsContact C-N 3.27Å; Q228-F230 PolarHBondContact O-N 2.91Å; F230-L232 VanDerWaalsContact C-N 3.29Å; F230-L232 PolarHBondContact O-N 3.33Å; F230-R233 PolarHBondContact O-N 2.9Å; F230-R233 VanDerWaalsContact O-N 3.15Å; F230-W234 VanDerWaalsContact O-CB 3.32Å; F230-W234 WeakPolarHBondContact O-CB 3.49Å; F230-W234 PolarHBondContact O-N 2.86Å; F230-I267 HydrophobicContact CE1-CD1 4.44Å; F230-I267 HydrophobicContact CE1-CG2 3.82Å; F230-I267 HydrophobicContact CZ-CD1 4.48Å; F230-L271 HydrophobicContact CD1-CD1 4.46Å
231L91Very high85Confident13 Ų1350.5 Ų50.57%0.06825%0.251CS..Hα-helixtrans-59.6-38.4-179.8-77.3168.9000112.1A227 Q228 S235 I267 L268 L271 P629 L633A227-L231 VanDerWaalsContact O-CB 3.31Å; A227-L231 WeakPolarHBondContact O-CB 3.32Å; A227-L231 VanDerWaalsContact O-CG 3.25Å; A227-L231 WeakPolarHBondContact O-CG 3.36Å; A227-L231 PolarHBondContact O-N 3.12Å; Q228-L231 PolarHBondContact O-N 2.82Å; L231-S235 VanDerWaalsContact O-CB 3.3Å; L231-S235 WeakPolarHBondContact O-CB 3.32Å; L231-S235 PolarHBondContact O-N 2.83Å; L231-S235 PolarHBondContact O-OG 3.28Å; L231-I267 HydrophobicContact CD2-CG2 3.68Å; L231-L268 HydrophobicContact CD1-CD2 4.18Å; L231-L268 HydrophobicContact CD2-CD2 3.77Å; L231-L271 HydrophobicContact CD1-CD1 3.92Å; L231-L271 HydrophobicContact CD2-CD1 3.9Å; L231-L271 HydrophobicContact CG-CD1 3.84Å; L231-P629 HydrophobicContact CD1-CB 4.07Å; L231-L633 HydrophobicContact CD1-CD1 4.32Å
232L89Confident86.7Confident97 Ų9747.5 Ų47.551%0.50824%0.242SC..Hα-helixtrans-63.7-46.4174.9-179.661.5000111.9L162 Q228 F230 S235 F236L162-L232 HydrophobicContact CD1-CD1 4.44Å; L162-L232 HydrophobicContact CD1-CD2 4.12Å; Q228-L232 WeakPolarHBondContact O-CB 3.43Å; Q228-L232 PolarHBondContact O-N 3.24Å; F230-L232 VanDerWaalsContact C-N 3.29Å; F230-L232 PolarHBondContact O-N 3.33Å; L232-S235 PolarHBondContact O-N 2.82Å; L232-F236 PolarHBondContact O-N 2.94Å
233R85.4Confident87.7Confident107 Ų10748.5 Ų48.540%0.40424%0.238SC..Hα-helixtrans-64.8-42.7177-71.3169.8-176.7-111.6-2.7111.8Y175 D229 F230 S235 F236 F237Y175-R233 PolarHBondContact O-NH1 2.92Å; Y175-R233 VanDerWaalsContact O-NH1 3.13Å; D229-R233 WeakPolarHBondContact O-CD 3.43Å; D229-R233 VanDerWaalsContact O-CG 3.25Å; D229-R233 WeakPolarHBondContact O-CG 3.31Å; D229-R233 PolarHBondContact O-N 3.05Å; F230-R233 PolarHBondContact O-N 2.9Å; F230-R233 VanDerWaalsContact O-N 3.15Å; R233-S235 VanDerWaalsContact C-N 3.34Å; R233-S235 PolarHBondContact O-N 3.16Å; R233-F236 PolarHBondContact O-N 3.17Å; R233-F237 VanDerWaalsContact O-CB 3.28Å; R233-F237 WeakPolarHBondContact O-CB 3.44Å; R233-F237 PolarHBondContact O-N 2.8Å
234W91.3Very high88.4Confident14 Ų1447.8 Ų47.85%0.05323%0.233CC..Hα-helixtrans-63.7-36176.1175.9-99.6000112.9V183 W203 L204 F230 F237 G238 R260 L263 D264 I267V183-W234 HydrophobicContact CG1-CZ3 3.97Å; W203-W234 HydrophobicContact CH2-CH2 4.49Å; L204-W234 HydrophobicContact CD2-CH2 4.23Å; F230-W234 VanDerWaalsContact O-CB 3.32Å; F230-W234 WeakPolarHBondContact O-CB 3.49Å; F230-W234 PolarHBondContact O-N 2.86Å; W234-F237 AromaticContact CE3-CD1 3.97Å; W234-F237 HydrophobicContact CE3-CD1 3.97Å; W234-F237 HydrophobicContact CE3-CE1 4.41Å; W234-F237 HydrophobicContact CH2-CE1 4.4Å; W234-F237 AromaticContact CZ3-CD1 3.93Å; W234-F237 HydrophobicContact CZ3-CD1 3.93Å; W234-F237 AromaticContact CZ3-CE1 3.92Å; W234-F237 HydrophobicContact CZ3-CE1 3.92Å; W234-G238 PolarHBondContact O-N 3.45Å; W234-G238 VanDerWaalsContact O-N 3.1Å; W234-R260 VanDerWaalsContact NE1-NH1 3.17Å; W234-R260 PolarHBondContact O-NH1 2.82Å; W234-R260 PolarHBondContact O-NH2 2.85Å; W234-L263 HydrophobicContact CH2-CB 4.39Å; W234-L263 HydrophobicContact CH2-CD1 4.32Å; W234-L263 HydrophobicContact CZ2-CB 3.82Å; W234-L263 HydrophobicContact CZ2-CD1 4.4Å; W234-D264 PolarHBondContact NE1-OD1 3.44Å; W234-I267 HydrophobicContact CD2-CD1 3.49Å; W234-I267 VanDerWaalsContact CD2-CD1 3.49Å; W234-I267 HydrophobicContact CE3-CD1 3.96Å; W234-I267 HydrophobicContact CG-CD1 3.99Å; W234-I267 HydrophobicContact CH2-CD1 3.96Å; W234-I267 HydrophobicContact CZ2-CD1 3.5Å; W234-I267 HydrophobicContact CZ3-CD1 4.17Å
235S91.1Very high89Confident57 Ų5745.4 Ų45.440%0.39922%0.223SC..Hα-helixtrans-68.3-45.1174.9-59.40000111.7L231 L232 R233 A239L231-S235 VanDerWaalsContact O-CB 3.3Å; L231-S235 WeakPolarHBondContact O-CB 3.32Å; L231-S235 PolarHBondContact O-N 2.83Å; L231-S235 PolarHBondContact O-OG 3.28Å; L232-S235 PolarHBondContact O-N 2.82Å; R233-S235 VanDerWaalsContact C-N 3.34Å; R233-S235 PolarHBondContact O-N 3.16Å; S235-A239 WeakPolarHBondContact O-CB 3.44Å; S235-A239 PolarHBondContact O-N 3.48Å
236F87.5Confident89.5Confident61 Ų6144.3 Ų44.327%0.26823%0.225SC..Hα-helixtrans-61.7-43.8174.2-177.8-94.7000112.2S158 P160 L232 R233 A239 R240S158-F236 WeakPolarHBondContact O-CE1 3.42Å; S158-F236 VanDerWaalsContact O-CZ 3.27Å; S158-F236 WeakPolarHBondContact O-CZ 3.08Å; P160-F236 HydrophobicContact CB-CD2 4.32Å; P160-F236 HydrophobicContact CB-CE2 4.19Å; P160-F236 HydrophobicContact CB-CZ 4.39Å; P160-F236 HydrophobicContact CG-CD1 3.79Å; P160-F236 HydrophobicContact CG-CD2 4.03Å; P160-F236 HydrophobicContact CG-CE1 3.79Å; P160-F236 HydrophobicContact CG-CE2 4.03Å; P160-F236 HydrophobicContact CG-CG 3.9Å; P160-F236 HydrophobicContact CG-CZ 3.89Å; L232-F236 PolarHBondContact O-N 2.94Å; R233-F236 PolarHBondContact O-N 3.17Å; F236-A239 PolarHBondContact O-N 3.32Å; F236-R240 HydrophobicContact CD1-CG 4.13Å; F236-R240 HydrophobicContact CE1-CG 3.81Å; F236-R240 HydrophobicContact CZ-CG 4.12Å; F236-R240 WeakPolarHBondContact O-CG 3.15Å; F236-R240 PolarHBondContact O-N 3.09Å
237F88.6Confident90Very high9 Ų948.6 Ų48.64%0.03925%0.25CC..Hα-helixtrans-56.3-52.1176.9174.2-111.4000112.3I156 S180 V183 F184 R233 W234 A239 R240 I241I156-F237 HydrophobicContact CG2-CD2 4.02Å; I156-F237 HydrophobicContact CG2-CE2 4.14Å; S180-F237 WeakPolarHBondContact O-CE2 3.42Å; V183-F237 HydrophobicContact CB-CZ 4.4Å; V183-F237 HydrophobicContact CG1-CE1 3.74Å; V183-F237 HydrophobicContact CG1-CZ 3.8Å; F184-F237 HydrophobicContact CB-CE2 3.92Å; F184-F237 HydrophobicContact CB-CZ 3.94Å; F184-F237 HydrophobicContact CD2-CE2 4.38Å; F184-F237 HydrophobicContact CD2-CZ 4.25Å; R233-F237 VanDerWaalsContact O-CB 3.28Å; R233-F237 WeakPolarHBondContact O-CB 3.44Å; R233-F237 PolarHBondContact O-N 2.8Å; W234-F237 AromaticContact CE3-CD1 3.97Å; W234-F237 HydrophobicContact CE3-CD1 3.97Å; W234-F237 HydrophobicContact CE3-CE1 4.41Å; W234-F237 HydrophobicContact CH2-CE1 4.4Å; W234-F237 AromaticContact CZ3-CD1 3.93Å; W234-F237 HydrophobicContact CZ3-CD1 3.93Å; W234-F237 AromaticContact CZ3-CE1 3.92Å; W234-F237 HydrophobicContact CZ3-CE1 3.92Å; F237-A239 PolarHBondContact O-N 3.2Å; F237-R240 PolarHBondContact O-N 3.02Å; F237-I241 HydrophobicContact CD1-CD1 4.2Å; F237-I241 HydrophobicContact CD2-CD1 4.42Å; F237-I241 HydrophobicContact CE1-CD1 3.73Å; F237-I241 HydrophobicContact CE2-CD1 3.99Å; F237-I241 HydrophobicContact CZ-CD1 3.62Å; F237-I241 PolarHBondContact O-N 3.17Å; F237-I241 VanDerWaalsContact O-N 3.12Å
238G91.6Very high90.2Very high2 Ų252.1 Ų52.12%0.02127%0.269CS..Hα-helixtrans-62.8-42.917600000113.3W234 R240 I241 M242W234-G238 PolarHBondContact O-N 3.45Å; W234-G238 VanDerWaalsContact O-N 3.1Å; G238-R240 VanDerWaalsContact C-N 3.27Å; G238-R240 PolarHBondContact O-N 3.29Å; G238-I241 PolarHBondContact O-N 3.47Å; G238-I241 VanDerWaalsContact O-N 3.15Å; G238-M242 WeakPolarHBondContact O-CG 3.13Å; G238-M242 PolarHBondContact O-N 3.31Å
239A91Very high90.5Very high60 Ų6055 Ų5550%0.49629%0.287SS..Hα-helixtrans-59.2-38.4176.700000112S235 F236 F237 H243S235-A239 WeakPolarHBondContact O-CB 3.44Å; S235-A239 PolarHBondContact O-N 3.48Å; F236-A239 PolarHBondContact O-N 3.32Å; F237-A239 PolarHBondContact O-N 3.2Å; A239-H243 WeakPolarHBondContact O-CB 3.41Å; A239-H243 PolarHBondContact O-N 3.4Å
240R88.4Confident90.9Very high74 Ų7452.1 Ų52.128%0.27927%0.273SS..Hα-helixtrans-64.7-42.8173.6-74.8-63.3-166.1-161.24.9112.7S158 F236 F237 G238 N244S158-R240 VanDerWaalsContact OG-CZ 3.24Å; S158-R240 PolarHBondContact OG-NE 3.07Å; S158-R240 PolarHBondContact OG-NH2 2.86Å; F236-R240 HydrophobicContact CD1-CG 4.13Å; F236-R240 HydrophobicContact CE1-CG 3.81Å; F236-R240 HydrophobicContact CZ-CG 4.12Å; F236-R240 WeakPolarHBondContact O-CG 3.15Å; F236-R240 PolarHBondContact O-N 3.09Å; F237-R240 PolarHBondContact O-N 3.02Å; G238-R240 VanDerWaalsContact C-N 3.27Å; G238-R240 PolarHBondContact O-N 3.29Å; R240-N244 PolarHBondContact O-N 3.24Å; R240-N244 VanDerWaalsContact O-N 3.12Å; R240-N244 PolarHBondContact O-ND2 3.35Å
241I90.9Very high91.2Very high11 Ų1156.3 Ų56.36%0.05630%0.304CS..Hα-helixtrans-63.7-53.4176.6-64.7169.2000110.3F184 L187 F237 G238 H243 N244 L245F184-I241 HydrophobicContact CD2-CD1 3.81Å; F184-I241 HydrophobicContact CD2-CG1 4.17Å; F184-I241 HydrophobicContact CE2-CD1 4.04Å; F184-I241 HydrophobicContact CE2-CG1 4.03Å; L187-I241 HydrophobicContact CD2-CD1 4.1Å; F237-I241 HydrophobicContact CD1-CD1 4.2Å; F237-I241 HydrophobicContact CD2-CD1 4.42Å; F237-I241 HydrophobicContact CE1-CD1 3.73Å; F237-I241 HydrophobicContact CE2-CD1 3.99Å; F237-I241 HydrophobicContact CZ-CD1 3.62Å; F237-I241 PolarHBondContact O-N 3.17Å; F237-I241 VanDerWaalsContact O-N 3.12Å; G238-I241 PolarHBondContact O-N 3.47Å; G238-I241 VanDerWaalsContact O-N 3.15Å; I241-H243 VanDerWaalsContact C-N 3.28Å; I241-H243 PolarHBondContact O-N 2.82Å; I241-N244 PolarHBondContact O-N 2.9Å; I241-N244 VanDerWaalsContact O-N 3.12Å; I241-L245 HydrophobicContact CG2-CD1 3.92Å; I241-L245 HydrophobicContact CG2-CG 4.41Å; I241-L245 WeakPolarHBondContact O-CG 3.43Å; I241-L245 PolarHBondContact O-N 3.38Å
242M93.4Very high91.4Very high27 Ų2756 Ų5613%0.13330%0.303CS..Hα-helixtrans-58.9-39.4-179.8-63.7-51.9-56.700111.9G238 L245 T246 F253 F256 H257 R260G238-M242 WeakPolarHBondContact O-CG 3.13Å; G238-M242 PolarHBondContact O-N 3.31Å; M242-L245 PolarHBondContact O-N 2.9Å; M242-L245 HydrophobicContact SD-CD1 4.3Å; M242-T246 PolarHBondContact O-N 2.95Å; M242-T246 PolarHBondContact O-OG1 3Å; M242-T246 VanDerWaalsContact O-OG1 3.05Å; M242-F253 HydrophobicContact CE-CD2 3.95Å; M242-F253 HydrophobicContact CE-CE1 4.29Å; M242-F253 HydrophobicContact CE-CE2 3.47Å; M242-F253 VanDerWaalsContact CE-CE2 3.47Å; M242-F253 HydrophobicContact CE-CZ 3.66Å; M242-F256 HydrophobicContact SD-CB 4.48Å; M242-H257 HydrophobicContact CE-CB 3.72Å; M242-R260 HydrophobicContact CG-CG 4.44Å; M242-R260 HydrophobicContact SD-CB 4.19Å; M242-R260 HydrophobicContact SD-CG 4.46Å
243H92.5Very high91.7Very high95 Ų9555 Ų5544%0.4430%0.295SS..Hα-helixtrans-62.5-42.8175.5176-90.4000113A239 I241 T246 L247A239-H243 WeakPolarHBondContact O-CB 3.41Å; A239-H243 PolarHBondContact O-N 3.4Å; I241-H243 VanDerWaalsContact C-N 3.28Å; I241-H243 PolarHBondContact O-N 2.82Å; H243-T246 PolarHBondContact O-N 2.85Å; H243-L247 WeakPolarHBondContact CE1-CD1 3.39Å; H243-L247 WeakPolarHBondContact O-CG 3.37Å; H243-L247 PolarHBondContact O-N 2.89Å
244N92.2Very high92.2Very high15 Ų1552.3 Ų52.38%0.0830%0.301CS..Hα-helixtrans-64.8-42.8175.1-82.7-95.7000111.5V151 S155 R240 I241 T246 L247 N248V151-N244 HydrophobicContact CB-CB 4.29Å; V151-N244 HydrophobicContact CG1-CB 3.83Å; V151-N244 HydrophobicContact CG2-CB 3.91Å; S155-N244 PolarHBondContact OG-ND2 2.81Å; S155-N244 PolarHBondContact OG-OD1 3.09Å; R240-N244 PolarHBondContact O-N 3.24Å; R240-N244 VanDerWaalsContact O-N 3.12Å; R240-N244 PolarHBondContact O-ND2 3.35Å; I241-N244 PolarHBondContact O-N 2.9Å; I241-N244 VanDerWaalsContact O-N 3.12Å; N244-T246 VanDerWaalsContact C-N 3.29Å; N244-T246 PolarHBondContact O-N 2.65Å; N244-L247 PolarHBondContact O-N 3.09Å; N244-N248 WeakPolarHBondContact O-CB 3.13Å; N244-N248 PolarHBondContact O-N 3.2Å
245L93.4Very high92.4Very high0 Ų052.9 Ų52.90%031%0.306CS..Hα-helixtrans-60.7-38.4176.4-66.2171.1000111.8D147 V151 I241 M242 N249 A250 F253 F256D147-L245 HydrophobicContact CB-CD2 3.95Å; V151-L245 HydrophobicContact CG2-CD2 3.92Å; V151-L245 HydrophobicContact CG2-CG 4.25Å; I241-L245 HydrophobicContact CG2-CD1 3.92Å; I241-L245 HydrophobicContact CG2-CG 4.41Å; I241-L245 WeakPolarHBondContact O-CG 3.43Å; I241-L245 PolarHBondContact O-N 3.38Å; M242-L245 PolarHBondContact O-N 2.9Å; M242-L245 HydrophobicContact SD-CD1 4.3Å; L245-N249 PolarHBondContact O-N 3.1Å; L245-A250 HydrophobicContact CB-CB 3.86Å; L245-A250 HydrophobicContact CD2-CB 3.73Å; L245-A250 HydrophobicContact CG-CB 4.4Å; L245-A250 VanDerWaalsContact O-CB 3.25Å; L245-A250 WeakPolarHBondContact O-CB 3.24Å; L245-A250 PolarHBondContact O-N 2.97Å; L245-F253 HydrophobicContact CB-CD2 4Å; L245-F256 HydrophobicContact CD1-CB 3.61Å; L245-F256 HydrophobicContact CD1-CD1 4.13Å; L245-F256 HydrophobicContact CD1-CD2 3.58Å; L245-F256 HydrophobicContact CD1-CE2 4.29Å; L245-F256 HydrophobicContact CD1-CG 3.5Å; L245-F256 HydrophobicContact CD2-CD2 4Å; L245-F256 HydrophobicContact CD2-CE2 4.12Å; L245-F256 HydrophobicContact CG-CD2 4.47Å
246T93.7Very high92.6Very high86 Ų8650.5 Ų50.553%0.52829%0.289SS..Hα-helixtrans-63.1-48.6171.6-56.30000112.1M242 H243 N244 N248 N249 F253M242-T246 PolarHBondContact O-N 2.95Å; M242-T246 PolarHBondContact O-OG1 3Å; M242-T246 VanDerWaalsContact O-OG1 3.05Å; H243-T246 PolarHBondContact O-N 2.85Å; N244-T246 VanDerWaalsContact C-N 3.29Å; N244-T246 PolarHBondContact O-N 2.65Å; T246-N248 VanDerWaalsContact C-N 3.33Å; T246-N248 PolarHBondContact O-N 3.32Å; T246-N249 PolarHBondContact O-N 3.15Å; T246-N249 VanDerWaalsContact O-N 3.11Å; T246-F253 VanDerWaalsContact OG1-CE2 3.23Å; T246-F253 WeakPolarHBondContact OG1-CE2 3.49Å
247L91.8Very high93Very high122 Ų12251.6 Ų51.664%0.63930%0.295SS*.Hα-helixtrans-65.2-35.8-179-73.1-175.6000113H243 N244 N249H243-L247 WeakPolarHBondContact CE1-CD1 3.39Å; H243-L247 WeakPolarHBondContact O-CG 3.37Å; H243-L247 PolarHBondContact O-N 2.89Å; N244-L247 PolarHBondContact O-N 3.09Å; L247-N249 PolarHBondContact O-N 3.4Å
248N91.6Very high93.4Very high74 Ų7452.3 Ų52.340%0.39630%0.299SS..THydrogen-bonded Turntrans-76.4-4.3176-70.5-9.6000113.1C150 N244 T246 A250C150-N248 PolarHBondContact O-ND2 3.37Å; N244-N248 WeakPolarHBondContact O-CB 3.13Å; N244-N248 PolarHBondContact O-N 3.2Å; T246-N248 VanDerWaalsContact C-N 3.33Å; T246-N248 PolarHBondContact O-N 3.32Å; N248-A250 VanDerWaalsContact C-N 3.28Å; N248-A250 PolarHBondContact O-N 3.44Å
249N92.8Very high93.6Very high145 Ų14552.4 Ų52.478%0.77530%0.299SS*.THydrogen-bonded Turntrans52.147-172.2-165.895.2000111.6L245 T246 L247 S251L245-N249 PolarHBondContact O-N 3.1Å; T246-N249 PolarHBondContact O-N 3.15Å; T246-N249 VanDerWaalsContact O-N 3.11Å; L247-N249 PolarHBondContact O-N 3.4Å; N249-S251 PolarHBondContact O-N 2.96Å
250A94.3Very high93.8Very high9 Ų951 Ų517%0.07428%0.281CS..  trans-57.3125-174.600000112.4D147 L245 N248 S252 F253D147-A250 HydrophobicContact CB-CB 3.82Å; D147-A250 WeakPolarHBondContact OD1-CA 3.4Å; L245-A250 HydrophobicContact CB-CB 3.86Å; L245-A250 HydrophobicContact CD2-CB 3.73Å; L245-A250 HydrophobicContact CG-CB 4.4Å; L245-A250 VanDerWaalsContact O-CB 3.25Å; L245-A250 WeakPolarHBondContact O-CB 3.24Å; L245-A250 PolarHBondContact O-N 2.97Å; N248-A250 VanDerWaalsContact C-N 3.28Å; N248-A250 PolarHBondContact O-N 3.44Å; A250-S252 PolarHBondContact O-N 3.09Å; A250-F253 HydrophobicContact CB-CB 4.46Å; A250-F253 WeakPolarHBondContact O-CB 3.45Å; A250-F253 PolarHBondContact O-N 3.13Å
251S93.4Very high94.2Very high104 Ų10451 Ų5173%0.72729%0.285SS*.THydrogen-bonded Turntrans-61.8-31.6-179.666.10000113.1D147 N249D147-S251 PolarHBondContact OD1-N 2.87Å; D147-S251 PolarHBondContact OD2-N 3.17Å; D147-S251 PolarHBondContact OD2-OG 3.01Å; N249-S251 PolarHBondContact O-N 2.96Å
252S95.5Very high94.4Very high7 Ų750.7 Ų50.75%0.04928%0.283CS..THydrogen-bonded Turntrans-95.310.1-176.864.50000114.3M144 D147 A250 G254 S255 F256M144-S252 WeakPolarHBondContact CA-OG 3.2Å; M144-S252 VanDerWaalsContact CG-CB 3.49Å; D147-S252 WeakPolarHBondContact CB-OG 3.42Å; D147-S252 VanDerWaalsContact OD2-CB 3.3Å; D147-S252 WeakPolarHBondContact OD2-CB 3.39Å; D147-S252 PolarHBondContact OD2-N 3.35Å; D147-S252 PolarHBondContact OD2-OG 2.95Å; A250-S252 PolarHBondContact O-N 3.09Å; S252-G254 PolarHBondContact O-N 2.97Å; S252-G254 VanDerWaalsContact O-N 3.07Å; S252-S255 PolarHBondContact O-N 3.05Å; S252-F256 PolarHBondContact O-N 3.42Å; S252-F256 WeakPolarHBondContact OG-CD2 3.49Å
253F95.8Very high94.5Very high76 Ų7649.7 Ų49.733%0.33328%0.278SS..Hα-helixtrans-47.7-41.7-175.5177.7-88.2000114M242 L245 T246 A250 F256 H257M242-F253 HydrophobicContact CE-CD2 3.95Å; M242-F253 HydrophobicContact CE-CE1 4.29Å; M242-F253 HydrophobicContact CE-CE2 3.47Å; M242-F253 VanDerWaalsContact CE-CE2 3.47Å; M242-F253 HydrophobicContact CE-CZ 3.66Å; L245-F253 HydrophobicContact CB-CD2 4Å; T246-F253 VanDerWaalsContact OG1-CE2 3.23Å; T246-F253 WeakPolarHBondContact OG1-CE2 3.49Å; A250-F253 HydrophobicContact CB-CB 4.46Å; A250-F253 WeakPolarHBondContact O-CB 3.45Å; A250-F253 PolarHBondContact O-N 3.13Å; F253-F256 PolarHBondContact O-N 3.32Å; F253-H257 WeakPolarHBondContact O-CB 3.34Å; F253-H257 PolarHBondContact O-N 3.39Å
254G95.6Very high94.6Very high51 Ų5147.2 Ų47.253%0.52627%0.268SS..Hα-helixtrans-63.9-42.1178.700000113.4S252 H257 L258S252-G254 PolarHBondContact O-N 2.97Å; S252-G254 VanDerWaalsContact O-N 3.07Å; G254-H257 PolarHBondContact O-N 3.11Å; G254-L258 PolarHBondContact O-N 2.95Å
255S95.8Very high94.8Very high25 Ų2547 Ų4718%0.17527%0.267CS..Hα-helixtrans-69.3-38.4176.7-52.70000111.5V140 M144 S252 L258 I259V140-S255 WeakPolarHBondContact CG1-OG 3.41Å; M144-S255 WeakPolarHBondContact SD-CB 3.35Å; S252-S255 PolarHBondContact O-N 3.05Å; S255-L258 WeakPolarHBondContact O-CB 3.4Å; S255-L258 PolarHBondContact O-N 2.9Å; S255-I259 WeakPolarHBondContact O-CG1 3.49Å; S255-I259 PolarHBondContact O-N 2.84Å
256F95.2Very high94.8Very high8 Ų848.1 Ų48.14%0.03527%0.271CS..Hα-helixtrans-63.1-39.8170.9-95.4-59.6000113.1M144 D147 I148 L191 M242 L245 S252 F253 L258 I259 R260M144-F256 HydrophobicContact CB-CD2 4.3Å; M144-F256 HydrophobicContact CB-CE2 3.6Å; M144-F256 HydrophobicContact CB-CZ 3.7Å; M144-F256 HydrophobicContact CG-CD2 3.91Å; M144-F256 HydrophobicContact CG-CE2 3.74Å; M144-F256 HydrophobicContact CG-CG 4.48Å; M144-F256 HydrophobicContact CG-CZ 4.12Å; M144-F256 VanDerWaalsContact O-CE2 3.24Å; M144-F256 WeakPolarHBondContact O-CE2 3.29Å; M144-F256 VanDerWaalsContact O-CZ 3.3Å; M144-F256 WeakPolarHBondContact O-CZ 3.45Å; D147-F256 HydrophobicContact CB-CE2 4.3Å; I148-F256 HydrophobicContact CB-CE1 4.47Å; I148-F256 HydrophobicContact CB-CE2 4.21Å; I148-F256 HydrophobicContact CB-CZ 3.65Å; I148-F256 HydrophobicContact CD1-CE1 3.93Å; I148-F256 HydrophobicContact CD1-CZ 3.96Å; I148-F256 HydrophobicContact CG1-CZ 4.27Å; I148-F256 HydrophobicContact CG2-CZ 4.12Å; L191-F256 HydrophobicContact CD1-CE1 3.66Å; L191-F256 HydrophobicContact CD1-CZ 3.73Å; M242-F256 HydrophobicContact SD-CB 4.48Å; L245-F256 HydrophobicContact CD1-CB 3.61Å; L245-F256 HydrophobicContact CD1-CD1 4.13Å; L245-F256 HydrophobicContact CD1-CD2 3.58Å; L245-F256 HydrophobicContact CD1-CE2 4.29Å; L245-F256 HydrophobicContact CD1-CG 3.5Å; L245-F256 HydrophobicContact CD2-CD2 4Å; L245-F256 HydrophobicContact CD2-CE2 4.12Å; L245-F256 HydrophobicContact CG-CD2 4.47Å; S252-F256 PolarHBondContact O-N 3.42Å; S252-F256 WeakPolarHBondContact OG-CD2 3.49Å; F253-F256 PolarHBondContact O-N 3.32Å; F256-L258 VanDerWaalsContact C-N 3.34Å; F256-I259 PolarHBondContact O-N 3.48Å; F256-R260 WeakPolarHBondContact O-CB 3.47Å; F256-R260 PolarHBondContact O-N 3.42Å
257H95.6Very high94.9Very high83 Ų8344 Ų4438%0.38425%0.246SC..Hα-helixtrans-64.3-40.7176.1-174.544.2000111.6M242 F253 G254 R260 M261M242-H257 HydrophobicContact CE-CB 3.72Å; F253-H257 WeakPolarHBondContact O-CB 3.34Å; F253-H257 PolarHBondContact O-N 3.39Å; G254-H257 PolarHBondContact O-N 3.11Å; H257-R260 PolarHBondContact O-N 2.76Å; H257-M261 WeakPolarHBondContact O-CG 3.44Å; H257-M261 PolarHBondContact O-N 3.29Å
258L96.7Very high94.9Very high24 Ų2439 Ų3913%0.12622%0.22CC..Hα-helixtrans-61.8-47.3173.9173.960.5000112.4L127 I130 A131 A134 G254 S255 F256 R260 M261 L262L127-L258 HydrophobicContact CD2-CD1 4.47Å; I130-L258 HydrophobicContact CB-CD1 4.13Å; I130-L258 HydrophobicContact CG2-CD1 3.74Å; I130-L258 HydrophobicContact CG2-CD2 3.86Å; I130-L258 HydrophobicContact CG2-CG 4.47Å; A131-L258 HydrophobicContact CB-CD1 4.48Å; A131-L258 HydrophobicContact CB-CD2 4.49Å; A131-L258 HydrophobicContact CB-CG 4.24Å; A134-L258 HydrophobicContact CB-CD2 4.03Å; G254-L258 PolarHBondContact O-N 2.95Å; S255-L258 WeakPolarHBondContact O-CB 3.4Å; S255-L258 PolarHBondContact O-N 2.9Å; F256-L258 VanDerWaalsContact C-N 3.34Å; L258-R260 VanDerWaalsContact C-N 3.34Å; L258-R260 PolarHBondContact O-N 3.22Å; L258-M261 HydrophobicContact CD1-CE 4.47Å; L258-M261 PolarHBondContact O-N 3.46Å; L258-L262 PolarHBondContact O-N 3.08Å
259I95.8Very high95Very high5 Ų536.2 Ų36.23%0.02621%0.205CC..Hα-helixtrans-60.4-44.9173.4-67.8170.9000110.1L135 M144 L191 S255 F256 M261 L262 L263L135-I259 HydrophobicContact CD2-CD1 3.68Å; L135-I259 HydrophobicContact CD2-CG1 4.33Å; L135-I259 HydrophobicContact CG-CD1 4.41Å; M144-I259 HydrophobicContact CE-CD1 3.82Å; M144-I259 HydrophobicContact SD-CD1 3.45Å; M144-I259 WeakPolarHBondContact SD-CD1 3.4Å; L191-I259 HydrophobicContact CD2-CD1 4.06Å; S255-I259 WeakPolarHBondContact O-CG1 3.49Å; S255-I259 PolarHBondContact O-N 2.84Å; F256-I259 PolarHBondContact O-N 3.48Å; I259-M261 VanDerWaalsContact C-N 3.34Å; I259-M261 PolarHBondContact O-N 3.05Å; I259-L262 WeakPolarHBondContact O-CB 3.35Å; I259-L262 PolarHBondContact O-N 2.96Å; I259-L262 VanDerWaalsContact O-N 3.13Å; I259-L263 HydrophobicContact CG2-CD1 3.77Å; I259-L263 HydrophobicContact CG2-CG 4.03Å; I259-L263 VanDerWaalsContact O-CG 3.3Å; I259-L263 WeakPolarHBondContact O-CG 3.48Å; I259-L263 PolarHBondContact O-N 3.2Å
260R94.8Very high94.9Very high30 Ų3030.1 Ų30.111%0.11317%0.174CC..Hα-helixtrans-58.7-43.5178.1174.659.6-164.2-173.47.3112W234 M242 F256 H257 L258 L263 D264W234-R260 VanDerWaalsContact NE1-NH1 3.17Å; W234-R260 PolarHBondContact O-NH1 2.82Å; W234-R260 PolarHBondContact O-NH2 2.85Å; M242-R260 HydrophobicContact CG-CG 4.44Å; M242-R260 HydrophobicContact SD-CB 4.19Å; M242-R260 HydrophobicContact SD-CG 4.46Å; F256-R260 WeakPolarHBondContact O-CB 3.47Å; F256-R260 PolarHBondContact O-N 3.42Å; H257-R260 PolarHBondContact O-N 2.76Å; L258-R260 VanDerWaalsContact C-N 3.34Å; L258-R260 PolarHBondContact O-N 3.22Å; R260-L263 PolarHBondContact O-N 2.84Å; R260-D264 IonicContact CZ-OD1 3.88Å; R260-D264 IonicContact CZ-OD2 2.66Å; R260-D264 IonicContact NE-OD1 3.72Å; R260-D264 PolarHBondContact NE-OD1 2.94Å; R260-D264 IonicContact NE-OD2 3.92Å; R260-D264 PolarHBondContact NE-OD2 3.41Å; R260-D264 IonicContact NH1-OD1 2.74Å; R260-D264 PolarHBondContact NH1-OD1 3.45Å; R260-D264 IonicContact NH2-OD1 2.98Å; R260-D264 PolarHBondContact NH2-OD1 2.85Å; R260-D264 IonicContact NH2-OD2 3.65Å; R260-D264 PolarHBondContact NH2-OD2 3.1Å; R260-D264 WeakPolarHBondContact O-CB 3.48Å; R260-D264 PolarHBondContact O-N 3.39Å
261M96.7Very high94.8Very high74 Ų7429.7 Ų29.737%0.36517%0.171SC..Hα-helixtrans-62.4-42.8174.5-71.5-174.3-67.100112.2L127 H257 L258 I259 D264 E265L127-M261 HydrophobicContact CD1-CB 4.26Å; L127-M261 HydrophobicContact CD2-CB 4.17Å; H257-M261 WeakPolarHBondContact O-CG 3.44Å; H257-M261 PolarHBondContact O-N 3.29Å; L258-M261 HydrophobicContact CD1-CE 4.47Å; L258-M261 PolarHBondContact O-N 3.46Å; I259-M261 VanDerWaalsContact C-N 3.34Å; I259-M261 PolarHBondContact O-N 3.05Å; M261-D264 PolarHBondContact O-N 3.11Å; M261-E265 WeakPolarHBondContact O-CB 3.46Å; M261-E265 PolarHBondContact O-N 3.36Å
262L95.9Very high94.7Very high4 Ų425.2 Ų25.22%0.02114%0.139CC..Hα-helixtrans-60.3-47.6177.1179.974.3000112.1F124 L127 A128 A131 V197 L258 I259 E265 Y266F124-L262 HydrophobicContact CD2-CD1 4.05Å; F124-L262 HydrophobicContact CE2-CD1 3.43Å; F124-L262 VanDerWaalsContact CE2-CD1 3.43Å; F124-L262 HydrophobicContact CE2-CG 4.14Å; F124-L262 HydrophobicContact CZ-CD1 4.1Å; L127-L262 HydrophobicContact CB-CD1 3.92Å; A128-L262 HydrophobicContact CB-CD1 3.99Å; A131-L262 HydrophobicContact CB-CD2 3.8Å; V197-L262 HydrophobicContact CG1-CD2 4.14Å; V197-L262 HydrophobicContact CG2-CD2 4Å; L258-L262 PolarHBondContact O-N 3.08Å; I259-L262 WeakPolarHBondContact O-CB 3.35Å; I259-L262 PolarHBondContact O-N 2.96Å; I259-L262 VanDerWaalsContact O-N 3.13Å; L262-E265 PolarHBondContact O-N 2.91Å; L262-Y266 WeakPolarHBondContact O-CB 3.18Å; L262-Y266 PolarHBondContact O-N 3.05Å
263L95.7Very high94.4Very high6 Ų627.1 Ų27.13%0.03115%0.15CC..Hα-helixtrans-67.3-38.8-178.8-60.4174.5000111.6L187 F200 W203 L204 W234 I259 R260 Y266 I267L187-L263 HydrophobicContact CD1-CD1 4.49Å; F200-L263 HydrophobicContact CB-CD2 4.09Å; F200-L263 HydrophobicContact CD1-CD2 3.92Å; F200-L263 HydrophobicContact CG-CD2 4.31Å; W203-L263 HydrophobicContact CZ3-CD1 4.32Å; W203-L263 HydrophobicContact CZ3-CD2 4.27Å; L204-L263 HydrophobicContact CD1-CB 3.98Å; L204-L263 HydrophobicContact CD1-CD2 3.49Å; L204-L263 VanDerWaalsContact CD1-CD2 3.49Å; L204-L263 HydrophobicContact CD1-CG 4.32Å; L204-L263 HydrophobicContact CD2-CD2 4.39Å; L204-L263 HydrophobicContact CG-CD2 3.98Å; W234-L263 HydrophobicContact CH2-CB 4.39Å; W234-L263 HydrophobicContact CH2-CD1 4.32Å; W234-L263 HydrophobicContact CZ2-CB 3.82Å; W234-L263 HydrophobicContact CZ2-CD1 4.4Å; I259-L263 HydrophobicContact CG2-CD1 3.77Å; I259-L263 HydrophobicContact CG2-CG 4.03Å; I259-L263 VanDerWaalsContact O-CG 3.3Å; I259-L263 WeakPolarHBondContact O-CG 3.48Å; I259-L263 PolarHBondContact O-N 3.2Å; R260-L263 PolarHBondContact O-N 2.84Å; L263-Y266 PolarHBondContact O-N 3.41Å; L263-I267 WeakPolarHBondContact O-CG1 3.35Å; L263-I267 PolarHBondContact O-N 3.12Å
264D95.1Very high94.1Very high44 Ų4424.6 Ų24.624%0.23514%0.139CC..Hα-helixtrans-62.5-48.4175.8-74.13.9000111.3W234 R260 M261 Y266 I267 L268W234-D264 PolarHBondContact NE1-OD1 3.44Å; R260-D264 IonicContact CZ-OD1 3.88Å; R260-D264 IonicContact CZ-OD2 2.66Å; R260-D264 IonicContact NE-OD1 3.72Å; R260-D264 PolarHBondContact NE-OD1 2.94Å; R260-D264 IonicContact NE-OD2 3.92Å; R260-D264 PolarHBondContact NE-OD2 3.41Å; R260-D264 IonicContact NH1-OD1 2.74Å; R260-D264 PolarHBondContact NH1-OD1 3.45Å; R260-D264 IonicContact NH2-OD1 2.98Å; R260-D264 PolarHBondContact NH2-OD1 2.85Å; R260-D264 IonicContact NH2-OD2 3.65Å; R260-D264 PolarHBondContact NH2-OD2 3.1Å; R260-D264 WeakPolarHBondContact O-CB 3.48Å; R260-D264 PolarHBondContact O-N 3.39Å; M261-D264 PolarHBondContact O-N 3.11Å; D264-Y266 VanDerWaalsContact C-N 3.33Å; D264-Y266 PolarHBondContact O-N 3.38Å; D264-I267 PolarHBondContact O-N 3Å; D264-L268 VanDerWaalsContact O-CG 3.3Å; D264-L268 WeakPolarHBondContact O-CG 3.42Å; D264-L268 PolarHBondContact O-N 2.82Å
265E94.8Very high93.7Very high10 Ų1023.3 Ų23.35%0.04712%0.119CC..Hα-helixtrans-67.4-35.4-178.8-169.768.5168.800112R120 S123 F124 L127 M261 L262 L268 L269 H627R120-E265 WeakPolarHBondContact CD-OE1 3.33Å; R120-E265 IonicContact CZ-OE2 2.75Å; R120-E265 IonicContact NH1-OE1 2.89Å; R120-E265 IonicContact NH1-OE2 3.31Å; R120-E265 PolarHBondContact NH1-OE2 3.02Å; S123-E265 WeakPolarHBondContact CB-OE1 3.31Å; S123-E265 PolarHBondContact OG-OE1 3.31Å; F124-E265 HydrophobicContact CB-CG 3.92Å; L127-E265 HydrophobicContact CD1-CB 3.73Å; L127-E265 HydrophobicContact CD1-CG 4.02Å; M261-E265 WeakPolarHBondContact O-CB 3.46Å; M261-E265 PolarHBondContact O-N 3.36Å; L262-E265 PolarHBondContact O-N 2.91Å; E265-L268 PolarHBondContact O-N 3.08Å; E265-L269 WeakPolarHBondContact O-CB 3.4Å; E265-L269 PolarHBondContact O-N 3.2Å; E265-H627 VanDerWaalsContact CD-ND1 3.31Å; E265-H627 IonicContact OE1-CE1 2.8Å; E265-H627 PolarHBondContact OE1-CE1 2.93Å; E265-H627 IonicContact OE1-ND1 2.74Å; E265-H627 PolarHBondContact OE1-ND1 3.28Å; E265-H627 IonicContact OE2-CE1 2.89Å; E265-H627 IonicContact OE2-CG 3.12Å; E265-H627 IonicContact OE2-ND1 2.81Å; E265-H627 PolarHBondContact OE2-ND1 2.9Å
266Y95.1Very high93.4Very high24 Ų2423.6 Ų23.69%0.09412%0.119CC..Hα-helixtrans-66.7-43.4173.8-169.5-96.3000112.8F124 I201 L204 D205 L262 L263 D264 L268 L269 A270F124-Y266 HydrophobicContact CD1-CD2 4.43Å; F124-Y266 HydrophobicContact CD2-CD2 4.04Å; F124-Y266 HydrophobicContact CE1-CD2 4.01Å; F124-Y266 AromaticContact CE2-CD2 3.59Å; F124-Y266 HydrophobicContact CE2-CD2 3.59Å; F124-Y266 HydrophobicContact CE2-CG 4.05Å; F124-Y266 HydrophobicContact CG-CD2 4.46Å; F124-Y266 AromaticContact CZ-CD2 3.58Å; F124-Y266 HydrophobicContact CZ-CD2 3.58Å; F124-Y266 HydrophobicContact CZ-CE2 4.36Å; F124-Y266 HydrophobicContact CZ-CG 4.4Å; I201-Y266 HydrophobicContact CB-CE2 4.46Å; I201-Y266 HydrophobicContact CG1-CD2 4.04Å; I201-Y266 HydrophobicContact CG1-CE2 4.02Å; I201-Y266 HydrophobicContact CG1-CG 4.46Å; I201-Y266 HydrophobicContact CG2-CE1 4.17Å; I201-Y266 HydrophobicContact CG2-CE2 3.82Å; L204-Y266 HydrophobicContact CB-CD1 3.72Å; L204-Y266 HydrophobicContact CB-CE1 4.06Å; L204-Y266 HydrophobicContact CD1-CD1 3.68Å; L204-Y266 HydrophobicContact CD1-CG 4.13Å; L204-Y266 HydrophobicContact CG-CD1 4.39Å; D205-Y266 PolarHBondContact OD1-OH 2.92Å; D205-Y266 VanDerWaalsContact OD1-OH 3.13Å; D205-Y266 PolarHBondContact OD2-OH 2.99Å; L262-Y266 WeakPolarHBondContact O-CB 3.18Å; L262-Y266 PolarHBondContact O-N 3.05Å; L263-Y266 PolarHBondContact O-N 3.41Å; D264-Y266 VanDerWaalsContact C-N 3.33Å; D264-Y266 PolarHBondContact O-N 3.38Å; Y266-L268 VanDerWaalsContact C-N 3.3Å; Y266-L268 PolarHBondContact O-N 3.24Å; Y266-L269 HydrophobicContact CD2-CD2 4.38Å; Y266-L269 HydrophobicContact CE2-CD2 4.46Å; Y266-L269 WeakPolarHBondContact O-CB 3.39Å; Y266-L269 PolarHBondContact O-N 3.06Å; Y266-A270 HydrophobicContact CE1-CB 4.13Å; Y266-A270 WeakPolarHBondContact O-CB 3.45Å; Y266-A270 PolarHBondContact O-N 3.42Å
267I94.6Very high93.1Very high0 Ų026.7 Ų26.70%014%0.136CC..Hα-helixtrans-61.4-41.5176.8-78.1163.6000110.9L204 V208 F230 L231 W234 L263 D264 A270 L271L204-I267 HydrophobicContact CD1-CG1 4.2Å; L204-I267 HydrophobicContact CD2-CD1 3.86Å; L204-I267 HydrophobicContact CD2-CG1 4.1Å; V208-I267 HydrophobicContact CG2-CG1 4.18Å; F230-I267 HydrophobicContact CE1-CD1 4.44Å; F230-I267 HydrophobicContact CE1-CG2 3.82Å; F230-I267 HydrophobicContact CZ-CD1 4.48Å; L231-I267 HydrophobicContact CD2-CG2 3.68Å; W234-I267 HydrophobicContact CD2-CD1 3.49Å; W234-I267 VanDerWaalsContact CD2-CD1 3.49Å; W234-I267 HydrophobicContact CE3-CD1 3.96Å; W234-I267 HydrophobicContact CG-CD1 3.99Å; W234-I267 HydrophobicContact CH2-CD1 3.96Å; W234-I267 HydrophobicContact CZ2-CD1 3.5Å; W234-I267 HydrophobicContact CZ3-CD1 4.17Å; L263-I267 WeakPolarHBondContact O-CG1 3.35Å; L263-I267 PolarHBondContact O-N 3.12Å; D264-I267 PolarHBondContact O-N 3Å; I267-A270 PolarHBondContact O-N 3.25Å; I267-L271 HydrophobicContact CG2-CD1 3.86Å; I267-L271 WeakPolarHBondContact O-CB 3.25Å; I267-L271 VanDerWaalsContact O-CG 3.27Å; I267-L271 WeakPolarHBondContact O-CG 3.5Å; I267-L271 PolarHBondContact O-N 2.9Å; I267-L271 VanDerWaalsContact O-N 3.07Å
268L93.3Very high92.7Very high16 Ų1626.1 Ų26.18%0.08414%0.136CC..Hα-helixtrans-64.7-41.1175.5-66170.8000111.3L231 D264 E265 Y266 E272 P629 I632L231-L268 HydrophobicContact CD1-CD2 4.18Å; L231-L268 HydrophobicContact CD2-CD2 3.77Å; D264-L268 VanDerWaalsContact O-CG 3.3Å; D264-L268 WeakPolarHBondContact O-CG 3.42Å; D264-L268 PolarHBondContact O-N 2.82Å; E265-L268 PolarHBondContact O-N 3.08Å; Y266-L268 VanDerWaalsContact C-N 3.3Å; Y266-L268 PolarHBondContact O-N 3.24Å; L268-E272 WeakPolarHBondContact O-CB 3.39Å; L268-E272 PolarHBondContact O-N 3.01Å; L268-P629 HydrophobicContact CD2-CB 3.92Å; L268-I632 HydrophobicContact CB-CD1 3.96Å; L268-I632 HydrophobicContact CD2-CD1 3.74Å; L268-I632 HydrophobicContact CG-CD1 4.41Å
269L92.4Very high92.3Very high15 Ų1528.2 Ų28.28%0.07914%0.143CC..Hα-helixtrans-61.6-47.3174.2174.957.9000112.9R120 Q121 F124 E265 Y266 E272 T273R120-L269 HydrophobicContact CB-CD1 4.42Å; R120-L269 HydrophobicContact CG-CB 3.7Å; R120-L269 HydrophobicContact CG-CD1 3.72Å; R120-L269 HydrophobicContact CG-CG 4.27Å; Q121-L269 HydrophobicContact CG-CD1 3.45Å; Q121-L269 VanDerWaalsContact CG-CD1 3.45Å; Q121-L269 HydrophobicContact CG-CD2 4.2Å; Q121-L269 HydrophobicContact CG-CG 4.49Å; F124-L269 HydrophobicContact CB-CD2 4.03Å; F124-L269 HydrophobicContact CD1-CD2 3.9Å; F124-L269 HydrophobicContact CG-CD2 3.94Å; E265-L269 WeakPolarHBondContact O-CB 3.4Å; E265-L269 PolarHBondContact O-N 3.2Å; Y266-L269 HydrophobicContact CD2-CD2 4.38Å; Y266-L269 HydrophobicContact CE2-CD2 4.46Å; Y266-L269 WeakPolarHBondContact O-CB 3.39Å; Y266-L269 PolarHBondContact O-N 3.06Å; L269-E272 PolarHBondContact O-N 3.46Å; L269-T273 WeakPolarHBondContact O-CB 3.19Å; L269-T273 PolarHBondContact O-N 3.02Å; L269-T273 PolarHBondContact O-OG1 3.04Å
270A91.9Very high91.9Very high17 Ų1729.1 Ų29.114%0.1415%0.148CC..Hα-helixtrans-63.5-43-179.300000111.6Y266 I267 Q274Y266-A270 HydrophobicContact CE1-CB 4.13Å; Y266-A270 WeakPolarHBondContact O-CB 3.45Å; Y266-A270 PolarHBondContact O-N 3.42Å; I267-A270 PolarHBondContact O-N 3.25Å; A270-Q274 WeakPolarHBondContact O-CB 3.36Å; A270-Q274 PolarHBondContact O-N 2.65Å
271L91.6Very high91.7Very high1 Ų132 Ų321%0.00516%0.162CC..Hα-helixtrans-69.4-43.5177.4-68.3171000112.5V208 V212 A227 F230 L231 I267 T273 Q274 F275V208-L271 HydrophobicContact CG1-CD2 3.89Å; V208-L271 HydrophobicContact CG1-CG 4.42Å; V212-L271 HydrophobicContact CB-CD2 4.27Å; V212-L271 HydrophobicContact CG1-CD2 3.91Å; V212-L271 HydrophobicContact CG2-CD2 4.24Å; A227-L271 HydrophobicContact CB-CD1 4.34Å; A227-L271 HydrophobicContact CB-CD2 4.1Å; F230-L271 HydrophobicContact CD1-CD1 4.46Å; L231-L271 HydrophobicContact CD1-CD1 3.92Å; L231-L271 HydrophobicContact CD2-CD1 3.9Å; L231-L271 HydrophobicContact CG-CD1 3.84Å; I267-L271 HydrophobicContact CG2-CD1 3.86Å; I267-L271 WeakPolarHBondContact O-CB 3.25Å; I267-L271 VanDerWaalsContact O-CG 3.27Å; I267-L271 WeakPolarHBondContact O-CG 3.5Å; I267-L271 PolarHBondContact O-N 2.9Å; I267-L271 VanDerWaalsContact O-N 3.07Å; L271-T273 VanDerWaalsContact C-N 3.34Å; L271-T273 PolarHBondContact O-N 3.22Å; L271-Q274 PolarHBondContact O-N 2.58Å; L271-F275 WeakPolarHBondContact O-CD2 3.39Å; L271-F275 WeakPolarHBondContact O-CG 3.35Å; L271-F275 PolarHBondContact O-N 3.02Å
272E91.1Very high91.3Very high10 Ų1033.3 Ų33.35%0.04717%0.171CC..Hα-helixtrans-62.1-42.1174.8-176.6177-12500111.4S116 R120 L268 L269 F275 N276 I632S116-E272 VanDerWaalsContact CB-OE1 3.24Å; S116-E272 WeakPolarHBondContact CB-OE1 3.44Å; S116-E272 PolarHBondContact OG-OE1 2.84Å; R120-E272 WeakPolarHBondContact CB-OE2 3.15Å; R120-E272 WeakPolarHBondContact CG-OE2 3.25Å; R120-E272 IonicContact NE-OE2 3.95Å; L268-E272 WeakPolarHBondContact O-CB 3.39Å; L268-E272 PolarHBondContact O-N 3.01Å; L269-E272 PolarHBondContact O-N 3.46Å; E272-F275 PolarHBondContact O-N 3.14Å; E272-N276 VanDerWaalsContact O-CB 3.29Å; E272-N276 WeakPolarHBondContact O-CB 3.46Å; E272-N276 VanDerWaalsContact O-CG 3.28Å; E272-N276 PolarHBondContact O-N 3.23Å; E272-N276 PolarHBondContact O-ND2 3.4Å; E272-I632 HydrophobicContact CB-CD1 4.25Å; E272-I632 HydrophobicContact CB-CG1 4.37Å; E272-I632 HydrophobicContact CB-CG2 4.1Å
273T89.9Confident91Very high46 Ų4634.2 Ų34.228%0.28218%0.176SC..Hα-helixtrans-62.7-41.4175.2-630000111.5L269 L271 N276 N277L269-T273 WeakPolarHBondContact O-CB 3.19Å; L269-T273 PolarHBondContact O-N 3.02Å; L269-T273 PolarHBondContact O-OG1 3.04Å; L271-T273 VanDerWaalsContact C-N 3.34Å; L271-T273 PolarHBondContact O-N 3.22Å; T273-N276 PolarHBondContact O-N 3.13Å; T273-N277 WeakPolarHBondContact O-CB 3.21Å; T273-N277 VanDerWaalsContact O-CG 3.3Å; T273-N277 PolarHBondContact O-N 2.97Å; T273-N277 PolarHBondContact O-ND2 3.4Å; T273-N277 VanDerWaalsContact O-ND2 3.11Å
274Q88.4Confident90.7Very high23 Ų2337.8 Ų37.811%0.10719%0.192CC..Hα-helixtrans-64.4-45.5177.2-161.3-79.6-61.100111.7I213 A270 L271 N276 N277 D278I213-Q274 HydrophobicContact CD1-CG 3.98Å; I213-Q274 HydrophobicContact CG1-CG 4.33Å; A270-Q274 WeakPolarHBondContact O-CB 3.36Å; A270-Q274 PolarHBondContact O-N 2.65Å; L271-Q274 PolarHBondContact O-N 2.58Å; Q274-N276 PolarHBondContact O-N 2.99Å; Q274-N277 PolarHBondContact O-N 3.45Å; Q274-D278 PolarHBondContact NE2-OD1 3.42Å; Q274-D278 PolarHBondContact NE2-OD2 2.85Å; Q274-D278 PolarHBondContact O-N 3.32Å
275F88.1Confident90.4Very high25 Ų2539.2 Ų39.211%0.1120%0.2CC..Hα-helixtrans-67.5-34.5175.9-59.9-30.1000113.1V223 K224 A227 L271 E272 D278 K279 I632 L633V223-F275 HydrophobicContact CB-CE1 4.33Å; V223-F275 HydrophobicContact CG1-CE1 4.15Å; K224-F275 HydrophobicContact CB-CE1 4.49Å; K224-F275 HydrophobicContact CB-CZ 4.42Å; A227-F275 HydrophobicContact CB-CE2 4.38Å; A227-F275 HydrophobicContact CB-CZ 3.68Å; L271-F275 WeakPolarHBondContact O-CD2 3.39Å; L271-F275 WeakPolarHBondContact O-CG 3.35Å; L271-F275 PolarHBondContact O-N 3.02Å; E272-F275 PolarHBondContact O-N 3.14Å; F275-D278 PolarHBondContact O-N 2.87Å; F275-K279 VanDerWaalsContact O-CG 3.29Å; F275-K279 WeakPolarHBondContact O-CG 3.36Å; F275-K279 PolarHBondContact O-N 3.12Å; F275-I632 HydrophobicContact CD2-CG2 3.68Å; F275-I632 HydrophobicContact CE2-CG2 3.9Å; F275-L633 HydrophobicContact CE2-CD2 3.85Å; F275-L633 HydrophobicContact CZ-CD2 4.28Å
276N88.7Confident90.1Very high31 Ų3140.9 Ų40.917%0.16621%0.209CC..Hα-helixtrans-64.9-41.4173.8-80.2-31.2000111.7R113 E272 T273 Q274 K279 E280R113-N276 WeakPolarHBondContact CB-OD1 3.36Å; R113-N276 VanDerWaalsContact CD-OD1 3.29Å; R113-N276 WeakPolarHBondContact CD-OD1 3.47Å; E272-N276 VanDerWaalsContact O-CB 3.29Å; E272-N276 WeakPolarHBondContact O-CB 3.46Å; E272-N276 VanDerWaalsContact O-CG 3.28Å; E272-N276 PolarHBondContact O-N 3.23Å; E272-N276 PolarHBondContact O-ND2 3.4Å; T273-N276 PolarHBondContact O-N 3.13Å; Q274-N276 PolarHBondContact O-N 2.99Å; N276-K279 PolarHBondContact O-N 3.49Å; N276-E280 WeakPolarHBondContact O-CB 3.47Å; N276-E280 PolarHBondContact O-N 2.97Å
277N88.4Confident89.8Confident73 Ų7342.4 Ų42.439%0.3922%0.218SC..Hα-helixtrans-62.6-40.4173.8-75.3-38.8000112.1T273 Q274 E280 Q281T273-N277 WeakPolarHBondContact O-CB 3.21Å; T273-N277 VanDerWaalsContact O-CG 3.3Å; T273-N277 PolarHBondContact O-N 2.97Å; T273-N277 PolarHBondContact O-ND2 3.4Å; T273-N277 VanDerWaalsContact O-ND2 3.11Å; Q274-N277 PolarHBondContact O-N 3.45Å; N277-E280 PolarHBondContact O-N 2.94Å; N277-Q281 WeakPolarHBondContact O-CB 3.47Å; N277-Q281 PolarHBondContact O-N 3.21Å
278D87.8Confident89.4Confident71 Ų7147 Ų4738%0.3824%0.24SC..Hα-helixtrans-63.1-44.9175.3-73.7-9.4000111.5Q274 F275 E280 Q281 D282Q274-D278 PolarHBondContact NE2-OD1 3.42Å; Q274-D278 PolarHBondContact NE2-OD2 2.85Å; Q274-D278 PolarHBondContact O-N 3.32Å; F275-D278 PolarHBondContact O-N 2.87Å; D278-E280 VanDerWaalsContact C-N 3.31Å; D278-E280 PolarHBondContact O-N 3.37Å; D278-Q281 PolarHBondContact O-N 2.93Å; D278-D282 PolarHBondContact O-N 3.32Å
279K88.6Confident89.2Confident67 Ų6752.1 Ų52.129%0.29126%0.261SS..Hα-helixtrans-68.9-27.5176.8-60.1-75-177.4175.70112.6F275 N276 L283 E635F275-K279 VanDerWaalsContact O-CG 3.29Å; F275-K279 WeakPolarHBondContact O-CG 3.36Å; F275-K279 PolarHBondContact O-N 3.12Å; N276-K279 PolarHBondContact O-N 3.49Å; K279-L283 WeakPolarHBondContact O-CG 3.49Å; K279-L283 PolarHBondContact O-N 3.26Å; K279-E635 IonicContact NZ-OE1 2.65Å; K279-E635 PolarHBondContact NZ-OE1 2.93Å; K279-E635 IonicContact NZ-OE2 2.82Å; K279-E635 PolarHBondContact NZ-OE2 3.41Å
280E87.7Confident88.9Confident24 Ų2453.7 Ų53.711%0.11227%0.267CS..Hα-helixtrans-69.7-43.9169.8-175.3-171.9149.900110.6K59 N276 N277 D278 D282 L283 Q284K59-E280 WeakPolarHBondContact CD-OE2 3.32Å; K59-E280 IonicContact NZ-OE1 2.92Å; K59-E280 PolarHBondContact NZ-OE1 2.96Å; K59-E280 IonicContact NZ-OE2 3.21Å; K59-E280 PolarHBondContact NZ-OE2 2.91Å; N276-E280 WeakPolarHBondContact O-CB 3.47Å; N276-E280 PolarHBondContact O-N 2.97Å; N277-E280 PolarHBondContact O-N 2.94Å; D278-E280 VanDerWaalsContact C-N 3.31Å; D278-E280 PolarHBondContact O-N 3.37Å; E280-D282 VanDerWaalsContact C-N 3.32Å; E280-D282 PolarHBondContact O-N 3.11Å; E280-L283 WeakPolarHBondContact O-CB 3.47Å; E280-L283 PolarHBondContact O-N 3.34Å; E280-L283 VanDerWaalsContact O-N 3.1Å; E280-Q284 WeakPolarHBondContact O-CG 3.48Å; E280-Q284 PolarHBondContact O-N 2.71Å; E280-Q284 PolarHBondContact OE1-NE2 2.71Å
281Q89.1Confident88.5Confident91 Ų9158.1 Ų58.143%0.42529%0.286SS..Hα-helixtrans-61.7-39.8176.7-170.262.66900111.4N277 D278 L283 Q284 N285N277-Q281 WeakPolarHBondContact O-CB 3.47Å; N277-Q281 PolarHBondContact O-N 3.21Å; D278-Q281 PolarHBondContact O-N 2.93Å; Q281-L283 VanDerWaalsContact C-N 3.33Å; Q281-L283 PolarHBondContact O-N 3.42Å; Q281-Q284 PolarHBondContact O-N 2.75Å; Q281-N285 PolarHBondContact NE2-OD1 3.44Å; Q281-N285 VanDerWaalsContact O-CB 3.32Å; Q281-N285 WeakPolarHBondContact O-CB 3.37Å; Q281-N285 PolarHBondContact O-N 3.26Å; Q281-N285 PolarHBondContact O-ND2 3.02Å; Q281-N285 PolarHBondContact O-OD1 3.45Å
282D90.1Very high87.9Confident101 Ų10163.6 Ų63.654%0.5431%0.31SS..Hα-helixtrans-56.9-43.5171.5-80.2-25.4000112.5D278 E280 N285 L286D278-D282 PolarHBondContact O-N 3.32Å; E280-D282 VanDerWaalsContact C-N 3.32Å; E280-D282 PolarHBondContact O-N 3.11Å; D282-N285 PolarHBondContact O-N 3.34Å; D282-L286 WeakPolarHBondContact O-CB 3.48Å; D282-L286 PolarHBondContact O-N 2.92Å
283L89.3Confident87Confident23 Ų2367.4 Ų67.412%0.1233%0.33CS..Hα-helixtrans-67.4-40.9176.4-73.4172000112C51 V52 I110 K279 E280 Q281 L286 L287C51-L283 HydrophobicContact CB-CD2 4.25Å; V52-L283 HydrophobicContact CG2-CB 4.01Å; V52-L283 WeakPolarHBondContact CG2-O 3.44Å; I110-L283 HydrophobicContact CD1-CD1 4.12Å; K279-L283 WeakPolarHBondContact O-CG 3.49Å; K279-L283 PolarHBondContact O-N 3.26Å; E280-L283 WeakPolarHBondContact O-CB 3.47Å; E280-L283 PolarHBondContact O-N 3.34Å; E280-L283 VanDerWaalsContact O-N 3.1Å; Q281-L283 VanDerWaalsContact C-N 3.33Å; Q281-L283 PolarHBondContact O-N 3.42Å; L283-L286 WeakPolarHBondContact O-CB 3.32Å; L283-L286 PolarHBondContact O-N 2.71Å; L283-L287 PolarHBondContact O-N 2.94Å
284Q87.9Confident85.9Confident81 Ų8167.9 Ų67.938%0.37934%0.339SS..Hα-helixtrans-64.4-43174.8-67.7-17622.700111.8E280 Q281 L286 L287 E288E280-Q284 WeakPolarHBondContact O-CG 3.48Å; E280-Q284 PolarHBondContact O-N 2.71Å; E280-Q284 PolarHBondContact OE1-NE2 2.71Å; Q281-Q284 PolarHBondContact O-N 2.75Å; Q284-L286 VanDerWaalsContact C-N 3.27Å; Q284-L286 PolarHBondContact O-N 3.02Å; Q284-L287 PolarHBondContact O-N 3.16Å; Q284-E288 PolarHBondContact O-N 3.26Å
285N90.5Very high84.5Confident75 Ų7571.5 Ų71.540%0.40136%0.359SS..Hα-helixtrans-60.3-38175.2-65.8-17.7000111.3Q281 D282 E288 K289Q281-N285 PolarHBondContact NE2-OD1 3.44Å; Q281-N285 VanDerWaalsContact O-CB 3.32Å; Q281-N285 WeakPolarHBondContact O-CB 3.37Å; Q281-N285 PolarHBondContact O-N 3.26Å; Q281-N285 PolarHBondContact O-ND2 3.02Å; Q281-N285 PolarHBondContact O-OD1 3.45Å; D282-N285 PolarHBondContact O-N 3.34Å; N285-E288 PolarHBondContact O-N 3.47Å; N285-K289 WeakPolarHBondContact O-CB 3.34Å; N285-K289 PolarHBondContact O-N 3.26Å
286L88.4Confident83.1Confident45 Ų4573.1 Ų73.124%0.23638%0.377CS..Hα-helixtrans-67.2-42176.3-174.859.7000112D48 D282 L283 Q284 K289 Y290D48-L286 HydrophobicContact CB-CD2 3.9Å; D282-L286 WeakPolarHBondContact O-CB 3.48Å; D282-L286 PolarHBondContact O-N 2.92Å; L283-L286 WeakPolarHBondContact O-CB 3.32Å; L283-L286 PolarHBondContact O-N 2.71Å; Q284-L286 VanDerWaalsContact C-N 3.27Å; Q284-L286 PolarHBondContact O-N 3.02Å; L286-K289 WeakPolarHBondContact O-CB 3.46Å; L286-K289 PolarHBondContact O-N 3.23Å; L286-Y290 HydrophobicContact CD1-CE1 4.4Å; L286-Y290 HydrophobicContact CD1-CE2 3.97Å; L286-Y290 HydrophobicContact CD2-CE2 4.34Å; L286-Y290 HydrophobicContact CG-CD2 4.45Å; L286-Y290 HydrophobicContact CG-CE2 3.67Å; L286-Y290 WeakPolarHBondContact O-CD2 3.11Å; L286-Y290 PolarHBondContact O-N 3.3Å; L286-Y290 VanDerWaalsContact O-N 3.15Å
287L87.3Confident81.6Confident55 Ų5575.3 Ų75.329%0.28840%0.395SS..Hα-helixtrans-61.9-46.6172.6179.461.7000111.7I49 V52 L283 Q284 K289 Y290 M291I49-L287 HydrophobicContact CG1-CD1 4.29Å; V52-L287 HydrophobicContact CG1-CD2 3.95Å; V52-L287 HydrophobicContact CG2-CB 4.21Å; L283-L287 PolarHBondContact O-N 2.94Å; Q284-L287 PolarHBondContact O-N 3.16Å; L287-K289 VanDerWaalsContact C-N 3.28Å; L287-K289 PolarHBondContact O-N 3.01Å; L287-Y290 PolarHBondContact O-N 3.4Å; L287-M291 HydrophobicContact CG-SD 4.3Å; L287-M291 PolarHBondContact O-N 2.95Å
288E87.8Confident80Confident98 Ų9878 Ų7846%0.45840%0.403SS..Hα-helixtrans-61.7-37.9-179.9-158.2-148.6-163.700111.5Q284 N285 Y290 M291 K292Q284-E288 PolarHBondContact O-N 3.26Å; N285-E288 PolarHBondContact O-N 3.47Å; E288-Y290 PolarHBondContact O-N 3.43Å; E288-M291 PolarHBondContact O-N 3.33Å; E288-K292 HydrophobicContact CG-CD 4.31Å; E288-K292 WeakPolarHBondContact O-CB 3.25Å; E288-K292 WeakPolarHBondContact O-CG 3.37Å; E288-K292 PolarHBondContact O-N 3.41Å; E288-K292 WeakPolarHBondContact OE1-CE 3.26Å; E288-K292 IonicContact OE1-NZ 2.87Å; E288-K292 PolarHBondContact OE1-NZ 2.79Å; E288-K292 WeakPolarHBondContact OE2-CE 3.41Å; E288-K292 IonicContact OE2-NZ 2.88Å; E288-K292 PolarHBondContact OE2-NZ 3.29Å
289K88.9Confident78.5Confident123 Ų12377.5 Ų77.554%0.53541%0.409SS..Hα-helixtrans-60.3-41.5171.9-179-179.4179.61800112.4N285 L286 L287 N293N285-K289 WeakPolarHBondContact O-CB 3.34Å; N285-K289 PolarHBondContact O-N 3.26Å; L286-K289 WeakPolarHBondContact O-CB 3.46Å; L286-K289 PolarHBondContact O-N 3.23Å; L287-K289 VanDerWaalsContact C-N 3.28Å; L287-K289 PolarHBondContact O-N 3.01Å; K289-N293 VanDerWaalsContact O-CB 3.32Å; K289-N293 WeakPolarHBondContact O-CB 3.25Å; K289-N293 PolarHBondContact O-N 3.28Å; K289-N293 PolarHBondContact O-ND2 3.23Å
290Y85.6Confident77Confident48 Ų4877.8 Ų77.819%0.18842%0.423CS..Hα-helixtrans-66.9-40.4174.8-63.2-46.4000112.4I45 D48 L286 L287 E288 N293 A294I45-Y290 HydrophobicContact CB-CE1 4.27Å; I45-Y290 HydrophobicContact CD1-CD1 4.27Å; I45-Y290 HydrophobicContact CD1-CE1 4.1Å; I45-Y290 HydrophobicContact CG1-CD1 4.27Å; I45-Y290 HydrophobicContact CG1-CE1 3.72Å; I45-Y290 HydrophobicContact CG2-CD1 3.87Å; I45-Y290 HydrophobicContact CG2-CD2 3.89Å; I45-Y290 HydrophobicContact CG2-CE1 3.95Å; I45-Y290 HydrophobicContact CG2-CE2 3.96Å; I45-Y290 HydrophobicContact CG2-CG 3.86Å; D48-Y290 HydrophobicContact CB-CE2 3.87Å; D48-Y290 PolarHBondContact OD2-OH 3.32Å; D48-Y290 VanDerWaalsContact OD2-OH 3.05Å; L286-Y290 HydrophobicContact CD1-CE1 4.4Å; L286-Y290 HydrophobicContact CD1-CE2 3.97Å; L286-Y290 HydrophobicContact CD2-CE2 4.34Å; L286-Y290 HydrophobicContact CG-CD2 4.45Å; L286-Y290 HydrophobicContact CG-CE2 3.67Å; L286-Y290 WeakPolarHBondContact O-CD2 3.11Å; L286-Y290 PolarHBondContact O-N 3.3Å; L286-Y290 VanDerWaalsContact O-N 3.15Å; L287-Y290 PolarHBondContact O-N 3.4Å; E288-Y290 PolarHBondContact O-N 3.43Å; Y290-N293 PolarHBondContact O-N 2.96Å; Y290-A294 WeakPolarHBondContact O-CB 3.3Å; Y290-A294 PolarHBondContact O-N 3.03Å
291M82.9Confident75Confident110 Ų11085.7 Ų85.754%0.54246%0.458SS..Hα-helixtrans-64.4-48.9176.8-67.4-178.566.400111.8L287 E288 N293 A294 D295L287-M291 HydrophobicContact CG-SD 4.3Å; L287-M291 PolarHBondContact O-N 2.95Å; E288-M291 PolarHBondContact O-N 3.33Å; M291-N293 VanDerWaalsContact C-N 3.29Å; M291-N293 PolarHBondContact O-N 3.45Å; M291-A294 WeakPolarHBondContact O-CB 3.39Å; M291-A294 PolarHBondContact O-N 3.19Å; M291-D295 PolarHBondContact O-N 3.41Å
292K80.4Confident73.3Confident116 Ų11688.3 Ų88.350%0.50447%0.472SS..Hα-helixtrans-58.1-40.2175.5-74.9172.1174.7169.20112.3E288 A296E288-K292 HydrophobicContact CG-CD 4.31Å; E288-K292 WeakPolarHBondContact O-CB 3.25Å; E288-K292 WeakPolarHBondContact O-CG 3.37Å; E288-K292 PolarHBondContact O-N 3.41Å; E288-K292 WeakPolarHBondContact OE1-CE 3.26Å; E288-K292 IonicContact OE1-NZ 2.87Å; E288-K292 PolarHBondContact OE1-NZ 2.79Å; E288-K292 WeakPolarHBondContact OE2-CE 3.41Å; E288-K292 IonicContact OE2-NZ 2.88Å; E288-K292 PolarHBondContact OE2-NZ 3.29Å; K292-A296 VanDerWaalsContact O-CB 3.31Å; K292-A296 WeakPolarHBondContact O-CB 3.34Å; K292-A296 PolarHBondContact O-N 3.04Å
293N72.1Confident71.3Confident89 Ų8986.7 Ų86.748%0.47647%0.473SS..Hα-helixtrans-68.8-34174.9-73.2-6.3000112.6K289 Y290 M291 S297K289-N293 VanDerWaalsContact O-CB 3.32Å; K289-N293 WeakPolarHBondContact O-CB 3.25Å; K289-N293 PolarHBondContact O-N 3.28Å; K289-N293 PolarHBondContact O-ND2 3.23Å; Y290-N293 PolarHBondContact O-N 2.96Å; M291-N293 VanDerWaalsContact C-N 3.29Å; M291-N293 PolarHBondContact O-N 3.45Å; N293-S297 VanDerWaalsContact O-CB 3.31Å; N293-S297 WeakPolarHBondContact O-CB 3.26Å; N293-S297 PolarHBondContact O-N 3.15Å; N293-S297 PolarHBondContact O-OG 3.45Å
294A65.9Low68.8Low57 Ų5790.7 Ų90.747%0.47150%0.502SS..Hα-helixtrans-69-42.5175.600000111.7Y290 M291 S297 K298Y290-A294 WeakPolarHBondContact O-CB 3.3Å; Y290-A294 PolarHBondContact O-N 3.03Å; M291-A294 WeakPolarHBondContact O-CB 3.39Å; M291-A294 PolarHBondContact O-N 3.19Å; A294-S297 PolarHBondContact O-N 3.28Å; A294-K298 VanDerWaalsContact O-CB 3.32Å; A294-K298 WeakPolarHBondContact O-CB 3.46Å; A294-K298 PolarHBondContact O-N 3.25Å
295D59.8Low66.8Low98 Ų9892.8 Ų92.852%0.52452%0.523SS..Hα-helixtrans-68.6-37.9175-77.1-42.3000112.4M291 S297 K298 A299M291-D295 PolarHBondContact O-N 3.41Å; D295-S297 VanDerWaalsContact C-N 3.34Å; D295-K298 PolarHBondContact O-N 3Å; D295-A299 VanDerWaalsContact O-CB 3.31Å; D295-A299 WeakPolarHBondContact O-CB 3.38Å; D295-A299 PolarHBondContact O-N 2.97Å
296A57.8Low64.5Low59 Ų5994.6 Ų94.649%0.48854%0.541SS..Hα-helixtrans-62.1-40.9170.400000112K292 A299 A300K292-A296 VanDerWaalsContact O-CB 3.31Å; K292-A296 WeakPolarHBondContact O-CB 3.34Å; K292-A296 PolarHBondContact O-N 3.04Å; A296-A299 PolarHBondContact O-N 2.69Å; A296-A300 WeakPolarHBondContact O-CB 3.19Å; A296-A300 PolarHBondContact O-N 3.32Å
297S56.5Low62.6Low78 Ų7897.4 Ų97.455%0.54557%0.565SS.*Hα-helixtrans-65.2-40.7176-57.10000111.5N293 A294 D295 A300 F301N293-S297 VanDerWaalsContact O-CB 3.31Å; N293-S297 WeakPolarHBondContact O-CB 3.26Å; N293-S297 PolarHBondContact O-N 3.15Å; N293-S297 PolarHBondContact O-OG 3.45Å; A294-S297 PolarHBondContact O-N 3.28Å; D295-S297 VanDerWaalsContact C-N 3.34Å; S297-A300 PolarHBondContact O-N 3.27Å; S297-F301 WeakPolarHBondContact O-CB 3.42Å; S297-F301 PolarHBondContact O-N 2.84Å
298K54.9Low60.4Low129 Ų129100.9 Ų100.956%0.56159%0.593SS**Hα-helixtrans-67.4-39.8175.9-173.2179.9177-172.30111.9A294 D295 F301 M302A294-K298 VanDerWaalsContact O-CB 3.32Å; A294-K298 WeakPolarHBondContact O-CB 3.46Å; A294-K298 PolarHBondContact O-N 3.25Å; D295-K298 PolarHBondContact O-N 3Å; K298-F301 PolarHBondContact O-N 3.42Å; K298-M302 WeakPolarHBondContact O-CB 3.45Å; K298-M302 WeakPolarHBondContact O-CG 3.48Å; K298-M302 PolarHBondContact O-N 3.27Å
299A57.6Low58.3Low61 Ų61105.1 Ų105.150%0.50461%0.61SS.*Hα-helixtrans-64.3-42.3173.100000111.6D295 A296 F301 M302 A303D295-A299 VanDerWaalsContact O-CB 3.31Å; D295-A299 WeakPolarHBondContact O-CB 3.38Å; D295-A299 PolarHBondContact O-N 2.97Å; A296-A299 PolarHBondContact O-N 2.69Å; A299-F301 VanDerWaalsContact C-N 3.3Å; A299-F301 PolarHBondContact O-N 2.74Å; A299-M302 CarbonylContact O-C 3.53Å; A299-M302 PolarHBondContact O-N 2.94Å; A299-A303 PolarHBondContact O-N 3.19Å
300A56.5Low56Low72 Ų72107.5 Ų107.560%0.59563%0.627SS**Hα-helixtrans-64.7-31.8173.600000113A296 S297A296-A300 WeakPolarHBondContact O-CB 3.19Å; A296-A300 PolarHBondContact O-N 3.32Å; S297-A300 PolarHBondContact O-N 3.27Å
301F45.8Very low53.5Low191 Ų191109.7 Ų109.784%0.83866%0.656SS**Hα-helixtrans-79.5-24.9175.5-151.5-86.2000113.3S297 K298 A299S297-F301 WeakPolarHBondContact O-CB 3.42Å; S297-F301 PolarHBondContact O-N 2.84Å; K298-F301 PolarHBondContact O-N 3.42Å; A299-F301 VanDerWaalsContact C-N 3.3Å; A299-F301 PolarHBondContact O-N 2.74Å
302M53.6Low51Low146 Ų146111.8 Ų111.872%0.71967%0.669SS**Hα-helixtrans-90.6-10.1173.3-68.5-167.673.500113.5K298 A299 S304K298-M302 WeakPolarHBondContact O-CB 3.45Å; K298-M302 WeakPolarHBondContact O-CG 3.48Å; K298-M302 PolarHBondContact O-N 3.27Å; A299-M302 CarbonylContact O-C 3.53Å; A299-M302 PolarHBondContact O-N 2.94Å; M302-S304 PolarHBondContact O-N 2.95Å; M302-S304 VanDerWaalsContact O-N 3.09Å
303A47.9Very low49.2Very low67 Ų67116.4 Ų116.455%0.55468%0.683SS**SBendtrans-70.698164.900000109A299A299-A303 PolarHBondContact O-N 3.19Å
304S37.6Very low47.4Very low106 Ų106119.2 Ų119.274%0.74170%0.698SS**  trans-50.5127.4-173.9-60.80000113M302 S306M302-S304 PolarHBondContact O-N 2.95Å; M302-S304 VanDerWaalsContact O-N 3.09Å; S304-S306 PolarHBondContact O-N 3.29Å
305P44.3Very low45.9Very low126 Ų126126.3 Ų126.382%0.81872%0.718SS**  trans-67.1108.917726.5-33.4000110.1S307P305-S307 PolarHBondContact O-N 3.17Å
306S43.8Very low44.9Very low112 Ų112128 Ų12878%0.78373%0.732SS**  trans-7585.4-173.356.80000112.9S304S304-S306 PolarHBondContact O-N 3.29Å
307S46.8Very low43.9Very low104 Ų104131.3 Ų131.373%0.72775%0.749SS**  trans58.454.1150.8-168.90000117.7P305 F309P305-S307 PolarHBondContact O-N 3.17Å; S307-F309 PolarHBondContact O-N 3.13Å
308C42Very low42.7Very low129 Ų129132.2 Ų132.287%0.87276%0.761SS**  trans-7745.2168.6-64.60000113.8
309F43.9Very low41.5Very low186 Ų186131.2 Ų131.282%0.81677%0.771SS**  trans-145.793.5177.5-107.4-86000111.7S307S307-F309 PolarHBondContact O-N 3.13Å
310L40.3Very low40.2Very low173 Ų173134.7 Ų134.791%0.90679%0.785SS**  trans-178108.6143.9-104.7171.7000112.2
311A32.9Very low38.8Very low95 Ų95138.1 Ų138.179%0.78579%0.794SS**  trans59.6164.7160.300000117.9
312N31Very low38.1Very low154 Ų154137.9 Ų137.982%0.82480%0.795SS**  cis-141.1156.4-5.7-161.74.4000110.8
313R41.6Very low36.9Very low213 Ų213135.5 Ų135.580%0.80479%0.793SS**  trans-84.8134.8165.3-68.3168.771.2147.9-0.1109.1
314N34.3Very low36Very low147 Ų147138.3 Ų138.379%0.78680%0.803SS**  trans153.6103.8136-79.1-18.4000113.5
315K35.4Very low35.5Very low206 Ų206141.5 Ų141.590%0.89680%0.803SS**  174.6154.2111.7-95.4171.3-178.9179.90111.8
316T39.1Very low34.7Very low133 Ų133140.4 Ų140.482%0.81679%0.79SS**  trans-79.1140172.345.90000111.6
317P35.5Very low33.8Very low130 Ų130143 Ų14384%0.84479%0.79SS**  trans-84136.3158.233.4-29.5000110.5
318A31.1Very low32.9Very low96 Ų96143 Ų14379%0.79379%0.79SS**  trans-106.9159157.900000108.6
319S30.1Very low32.1Very low109 Ų109145.5 Ų145.576%0.76279%0.794SS**  trans-51.3144.7-178.652.70000115.2
320V30.6Very low31.3Very low134 Ų134140.5 Ų140.581%0.81280%0.795SS**  178.2140.4109149.20000110.2
321D27.7Very low30.6Very low144 Ų144135.5 Ų135.577%0.7779%0.785SS**  trans-68.6148.2170.8-64.7-81.4000113
322Q30.8Very low30.4Very low186 Ų186140.8 Ų140.887%0.86979%0.793SS**  179.1148.9112.2-98.9178.122.100115.6
323S28.8Very low30.3Very low96 Ų96137.6 Ų137.667%0.67179%0.788SS**  trans59.798.2142.7-164.90000121.2
324V27.7Very low29.6Very low126 Ų126138.6 Ų138.676%0.76479%0.794SS**  36.6118.7107.9179.20000117.5
325K27.8Very low29.5Very low173 Ų173139.6 Ų139.675%0.75280%0.796SS**  -179.314795.7-141.7-176.6175.2-173.10115.1
326N26.8Very low29.9Very low102 Ų102134.6 Ų134.655%0.54578%0.784SS.*  trans21.7143.8146.5-68.530.4000124.1
327E26.1Very low29.2Very low166 Ų166135.1 Ų135.178%0.77678%0.781SS**  59.2148127.3-63.7171.1135.800120.8
328S26.8Very low28.8Very low105 Ų105133.5 Ų133.573%0.73477%0.773SS**  cis-162161.1-238.20000112.6
329L25.8Very low28.6Very low181 Ų181134.6 Ų134.695%0.94877%0.77SS**  trans25.8113.3136.9-155.781.1000119.1
330G27.5Very low28.5Very low82 Ų82134.9 Ų134.985%0.84576%0.763SS**  trans-177.2119.416500000111.6
331G25.8Very low28.5Very low67 Ų67135.6 Ų135.669%0.69176%0.757SS**  trans-113.9-158.3-173.500000115
332H28Very low28.6Very low207 Ų207135.4 Ų135.496%0.95875%0.752SS**  trans86.6141.4-178.5-61.6-82.1000117.3
333A30.1Very low28.6Very low87 Ų87133 Ų13372%0.71974%0.744SS**  trans-108157-173.500000111.4
334Y25.7Very low28.5Very low234 Ų234134.3 Ų134.392%0.91874%0.744SS**  trans-149.7134.3156.7-107.1-83.2000111.2
335M33Very low28.6Very low167 Ų167134.8 Ų134.882%0.82374%0.742SS**  trans-104.8157.3154.7-91.1-79.4-174.400105.8
336P42.9Very low28.6Very low102 Ų102134 Ų13466%0.66274%0.741SS**  cis-158.7-177.746.743.6-21.5000119.2
337L25.7Very low28.7Very low144 Ų144132.6 Ų132.675%0.75474%0.743SS**  trans69.3135.6138.7-83.6161.2000123.9
338S26.2Very low28.9Very low95 Ų95134 Ų13466%0.66475%0.746SS**  trans73.2144.2147.3-62.60000117.7
339T27.7Very low29Very low120 Ų120133.7 Ų133.774%0.73675%0.75SS**  cis-159.5178.17.8-0.40000108.2
340N27.2Very low29Very low114 Ų114132 Ų13261%0.6175%0.746SS**  cis-160.4172.610.3-148-3.1000111.9
341Q31Very low28.9Very low149 Ų149135.1 Ų135.170%0.69674%0.743SS**  trans60.8144.2144.3-82163.5-19.100120.9
342Q30.3Very low28.9Very low141 Ų141141.2 Ų141.266%0.65975%0.747SS**  cis-170.5131.2-3.8-175.9166.6-24.300113.1
343L30.8Very low28.8Very low135 Ų135139.9 Ų139.971%0.70774%0.741SS**  trans55.8155.2155-60.1172.8000119.7
344D25.2Very low28.6Very low123 Ų123139 Ų13966%0.65874%0.74SS**  cis-152.4175.80.4-134.4-26.1000115.4
345L31.3Very low28.7Very low137 Ų137134.6 Ų134.672%0.71773%0.733SS**  trans-35.6166.1161.3-9454.3000118.7
346E27.2Very low28.5Very low157 Ų157133.6 Ų133.673%0.73473%0.731SS**  cis-164.5153.6-15.8-139-168130.400113.3
347A29.5Very low27.9Very low71 Ų71132 Ų13259%0.58773%0.732SS**  trans50145.7135.900000127.5
348K28.9Very low28.1Very low197 Ų197131.4 Ų131.486%0.85774%0.74SS**  trans87102.1139.8-83.7165.5-176.6164.50123
349A28.9Very low28.1Very low97 Ų97130.2 Ų130.280%0.80274%0.743SS**  trans-33161.1147.900000120.2
350V26.2Very low28Very low145 Ų145134.1 Ų134.188%0.87975%0.75SS**  trans-156.4169.8143.1128.20000110.7
351L26.2Very low28.2Very low149 Ų149134.5 Ų134.578%0.7876%0.757SS**  trans-92.9-179.2-169.7-65.2113.6000115.7
352Y25.3Very low28Very low194 Ų194132.8 Ų132.876%0.76176%0.761SS**  trans110.4124.4140.4-104.6-89.1000120.7
353Q26.5Very low27.8Very low179 Ų179131.6 Ų131.684%0.83677%0.768SS**  trans48.7161.7154.6-80.8168.1-23.800120.7
354G24.7Very low27.6Very low68 Ų68128.9 Ų128.970%0.70177%0.773SS**  cis154.4135.3-12.300000114.9
355N28.9Very low27.8Very low143 Ų143126.4 Ų126.477%0.76578%0.776SS**  trans73.6155.6161.3-135.845.7000121.4
356D29.1Very low27.6Very low146 Ų146128.7 Ų128.778%0.78178%0.784SS**  trans63.5152.6163.6-57.3-48.2000120.8
357G30Very low27.7Very low67 Ų67128.4 Ų128.469%0.69178%0.784SS**  cis149.470.3-10.200000116.8
358S28.4Very low27.5Very low132 Ų132133 Ų13392%0.92380%0.799SS**  trans178.9166.7166.440.40000109.8
359G26.6Very low27.4Very low70 Ų70132.3 Ų132.372%0.72280%0.796SS**  cis157.879.8-2.900000114.5
360F26.3Very low27.3Very low202 Ų202132.9 Ų132.989%0.88679%0.794SS**  trans77.7169.6136.2-123.4-94.5000122.6
361T30.5Very low27.4Very low123 Ų123134.3 Ų134.376%0.75579%0.791SS**  trans78.3151.4-179.975.10000115.2
362S27Very low27.4Very low112 Ų112133.1 Ų133.178%0.78379%0.79SS**  cis179.9170.1-14.2-94.20000106.8
363S27.2Very low27.6Very low116 Ų116129.4 Ų129.481%0.81179%0.792SS**  cis-171.2145.8-18.1172.90000108.6
364G26.6Very low27.8Very low79 Ų79124.2 Ų124.281%0.81479%0.787SS**  trans75.8158164.400000117.8
365G28.4Very low28.5Very low70 Ų70126.7 Ų126.772%0.72279%0.791SS**  cis169152.3-8.400000113.5
366Q28Very low28.5Very low186 Ų186127.3 Ų127.387%0.86979%0.793SS**  trans63.1163.7177.2-64.3-174.9-99.500117.2
367M28.3Very low28.5Very low150 Ų150128.8 Ų128.874%0.73980%0.798SS**  -169.5126.9-51.1-104.6-131.2-75.300106.6
368D26.7Very low29.1Very low169 Ų169131.3 Ų131.390%0.90480%0.8SS**  trans-159.2155.4149.1-128.7-29.9000111.8
369F26.8Very low29.4Very low182 Ų182130.7 Ų130.780%0.79879%0.792SS**  trans-131.1129-170.5-110.5-90.4000111.5
370S25.1Very low29.9Very low108 Ų108133.7 Ų133.776%0.75580%0.799SS**  trans-174116.3131.9-87.70000115.6
371Q29.6Very low30.3Very low175 Ų175131.7 Ų131.782%0.81880%0.796SS**  trans79.9126.9135.7-65.5-162.110.400123.5
372V25.6Very low30.4Very low125 Ų125131 Ų13176%0.75880%0.796SS**  trans95124.7147170.60000119.9
373S28.8Very low30.8Very low115 Ų115131.8 Ų131.880%0.80480%0.799SS**  trans74129.8167.9-63.30000119.8
374G32Very low30.8Very low71 Ų71130.9 Ų130.973%0.73280%0.799SS**  trans-90.3-159.416500000112.1
375P38.8Very low30.9Very low120 Ų120134.3 Ų134.378%0.77980%0.804SS**  cis-144-15233.731.6-4.6000115.1
376L29.9Very low31Very low155 Ų155137.6 Ų137.681%0.81280%0.804SS**  trans81123.4170.9-81.976.8000120.1
377M28.9Very low31.1Very low178 Ų178136.1 Ų136.188%0.87781%0.807SS**  -157.9169125.8-101.2-54.7164.600111.8
378T42.6Very low30.9Very low120 Ų120136 Ų13674%0.73680%0.804SS**  trans-68156.8-165.8530000118.8
379P33.1Very low31.1Very low118 Ų118140 Ų14077%0.76681%0.807SS**  trans-10016615137-29.9000113.8
380P38.8Very low31.1Very low133 Ų133134.6 Ų134.686%0.86480%0.803SS**  trans-104.8-172.1-163.941.3-37.5000116.8
381I33.8Very low31.2Very low160 Ų160134.3 Ų134.382%0.82180%0.801SS**  trans-117.8154.4-169-48.8171.4000112
382S32.5Very low31.1Very low109 Ų109131.7 Ų131.776%0.76280%0.796SS**  trans108.1156.9157.5-49.10000116
383P35.5Very low31.4Very low128 Ų128131.5 Ų131.583%0.83179%0.79SS**  cis-122.31792.541.8-28.6000114.9
384A27.7Very low31.4Very low98 Ų98131.9 Ų131.981%0.8178%0.783SS**  trans-108.9158.2170.400000111.7
385T28.3Very low31.3Very low150 Ų150137 Ų13792%0.9279%0.788SS**  trans-122148.7167.548.90000110.9
386L29.9Very low30.8Very low139 Ų139134.8 Ų134.873%0.72879%0.787SS**  trans-117.8133.3-162.9-179.582.2000111.1H388L386-H388 HydrophobicContact CD2-CB 4.43Å; L386-H388 HydrophobicContact CG-CB 4.31Å
387V29.5Very low31.2Very low155 Ų155134 Ų13494%0.93979%0.791SS**  trans-131134.2157.9-178.40000107.9
388H25.9Very low31.3Very low147 Ų147134.3 Ų134.368%0.68179%0.793SS**  trans-138.7120.3-157.5-160.8-43.9000112.4L386L386-H388 HydrophobicContact CD2-CB 4.43Å; L386-H388 HydrophobicContact CG-CB 4.31Å
389R30.4Very low30.8Very low254 Ų254133.5 Ų133.596%0.95880%0.798SS**  trans-175129.3166.4-106.5173.2179.2175.8-0.5108
390G26.3Very low30.5Very low69 Ų69132 Ų13271%0.71180%0.803SS**  cis-168.3150-7.800000111.7
391S27.8Very low30Very low101 Ų101137.3 Ų137.371%0.70681%0.806SS**  trans-66.1170.9175-154.80000111.1
392V28Very low30.1Very low120 Ų120134.7 Ų134.773%0.72780%0.799SS**  cis-158.2130.245.2-164.40000115
393I30.4Very low29.8Very low121 Ų121137.4 Ų137.462%0.62181%0.805SS**  trans12.6129.4136.5-27.6164.1000117.8
394N29.4Very low29.5Very low124 Ų124137.6 Ų137.666%0.66380%0.803SS**  -171.5133.485.5-89.8-77.3000111.3
395Q30.9Very low29.8Very low179 Ų179138.9 Ų138.984%0.83680%0.804SS**  67.5125.682.9-71-162.879.300116.9
396G28.2Very low29.7Very low73 Ų73136.8 Ų136.875%0.75380%0.795SS**  trans-167130.2169.300000111.4
397P36.8Very low29.7Very low139 Ų139135.6 Ų135.690%0.90380%0.798SS**  trans-97.5-176.8-170.138.5-37.2000115.3
398M31.4Very low29.6Very low184 Ų184133 Ų13391%0.90679%0.787SS**  trans-92163.3-170-95.9-73161.700116.5
399A33Very low29.7Very low103 Ų103130.8 Ų130.885%0.85179%0.788SS**  trans78.3122.116000000119.5
400G25.8Very low29.4Very low85 Ų85124.4 Ų124.488%0.87678%0.781SS**  trans167.594.6169.800000115.2
401R28.9Very low29.4Very low246 Ų246126 Ų12693%0.92878%0.781SS**  trans-88.5161152.3-105.5-175.1174.2-175.3-0.9107.5
402P34.6Very low29.4Very low104 Ų104130.3 Ų130.368%0.67579%0.788SS**  cis-149.4-170.434.844.8-24.7000117.5
403L26.3Very low29.3Very low167 Ų167130.6 Ų130.687%0.87480%0.795SS**  trans73.6148.9158.8-62.7178.9000120.6
404T30.4Very low29.2Very low131 Ų131130.4 Ų130.480%0.80481%0.805SS**  trans-103164.9174.551.80000110.7
405P33.7Very low29.2Very low126 Ų126130.5 Ų130.582%0.81882%0.815SS**  -143.4-167.9100.539-23.4000114.8
406S26.9Very low29.2Very low105 Ų105127.5 Ų127.573%0.73481%0.814SS**  trans-87177.8-161.1-35.80000117
407S29.6Very low29.1Very low114 Ų114130.3 Ų130.380%0.79782%0.82SS**  trans68.5149.8157.338.70000118.5
408S28Very low28.8Very low100 Ų100131.8 Ų131.870%0.69982%0.82SS**  cis-173.5156.3-12.750.20000112
409S27.4Very low28.6Very low102 Ų102128.5 Ų128.571%0.71382%0.815SS**  trans70.3126.1150.2-54.20000121.8
410C24.2Very low28.4Very low119 Ų119128.9 Ų128.980%0.80481%0.812SS**  trans42.4160.8140.9740000121.8
411S26.4Very low28.7Very low103 Ų103132.7 Ų132.772%0.7281%0.811SS**  cis-150.5173.521.9-63.70000114.1
412F26.5Very low28.9Very low192 Ų192126.1 Ų126.184%0.84280%0.802SS**  trans-45.4155.3166.4-65.4-101.9000116.1
413S27.4Very low28.7Very low125 Ų125129.1 Ų129.187%0.87481%0.808SS**  -167.4144.4114-80.30000113
414S28.5Very low29Very low118 Ų118127 Ų12783%0.82580%0.796SS**  trans-112.4146.4174.3-48.30000110.3
415S28.5Very low28.9Very low125 Ų125126.2 Ų126.287%0.87479%0.791SS**  trans-164.8137154.756.80000112.3
416S30.5Very low28.6Very low116 Ų116127.9 Ų127.981%0.81179%0.788SS**  trans-115.6149171.751.90000110.6
417C26.4Very low29.5Very low133 Ų133128.8 Ų128.890%0.89979%0.791SS**  trans-165.2159.7156.845.80000111.5
418L30Very low29.4Very low169 Ų169128 Ų12889%0.88579%0.785SS**  trans-116.7156.8-176.7-70150.6000110
419S27.6Very low30.6Very low115 Ų115128.5 Ų128.580%0.80479%0.787SS**  trans145.599.2131.2-63.30000116
420S29.3Very low30.4Very low112 Ų112129.9 Ų129.978%0.78380%0.795SS**  25.4133.5125.9-49.20000124.8
421L32.2Very low30.8Very low165 Ų165129.7 Ų129.786%0.86480%0.795SS**  101.3154128.5-116.4114.5000123.4
422S33Very low30.6Very low107 Ų107130.6 Ų130.675%0.74880%0.801SS**  trans75.7144.5175.774.30000117.5
423E29.1Very low30.6Very low168 Ų168132.1 Ų132.179%0.78580%0.803SS**  cis-172.2175.7-12.2-116.9-165.1162.800109.8
424I33.3Very low31.7Very low122 Ų122130.9 Ų130.963%0.62679%0.792SS**  cis-165.4172.2-9.8-158.5-178.1000111.5
425T27.7Very low31.4Very low114 Ų114132.5 Ų132.570%0.69979%0.786SS**  trans69.2111.7159.148.20000125.7
426Q29Very low31.4Very low161 Ų161131.9 Ų131.975%0.75278%0.777SS**  17.9149.6112.7-77.7-73-37.100121.4
427P44.1Very low31.4Very low124 Ų124132.4 Ų132.481%0.80577%0.771SS**  -148.2-17763.441.9-21.6000119.4
428S28.2Very low31.4Very low97 Ų97136.3 Ų136.368%0.67877%0.768SS**  trans-111-170173.8700000111.5
429P53.8Low31.8Very low112 Ų112137 Ų13773%0.72777%0.766SS**  cis-151.8-178.549.643.6-22000118.3
430C23.3Very low31.6Very low131 Ų131137.6 Ų137.689%0.88577%0.769SS**  trans153.6163.5135.4-90.40000114.3
431S31.5Very low31.6Very low115 Ų115139.6 Ų139.680%0.80477%0.77SS**  trans-144.9162.6-158.758.70000116.1
432S23.7Very low32.2Very low122 Ų122136.8 Ų136.885%0.85376%0.761SS**  trans-163.2154.8149.7-80.10000112.6
433Y26.1Very low32.1Very low223 Ų223139.7 Ų139.788%0.87576%0.763SS**  trans-116.2-175.2173.4-115.4-120.2000107.8
434P49.4Very low32Very low99 Ų99137.9 Ų137.964%0.64376%0.764SS**  cis-129.5-160.415.637.3-13.1000112.8
435E23.4Very low31.7Very low153 Ų153136.2 Ų136.272%0.71578%0.777SS**  cis-163.8130.217.9-155.6149.1-168.200115.1
436T28.2Very low31.6Very low111 Ų111134.1 Ų134.168%0.68178%0.778SS**  trans60.9149.9149.562.70000123
437L30.2Very low31.5Very low128 Ų128136.7 Ų136.767%0.6779%0.787SS**  cis-165.8159.9-17.7-111.3174000114.2
438Y26.8Very low30.8Very low214 Ų214139.8 Ų139.884%0.83979%0.788SS**  trans72.9158.9153.9-77.5-53.9000123.9
439H38.2Very low31.8Very low184 Ų184140.8 Ų140.885%0.85279%0.792SS**  trans-163.5123.1-158.9-173.54.4000109.6
440C23.8Very low30.8Very low127 Ų127139.7 Ų139.786%0.85879%0.792SS**  trans-168172.2171.6-138.60000115.5
441L28.7Very low31.3Very low155 Ų155138.2 Ų138.281%0.81279%0.79SS**  trans-108.6-173.6165.3-121.682.8000108.8
442P45.2Very low31.3Very low105 Ų105136.6 Ų136.668%0.68279%0.791SS**  cis-140.6174.41.743.3-24.5000118.3
443Q30Very low31.7Very low169 Ų169136.5 Ų136.579%0.7979%0.791SS**  trans54.8145.6138.9-77-166.427.600128
444T27.9Very low31.8Very low130 Ų130129.3 Ų129.380%0.79878%0.784SS**  trans88.6122.9139.340.10000125.7
445G26Very low31.9Very low87 Ų87130.4 Ų130.490%0.89779%0.791SS**  trans86.5137.3148.400000118.6
446G25.8Very low32.5Very low70 Ų70129.5 Ų129.572%0.72280%0.796SS**  cis127.9123.8-13.800000115.3
447F26.6Very low32.6Very low215 Ų215127.7 Ų127.794%0.94379%0.793SS**  trans-167161.7155.5-116.8-77.7000114.3
448F29.3Very low32.7Very low189 Ų189129.7 Ų129.783%0.82980%0.799SS**  trans-119.5-166.8-173.1-107.3-61.7000110.7
449P49.4Very low32.9Very low118 Ų118124.9 Ų124.977%0.76679%0.787SS**  cis-113.4-155.68.940.5-21.9000112.2
450A33Very low32.5Very low88 Ų88125.1 Ų125.173%0.72778%0.782SS**  cis-161.7-169.45.900000108.8
451A33.9Very low32.8Very low101 Ų101126.2 Ų126.284%0.83578%0.775SS**  cis166.6145.5-45.600000108
452G32.3Very low32.7Very low80 Ų80124.4 Ų124.483%0.82577%0.77SS**  cis-119.5-130.6-10.100000110.7
453S30.7Very low32Very low121 Ų121124 Ų12485%0.84678%0.776SS**  cis-145.8142.7-3.356.30000111
454G30Very low33.1Very low72 Ų72122 Ų12274%0.74278%0.777SS**  trans-80.8-148.5178.100000113.9
455P50.7Low32.9Very low122 Ų122127.2 Ų127.279%0.79278%0.783SS**  cis-122-170.913.445.3-32000112.1
456T35.6Very low32.9Very low133 Ų133127.5 Ų127.582%0.81677%0.771SS**  cis-169.3164.9-17.324.50000107.7
457A30.9Very low33.1Very low73 Ų73133.5 Ų133.560%0.60378%0.78SS**  cis177.6153.2-32.600000110.5
458Q31.1Very low33.1Very low171 Ų171129.8 Ų129.880%0.79977%0.774SS**  trans69.7148.1156.7-63.8179.13.600120.3
459N31.5Very low33.1Very low113 Ų113128 Ų12860%0.60477%0.769SS**  cis-170148.5-18.5-107.7-2.9000112
460Y29.4Very low32Very low189 Ų189128.5 Ų128.574%0.74177%0.765SS**  trans52.1155.9141.4-70-45.9000123.1
461Q30.2Very low32.5Very low149 Ų149130.3 Ų130.370%0.69677%0.769SS**  cis-171.7158.2-22.5-156.1175.59.300111.5
462T28.2Very low32.2Very low117 Ų117130.3 Ų130.372%0.71876%0.762SS**  trans55.9126.5150.733.30000124.7
463A29.7Very low32Very low97 Ų97134 Ų13480%0.80276%0.762SS**  trans76.1152.9131.700000120.9
464P54Low31.9Very low127 Ų127134 Ų13483%0.82576%0.758SS**  trans-106.9145.7-157.238.5-32.9000116.6
465R23.5Very low31.9Very low240 Ų240134.4 Ų134.491%0.90675%0.754SS**  trans-161.1139.5157.8-134-179.9177.9160.2-0.6114.5
466S24.7Very low30.9Very low93 Ų93135.7 Ų135.765%0.6575%0.752SS**  trans21.9119.2150.858.50000123.1
467Q30.7Very low30.6Very low196 Ų196137.2 Ų137.292%0.91675%0.75SS**  trans41129134.8-75.6-174.9-32.900123.4
468V27.3Very low30.5Very low136 Ų136138.9 Ų138.982%0.82475%0.753SS**  trans-170.2147.9153.6130.60000108.1
469Q28Very low30.3Very low152 Ų152139.6 Ų139.671%0.7176%0.756SS**  cis-165.6160.1-30.4-146.1-166.8100.200110.5
470N26.7Very low30.1Very low128 Ų128141.5 Ų141.568%0.68477%0.766SS**  trans25.8138.4147.5-73-17.5000122.6
471P44.1Very low31.3Very low126 Ų126137.7 Ų137.782%0.81877%0.765SS**  -139172.87728.1-8.4000115
472C26.2Very low32.4Very low102 Ų102135.6 Ų135.669%0.68976%0.764SS**  cis-170.5146.9-28.8-168.40000108.7
473L29.1Very low32.5Very low156 Ų156138.3 Ų138.382%0.81777%0.773SS**  trans66.7151.8177.2-50.8175000115.3
474T28.8Very low32.3Very low123 Ų123137.4 Ų137.476%0.75577%0.773SS**  cis-151.5144.57.4-18.10000113
475A28.7Very low31.1Very low80 Ų80137 Ų13766%0.66177%0.771SS**  trans58.4126.3140.500000125.1
476I30.3Very low31.3Very low148 Ų148133.2 Ų133.276%0.75976%0.764SS**  trans81.293.3135.4-61.2168.2000120.3
477Q29.7Very low31.6Very low165 Ų165136.1 Ų136.177%0.77177%0.771SS**  49.3136.6115.1-87.7179.5-22.500124.5
478T28.6Very low31.7Very low108 Ų108130.5 Ų130.566%0.66376%0.759SS**  trans90.8127.6134.947.90000124.5
479H27.7Very low31.7Very low187 Ų187135 Ų13587%0.86676%0.761SS**  trans76.6155.8139.6-79.3-63.3000123.7
480N26.9Very low31.7Very low153 Ų153137.4 Ų137.482%0.81877%0.765SS**  trans-86-179.5-163.3-115.43.6000112.8
481P54.3Low32.9Very low109 Ų109137.3 Ų137.371%0.70877%0.771SS**  trans-83.9-162.9-163.941.6-42.7000112.6
482P53.9Low32.2Very low104 Ų104136.1 Ų136.168%0.67577%0.766SS**  cis-149.6-16312.441.7-17.2000118.4
483L29.2Very low32.3Very low175 Ų175139.5 Ų139.592%0.91678%0.776SS**  trans74.8144157-66.4165.2000121.1
484G26.2Very low32.5Very low78 Ų78135.6 Ų135.680%0.80477%0.767SS**  trans153107.2155.500000118.5
485C27.5Very low32.6Very low117 Ų117137 Ų13779%0.79177%0.769SS**  trans-55.9170.7177.7-570000116.5
486H28.3Very low33.5Very low161 Ų161138.4 Ų138.475%0.74577%0.772SS**  -171.8137.965-116.8-87.8000116.3
487L31.5Very low33.6Very low154 Ų154135.5 Ų135.581%0.80677%0.77SS**  trans49.3148.4141.6-10058.8000121.8
488A32.3Very low33.7Very low79 Ų79135.8 Ų135.865%0.65378%0.776SS**  cis-153-164.94.200000108.8
489R27.7Very low33.8Very low230 Ų230135.7 Ų135.787%0.86878%0.78SS**  cis-157.7165.26.2-172.1172.1-74.7-165.4-1.8109.1
490Y28.7Very low33.9Very low203 Ų203134.9 Ų134.980%0.79677%0.774SS**  trans-133.5173.6171.7-111.9-78000111.2
491P51.7Low34.1Very low125 Ų125134.3 Ų134.381%0.81277%0.771SS**  -138.5170107.338.9-27.4000114.7
492S29.4Very low32.9Very low102 Ų102132.1 Ų132.171%0.71377%0.768SS**  trans-141.1167.5-168.2179.60000111.8
493L28Very low31.6Very low172 Ų172137.5 Ų137.590%0.90178%0.781SS**  trans-146.2149.7156.8-151.272.4000110.8
494A33.8Very low31.7Very low75 Ų75139.6 Ų139.662%0.6278%0.778SS**  trans-104.5-164.3-172.600000111.8
495D30.3Very low33.2Very low152 Ų152141.3 Ų141.381%0.81378%0.775SS**  cis-161.8-174.226.5-120.9-21.3000111.2
496P47.4Very low34.3Very low109 Ų109140.8 Ų140.871%0.70877%0.77SS**  trans-143.4178.2-134.844.3-22.9000120.7
497A32.1Very low34.4Very low88 Ų88137.9 Ų137.973%0.72777%0.768SS**  trans76.3163.6140.700000124.6
498L32.5Very low34.4Very low170 Ų170136.3 Ų136.389%0.8977%0.765SS**  trans76.3146.6172.2-64.1159.1000116.5
499S29.6Very low34.2Very low107 Ų107139.8 Ų139.875%0.74877%0.767SS**  cis-177.4166.4-1.2450000109.5
500K31.3Very low34.2Very low170 Ų170136.4 Ų136.474%0.73976%0.761SS**  cis-178.6144.3-12.5162.8-175.7167.6-175.80110.5
501D30.1Very low34.2Very low140 Ų140132.6 Ų132.675%0.74976%0.764SS**  trans53.9163.7165.6-57.7-4.5000119.5
502G28.6Very low33.3Very low63 Ų63132.8 Ų132.865%0.64977%0.768SS**  cis168168.1-8.600000113.8
503F28Very low33.3Very low217 Ų217131.9 Ų131.995%0.95278%0.775SS**  trans82.5158.3169-70-89.5000122.8
504Y29.6Very low33.4Very low220 Ų220129.7 Ų129.786%0.86377%0.774SS**  trans-140.2173.3-178.8-99.3-76.1000107.9
505P57.8Low33.2Very low113 Ų113129.8 Ų129.873%0.73478%0.783SS**  cis-120.1-121.8-10.224.43.2000109.2
506P51.8Low33.2Very low106 Ų106130.2 Ų130.269%0.68879%0.785SS**  cis-141.1-171.5-20.840.5-18.4000117.9
507S30Very low32.1Very low101 Ų101130.4 Ų130.471%0.70679%0.788SS**  trans75.798148.353.10000124.9
508V31Very low32Very low121 Ų121131.8 Ų131.873%0.73379%0.792SS**  36.4118.7129-1430000122.2
509H28.7Very low31.8Very low152 Ų152131.7 Ų131.770%0.70479%0.791SS**  174.9164.7106-98.9-76.3000115.2
510H28.1Very low31.8Very low158 Ų158132.6 Ų132.673%0.73179%0.792SS**  trans-25.6148-178.5-48.7-72.2000120.9
511S29.3Very low31.7Very low124 Ų124129 Ų12987%0.86779%0.785SS**  -173.9159.499.4-76.30000113.6
512S32.8Very low31.7Very low128 Ų128133.1 Ų133.190%0.89579%0.791SS**  trans-97.3153.6172.549.50000111.7
513G28.2Very low31.9Very low83 Ų83133.7 Ų133.786%0.85680%0.797SS**  trans-177.4131.2172.100000113.9
514S31Very low31.9Very low127 Ų127128.1 Ų128.189%0.88879%0.791SS**  trans-97.1149.2168.853.90000110.7
515G29.2Very low32.1Very low77 Ų77121.9 Ų121.979%0.79479%0.785SS**  trans175.113216900000113.5
516D29.6Very low30.9Very low160 Ų160123.2 Ų123.286%0.85679%0.791SS**  trans-82.4-177.9-179.2-65.9-77.6000114.2
517C25.4Very low30.1Very low114 Ų114129 Ų12977%0.7780%0.799SS**  trans107.586.4153.9-60.60000118.6
518S29.7Very low31.3Very low117 Ų117129.1 Ų129.182%0.81880%0.797SS**  39.2123.9111-48.30000120.5
519L27.9Very low32.4Very low167 Ų167128.8 Ų128.887%0.87480%0.798SS**  trans-152.9153.3140.7-114.8161.2000112
520T29.3Very low32.8Very low126 Ų126126.6 Ų126.677%0.77380%0.8SS**  trans-104.5-168-171.645.40000111.1
521V29.4Very low33.1Very low95 Ų95128 Ų12858%0.57680%0.798SS**  -173167.464.21760000110.2
522Y30.1Very low33.2Very low227 Ų227130.3 Ų130.389%0.8979%0.789SS**  trans97.9134.6165.1-61.7-76.6000116
523G32.3Very low33.1Very low75 Ų75129.9 Ų129.977%0.77378%0.782SS**  cis140.7139.9-0.300000110.5
524A29.2Very low34.1Very low99 Ų99132 Ų13282%0.81878%0.78SS**  cis-157.5162.39.100000113.8
525A34.2Very low34Very low90 Ų90129.1 Ų129.174%0.74477%0.771SS**  trans26.4136.7144.200000121.6
526V30.9Very low35.1Very low140 Ų140132 Ų13285%0.84878%0.775SS**  -172.8151.677.8144.20000112
527R36.7Very low35.1Very low227 Ų227132 Ų13286%0.85777%0.77SS**  cis-154.9-92.9-27.9-172.4-174.2-172.8-171.52.7114.5
528P53.7Low36.2Very low104 Ų104132 Ų13268%0.67577%0.769SS**  trans-137.7-161.5-163.550-29.9000114.9
529P55.7Low36.2Very low115 Ų115131.3 Ų131.375%0.74776%0.759SS**  cis-136.6166.2-6.641.1-23.8000119.5
530S36.3Very low36.3Very low106 Ų106131.5 Ų131.574%0.74176%0.756SS**  trans80.6144.7151.4-1560000117
531R33.6Very low36.3Very low187 Ų187131.8 Ų131.871%0.70676%0.758SS**  cis-166.6176.4-16.3-112.1178.2171.6172.4-2.7107.3
532Y31.4Very low36.4Very low172 Ų172135.6 Ų135.668%0.67577%0.769SS**  cis-150.7-160.94.5-137.7-18000111.4
533T30.5Very low37.2Very low120 Ų120130.2 Ų130.274%0.73676%0.762SS**  trans-150.2175.1-178.839.50000109.8
534P50.5Low36.9Very low126 Ų126130 Ų13082%0.81876%0.76SS**  cis-137.3-171.416.243.2-23000117.5
535G29Very low37Very low68 Ų68132.6 Ų132.670%0.70176%0.759SS**  trans-96-146.1172.200000114.1
536P52.7Low36.8Very low136 Ų136134.8 Ų134.888%0.88376%0.758SS**  cis-138.1-153.414.244.6-24.2000116
537E29.7Very low36.9Very low160 Ų160136.6 Ų136.675%0.74876%0.758SS**  trans-61.3168.9-176.6-127.8-170.8-11100117.2
538P46.6Very low36.7Very low114 Ų114134.7 Ų134.774%0.7476%0.758SS**  -158.1157.772.843.1-21.8000121.4
539V30.5Very low35.7Very low103 Ų103134.2 Ų134.262%0.62476%0.764SS**  35.4125.5129.8-174.60000124.8
540Q30.4Very low34.5Very low172 Ų172133.7 Ų133.780%0.80477%0.769SS**  trans23.8142.2142.1-53.1170.3-0.800124.4
541T29.3Very low34.3Very low132 Ų132132.3 Ų132.381%0.8176%0.764SS**  177.9126.2114.124.60000116.2
542E30.5Very low34.2Very low175 Ų175131.7 Ų131.782%0.81877%0.769SS**  51.3167.1126-74.6-61.989.100124.3
543P46.9Very low34.2Very low114 Ų114130.6 Ų130.674%0.7477%0.773SS**  trans-129.7-175.6-13747.6-35.8000117.9
544G26.8Very low34.4Very low71 Ų71131.7 Ų131.773%0.73277%0.774SS**  trans140.1163.7165.400000112.3
545L30.4Very low33.3Very low153 Ų153132.1 Ų132.180%0.80177%0.769SS**  cis-170.9135.9-20.8-174.782.7000106.3
546D29.6Very low33.4Very low135 Ų135132.9 Ų132.972%0.72277%0.769SS**  trans59.7165.7175.3-61.6-30.8000116
547Q33.4Very low32.2Very low178 Ų178130.8 Ų130.883%0.83276%0.763SS**  cis-150.8171.519.4-158152.261.500113
548Q32.3Very low32.1Very low187 Ų187131.4 Ų131.487%0.87477%0.771SS**  trans-89.9153.2-173.3-53.6151.5-62.200113.7
549A32.5Very low31.2Very low95 Ų95129.1 Ų129.179%0.78577%0.769SS**  -179.3138.7128.700000114.2
550A32Very low31.1Very low103 Ų103135 Ų13585%0.85179%0.786SS**  trans43.9147.9142.400000123
551A32.3Very low30.8Very low78 Ų78130.5 Ų130.565%0.64579%0.786SS**  cis-171.2150.1-17.200000111.2
552Q30.6Very low30.7Very low173 Ų173134 Ų13481%0.80879%0.791SS**  trans60134146.6-67.8168.84.500119.7
553I32Very low30.6Very low149 Ų149134.8 Ų134.876%0.76480%0.797SS**  69.7129.654.5-67.5170.1000111.4
554L34Very low29.6Very low144 Ų144132.7 Ų132.775%0.75480%0.796SS**  cis-157.9-177-12.7-102.7176.1000105.9
555D28.3Very low29.7Very low135 Ų135134.2 Ų134.272%0.72280%0.802SS**  cis-160.4-175.810.9-142.1-40.8000111.2
556A30.2Very low29.5Very low83 Ų83130.3 Ų130.369%0.68680%0.798SS**  trans69.4138.3159.900000118.9
557A27.3Very low29.5Very low92 Ų92132.4 Ų132.476%0.7681%0.809SS**  cis79107.32000000116.7
558D27.6Very low29.2Very low173 Ų173131 Ų13193%0.92581%0.807SS**  179.6169.3115.4-124.1-36.2000114.4
559G27.7Very low29.1Very low67 Ų67129.7 Ų129.769%0.69181%0.805SS**  trans89.291.2142.400000120.8
560F28.7Very low28.8Very low226 Ų226130.1 Ų130.199%0.99181%0.808SS**  trans-79.8145.5153.8-97.6-96.4000111.2
561G24.8Very low28.5Very low78 Ų78129.2 Ų129.280%0.80481%0.809SS**  trans-137.8147.9173.400000112
562F27.9Very low28.3Very low205 Ų205129.6 Ų129.690%0.89982%0.821SS**  trans-134124.8-162.4-177.8-80.3000113
563M26.8Very low28Very low191 Ų191124.8 Ų124.894%0.94182%0.817SS**  trans-178.5156.4160.2-105.2173.3178.100109.3
564G26.4Very low27.7Very low70 Ų70123.7 Ų123.772%0.72282%0.822SS**  cis150.348.1-5.100000116.7
565A28Very low27.6Very low104 Ų104126.4 Ų126.486%0.8683%0.831SS**  trans-164.3157.1168.100000111.2
566G26.9Very low27.5Very low71 Ų71123.8 Ų123.873%0.73284%0.836SS**  cis12055.9-7.900000116.3
567L30.5Very low27.4Very low179 Ų179125.7 Ų125.794%0.93784%0.844SS**  trans-141.6166.1171.6-82.2-176.8000113.3
568N27.5Very low27.4Very low149 Ų149125.7 Ų125.780%0.79784%0.844SS**  trans-133.8158.3-162.3-120.2-28.4000112.7
569L28.3Very low27.4Very low158 Ų158128.5 Ų128.583%0.82784%0.843SS**  trans74.5148.7154.9-108.373.2000122.3
570A27.5Very low27.4Very low104 Ų104128.6 Ų128.686%0.8684%0.844SS**  trans65.5145.6163.400000118.6
571G25.9Very low27.4Very low84 Ų84124 Ų12487%0.86683%0.834SS**  cis154.4119.4-8.200000112.9
572G26.7Very low27.6Very low86 Ų86127.8 Ų127.889%0.88784%0.835SS**  trans176.6151.317700000111.7
573G26Very low27.6Very low72 Ų72120.9 Ų120.974%0.74282%0.822SS**  trans-171.4-157.3-178.800000113.6
574C25.5Very low28Very low127 Ų127120.7 Ų120.786%0.85882%0.818SS**  trans92137.2173.3-62.50000119.7
575Q30.5Very low28.2Very low200 Ų200121 Ų12194%0.93582%0.822SS**  trans77.7143.7155.7-67.4179.127.500121.5
576G26.4Very low28.2Very low81 Ų81119.6 Ų119.684%0.83582%0.817SS**  trans138.7108.3161.100000114.9
577S29.1Very low28.3Very low123 Ų123124.9 Ų124.986%0.8682%0.82SS**  trans-152.4130.2169.6177.10000111.1
578A27.8Very low28.3Very low91 Ų91126.8 Ų126.875%0.75282%0.816SS**  trans177.3149.4150.400000114.3
579Y27.5Very low28.2Very low233 Ų233123.3 Ų123.391%0.91482%0.816SS**  trans-34.4164162.5-52.8-93.9000117.8
580G27.9Very low28Very low68 Ų68123.3 Ų123.370%0.70182%0.817SS**  cis-172.7-139.85.700000109.5
581V27.5Very low27.9Very low130 Ų130122.7 Ų122.779%0.78881%0.806SS**  cis-162.5173.2-2.4-165.90000107.8
582L28.6Very low27.9Very low158 Ų158123.3 Ų123.383%0.82780%0.797SS**  trans78.7133.6169.3-51.5172.6000116.9
583G28Very low27.7Very low60 Ų60129 Ų12962%0.61980%0.798SS**  cis105.8136.50.300000113.5
584H35.2Very low27.7Very low186 Ų186133.5 Ų133.586%0.86180%0.804SS**  cis-157.8173.90.8-64.3-90000108.5
585G31.9Very low27.8Very low78 Ų78131.9 Ų131.980%0.80480%0.8SS**  cis142.8116.6-5.500000113.5
586G27.6Very low27.6Very low73 Ų73127.3 Ų127.375%0.75379%0.79SS**  trans174.5158.9178.200000113.9
587F28.8Very low27.6Very low183 Ų183130.5 Ų130.580%0.80378%0.783SS**  cis-156.4132.23.3-130.1-102.4000111.9
588Y30.2Very low27.5Very low218 Ų218134.3 Ų134.386%0.85578%0.779SS**  trans61.2146.4151.1-87.5-117.3000125.1
589G24.9Very low27.5Very low77 Ų77136 Ų13679%0.79478%0.779SS**  trans141.4121.4153.600000115.8
590N24.1Very low27.4Very low158 Ų158132.1 Ų132.185%0.84577%0.774SS**  trans-153.6147.1178.3-167.714.3000115.2
591S26.2Very low27.8Very low90 Ų90134.4 Ų134.463%0.62978%0.777SS**  trans81.4146.6152.279.50000123
592S24.8Very low27.8Very low97 Ų97136.2 Ų136.268%0.67878%0.781SS**  trans83.5126.6154.3-40.80000117.6
593F24.1Very low27.9Very low205 Ų205135.4 Ų135.490%0.89978%0.783SS**  -158.1176.852.8-120.6-85000115.5
594L25.4Very low27.8Very low167 Ų167139.2 Ų139.287%0.87479%0.789SS**  trans-93.1165.3-179.5-87.2166.1000115.1
595A27.9Very low27.5Very low93 Ų93138.5 Ų138.577%0.76979%0.786SS**  trans-86.6167.4-179.100000114.9
596S25.2Very low27.3Very low104 Ų104143.4 Ų143.473%0.72779%0.787SS**  trans-161.8129.3154.9-88.30000114.4
597Q26.1Very low27.4Very low148 Ų148145.2 Ų145.269%0.69278%0.784SS**  trans44137133.3-52.1-174.423.400119.8
598R28.4Very low27.3Very low204 Ų204142 Ų14277%0.7778%0.784SS**  cis-157.3-174.95.2-117.9177.4-77152-4.1106.8
599V28Very low27.1Very low126 Ų126137.1 Ų137.176%0.76478%0.776SS**  cis-148.1-172.823.1-137.80000111
600N24.3Very low27.3Very low152 Ų152140.2 Ų140.281%0.81377%0.773SS**  trans-102.8177.6173.8-90.535.5000111.3
601P37.6Very low27.6Very low115 Ų115138.2 Ų138.275%0.74777%0.772SS**  cis-134-170.810.241.7-23.5000116.4
602L27.8Very low27.7Very low169 Ų169138.3 Ų138.389%0.88577%0.772SS**  trans79.696.2163.5-151.376.7000117
603V28.9Very low27.9Very low141 Ų141141 Ų14186%0.85578%0.784SS**  trans-127.2132.1159.7175.70000107
604D26.8Very low27.9Very low140 Ų140134.1 Ų134.175%0.74977%0.772SS**  trans-83.4161.4-175.5-148-22.6000112.3H606D604-H606 PolarHBondContact O-N 3.3Å; D604-H606 VanDerWaalsContact O-N 3.16Å
605Q29Very low27.9Very low171 Ų171131.1 Ų131.180%0.79976%0.764SS**  trans-78.498.8179.7-74.5-171.9-41.900111.5V607Q605-V607 PolarHBondContact O-N 2.95Å
606H28.4Very low27.9Very low181 Ų181134.4 Ų134.484%0.83877%0.768SS**  trans-67.894.6165.4-84.6-76.5000111D604 S608D604-H606 PolarHBondContact O-N 3.3Å; D604-H606 VanDerWaalsContact O-N 3.16Å; H606-S608 PolarHBondContact O-N 2.86Å
607V28.5Very low28Very low111 Ų111140 Ų14067%0.67377%0.773SS**  trans-78.9109.3170.9-175.90000109.4Q605 V609Q605-V607 PolarHBondContact O-N 2.95Å; V607-V609 VanDerWaalsContact C-N 3.32Å; V607-V609 HydrophobicContact CG1-CG2 3.87Å; V607-V609 PolarHBondContact O-N 3.48Å
608S27.2Very low28Very low115 Ų115138.3 Ų138.380%0.80478%0.775SS**  trans-76.677.3175-61.20000112.4H606H606-S608 PolarHBondContact O-N 2.86Å
609V26.6Very low28.1Very low116 Ų116135.5 Ų135.570%0.70377%0.769SS**  trans-84.7137.3153.4-133.20000106.1V607V607-V609 VanDerWaalsContact C-N 3.32Å; V607-V609 HydrophobicContact CG1-CG2 3.87Å; V607-V609 PolarHBondContact O-N 3.48Å
610I29Very low28.4Very low142 Ų142133.9 Ų133.973%0.72876%0.763SS**  cis-132.9116.723.8-61.2159.1000110.9
611S29.2Very low28.7Very low116 Ų116130.5 Ų130.581%0.81176%0.756SS**  trans-101.883.815846.60000109
612S28.3Very low28.6Very low91 Ų91127.6 Ų127.664%0.63674%0.742SS**  trans-14743.2-174.2-530000114.3G614S612-G614 PolarHBondContact O-N 2.98Å; S612-G614 VanDerWaalsContact O-N 3.08Å
613V28.6Very low28.9Very low153 Ų153122.7 Ų122.793%0.92771%0.712SS**  trans-75.885.2148.7-175.70000106.1S615V613-S615 PolarHBondContact O-N 3.45Å
614G25.1Very low29.4Very low62 Ų62120 Ų12064%0.63970%0.699SS**  trans-61.8132.7-175.300000111.1S612 L616S612-G614 PolarHBondContact O-N 2.98Å; S612-G614 VanDerWaalsContact O-N 3.08Å; G614-L616 PolarHBondContact O-N 3.15Å
615S25.9Very low30.2Very low103 Ų103119.3 Ų119.372%0.7269%0.692SS**  trans-40.1107.6179.7-171.30000112.4V613 R617V613-S615 PolarHBondContact O-N 3.45Å; S615-R617 PolarHBondContact O-N 3.36Å
616L27Very low31.3Very low163 Ų163112 Ų11285%0.85366%0.659SS**PPolyproline II helixtrans-52.4128.4147.7-69.5175.1000105.7G614G614-L616 PolarHBondContact O-N 3.15Å
617R27.8Very low32.4Very low222 Ų222105.4 Ų105.484%0.83863%0.628SS**PPolyproline II helixtrans-58.2132.6179.2-77.8-143.6-73.1173.9-7.5107.8S615 F619S615-R617 PolarHBondContact O-N 3.36Å; R617-F619 PolarHBondContact O-N 3.39Å; R617-F619 VanDerWaalsContact O-N 3.13Å
618P26.3Very low33.9Very low112 Ų112103 Ų10373%0.72761%0.611SS**PPolyproline II helixtrans-51.3126.5163.4-22.733000107.6
619F30.6Very low35.4Very low144 Ų14499.8 Ų99.863%0.63259%0.588SS**PPolyproline II helixtrans-54.5148.1164-77.2-99.4000107.8R617 A621 Y623R617-F619 PolarHBondContact O-N 3.39Å; R617-F619 VanDerWaalsContact O-N 3.13Å; F619-A621 PolarHBondContact O-N 3.42Å; F619-Y623 HydrophobicContact CB-CD1 3.52Å; F619-Y623 HydrophobicContact CB-CE1 4.32Å; F619-Y623 HydrophobicContact CB-CG 3.9Å; F619-Y623 AromaticContact CD1-CD1 3.62Å; F619-Y623 HydrophobicContact CD1-CD1 3.62Å; F619-Y623 HydrophobicContact CD1-CD2 4.42Å; F619-Y623 AromaticContact CD1-CE1 3.63Å; F619-Y623 HydrophobicContact CD1-CE1 3.63Å; F619-Y623 HydrophobicContact CD1-CE2 4.42Å; F619-Y623 HydrophobicContact CD1-CG 4.05Å; F619-Y623 HydrophobicContact CE1-CD1 4.46Å; F619-Y623 HydrophobicContact CE1-CE1 4.03Å; F619-Y623 AromaticContact CG-CD1 3.65Å; F619-Y623 HydrophobicContact CG-CD1 3.65Å; F619-Y623 AromaticContact CG-CE1 3.94Å; F619-Y623 HydrophobicContact CG-CE1 3.94Å; F619-Y623 HydrophobicContact CG-CG 4.29Å
620S33.8Very low36.8Very low92 Ų9299.4 Ų99.464%0.64358%0.581SS**PPolyproline II helixtrans-46.3142.3-178.7-176.90000110.9A622 Y623 S624S620-A622 PolarHBondContact O-N 3Å; S620-Y623 WeakPolarHBondContact O-CA 3.44Å; S620-Y623 WeakPolarHBondContact O-CB 3.25Å; S620-Y623 PolarHBondContact O-N 3.37Å; S620-S624 PolarHBondContact O-N 3.02Å
621A31.1Very low38.4Very low82 Ų8296.2 Ų96.268%0.67857%0.566SS**Hα-helixtrans-53.6-34.7-172.700000113.2F619 Y623 S624 E625F619-A621 PolarHBondContact O-N 3.42Å; A621-Y623 PolarHBondContact O-N 3.05Å; A621-S624 PolarHBondContact O-N 3.24Å; A621-S624 VanDerWaalsContact O-N 3.11Å; A621-E625 PolarHBondContact O-N 3.46Å
622A34.5Very low39.8Very low53 Ų5391.7 Ų91.744%0.43853%0.532SS..Hα-helixtrans-66.3-15.6174.800000115S620 V626S620-A622 PolarHBondContact O-N 3Å; A622-V626 PolarHBondContact O-N 3.17Å
623Y34.4Very low41.2Very low67 Ų6788 Ų8826%0.26351%0.506SS..Hα-helixtrans-81-45.3169.4-159.1-98.1000109.8S123 F619 S620 A621 E625 V626 H627S123-Y623 PolarHBondContact OG-OH 2.89Å; F619-Y623 HydrophobicContact CB-CD1 3.52Å; F619-Y623 HydrophobicContact CB-CE1 4.32Å; F619-Y623 HydrophobicContact CB-CG 3.9Å; F619-Y623 AromaticContact CD1-CD1 3.62Å; F619-Y623 HydrophobicContact CD1-CD1 3.62Å; F619-Y623 HydrophobicContact CD1-CD2 4.42Å; F619-Y623 AromaticContact CD1-CE1 3.63Å; F619-Y623 HydrophobicContact CD1-CE1 3.63Å; F619-Y623 HydrophobicContact CD1-CE2 4.42Å; F619-Y623 HydrophobicContact CD1-CG 4.05Å; F619-Y623 HydrophobicContact CE1-CD1 4.46Å; F619-Y623 HydrophobicContact CE1-CE1 4.03Å; F619-Y623 AromaticContact CG-CD1 3.65Å; F619-Y623 HydrophobicContact CG-CD1 3.65Å; F619-Y623 AromaticContact CG-CE1 3.94Å; F619-Y623 HydrophobicContact CG-CE1 3.94Å; F619-Y623 HydrophobicContact CG-CG 4.29Å; S620-Y623 WeakPolarHBondContact O-CA 3.44Å; S620-Y623 WeakPolarHBondContact O-CB 3.25Å; S620-Y623 PolarHBondContact O-N 3.37Å; A621-Y623 PolarHBondContact O-N 3.05Å; Y623-E625 VanDerWaalsContact C-N 3.29Å; Y623-E625 PolarHBondContact O-N 2.72Å; Y623-V626 WeakPolarHBondContact O-CA 3.03Å; Y623-V626 PolarHBondContact O-N 3.43Å; Y623-H627 AromaticContact CD1-CD2 3.39Å; Y623-H627 WeakPolarHBondContact CD1-CD2 3.37Å; Y623-H627 AromaticContact CD1-NE2 3.37Å; Y623-H627 WeakPolarHBondContact CD1-NE2 3.29Å; Y623-H627 AromaticContact CD2-NE2 3.85Å; Y623-H627 AromaticContact CE1-CD2 3.43Å; Y623-H627 VanDerWaalsContact CE1-CD2 3.43Å; Y623-H627 WeakPolarHBondContact CE1-CD2 3.21Å; Y623-H627 AromaticContact CE1-NE2 3.13Å; Y623-H627 WeakPolarHBondContact CE1-NE2 3.45Å; Y623-H627 AromaticContact CE2-NE2 3.66Å; Y623-H627 AromaticContact CG-NE2 3.71Å; Y623-H627 AromaticContact CZ-NE2 3.27Å; Y623-H627 VanDerWaalsContact CZ-NE2 3.27Å; Y623-H627 PolarHBondContact O-CD2 3.47Å; Y623-H627 PolarHBondContact O-N 2.84Å; Y623-H627 VanDerWaalsContact O-N 3.09Å
624S39.9Very low42.3Very low84 Ų8485.2 Ų85.259%0.58749%0.485SS*.Hα-helixtrans-62.4-35.5176.3-164.90000112.7S620 A621 V626 H627 D628S620-S624 PolarHBondContact O-N 3.02Å; A621-S624 PolarHBondContact O-N 3.24Å; A621-S624 VanDerWaalsContact O-N 3.11Å; S624-V626 VanDerWaalsContact C-N 3.31Å; S624-H627 PolarHBondContact O-N 2.98Å; S624-D628 PolarHBondContact O-N 3.27Å
625E42.9Very low43.1Very low126 Ų12686.2 Ų86.259%0.58947%0.473SS*.Hα-helixtrans-66.4-34.3171-171.1175.5-151.400111.8A621 Y623 N631A621-E625 PolarHBondContact O-N 3.46Å; Y623-E625 VanDerWaalsContact C-N 3.29Å; Y623-E625 PolarHBondContact O-N 2.72Å; E625-N631 PolarHBondContact O-ND2 3.38Å
626V52.2Low43.7Very low17 Ų1785.8 Ų85.810%0.10347%0.468CS..Hα-helixtrans-43.8-65.4162.9178.50000112K119 R120 A622 Y623 S624 D628K119-V626 HydrophobicContact CB-CG1 3.79Å; K119-V626 HydrophobicContact CD-CB 4.3Å; K119-V626 HydrophobicContact CD-CG1 4.23Å; R120-V626 PolarHBondContact NH2-O 3.26Å; A622-V626 PolarHBondContact O-N 3.17Å; Y623-V626 WeakPolarHBondContact O-CA 3.03Å; Y623-V626 PolarHBondContact O-N 3.43Å; S624-V626 VanDerWaalsContact C-N 3.31Å; V626-D628 PolarHBondContact O-N 2.88Å
627H50.8Low44.2Very low42 Ų4281.8 Ų81.819%0.19447%0.466CS..Hα-helixtrans-87.21.6-164.9-53.7-66.8000115.8R120 S123 E265 Y623 S624 P629R120-H627 PolarHBondContact NH1-ND1 3.07Å; R120-H627 VanDerWaalsContact NH1-ND1 3.19Å; S123-H627 PolarHBondContact OG-CE1 2.81Å; E265-H627 VanDerWaalsContact CD-ND1 3.31Å; E265-H627 IonicContact OE1-CE1 2.8Å; E265-H627 PolarHBondContact OE1-CE1 2.93Å; E265-H627 IonicContact OE1-ND1 2.74Å; E265-H627 PolarHBondContact OE1-ND1 3.28Å; E265-H627 IonicContact OE2-CE1 2.89Å; E265-H627 IonicContact OE2-CG 3.12Å; E265-H627 IonicContact OE2-ND1 2.81Å; E265-H627 PolarHBondContact OE2-ND1 2.9Å; Y623-H627 AromaticContact CD1-CD2 3.39Å; Y623-H627 WeakPolarHBondContact CD1-CD2 3.37Å; Y623-H627 AromaticContact CD1-NE2 3.37Å; Y623-H627 WeakPolarHBondContact CD1-NE2 3.29Å; Y623-H627 AromaticContact CD2-NE2 3.85Å; Y623-H627 AromaticContact CE1-CD2 3.43Å; Y623-H627 VanDerWaalsContact CE1-CD2 3.43Å; Y623-H627 WeakPolarHBondContact CE1-CD2 3.21Å; Y623-H627 AromaticContact CE1-NE2 3.13Å; Y623-H627 WeakPolarHBondContact CE1-NE2 3.45Å; Y623-H627 AromaticContact CE2-NE2 3.66Å; Y623-H627 AromaticContact CG-NE2 3.71Å; Y623-H627 AromaticContact CZ-NE2 3.27Å; Y623-H627 VanDerWaalsContact CZ-NE2 3.27Å; Y623-H627 PolarHBondContact O-CD2 3.47Å; Y623-H627 PolarHBondContact O-N 2.84Å; Y623-H627 VanDerWaalsContact O-N 3.09Å; S624-H627 PolarHBondContact O-N 2.98Å; H627-P629 WeakPolarHBondContact O-CD 3.33Å
628D61.3Low44.4Very low61 Ų6181 Ų8133%0.32646%0.463SS..  trans-65.5117176.1-168.9-22.2000110.9S624 V626 L630 N631S624-D628 PolarHBondContact O-N 3.27Å; V626-D628 PolarHBondContact O-N 2.88Å; D628-L630 PolarHBondContact O-N 3.42Å; D628-L630 VanDerWaalsContact O-N 3.15Å; D628-L630 VanDerWaalsContact OD1-CB 3.24Å; D628-L630 WeakPolarHBondContact OD1-CB 3.43Å; D628-L630 WeakPolarHBondContact OD1-CG 3.32Å; D628-L630 PolarHBondContact OD1-N 3.1Å; D628-N631 HydrophobicContact CB-CB 4.46Å; D628-N631 PolarHBondContact O-N 2.94Å; D628-N631 VanDerWaalsContact O-N 3.16Å
629P57.8Low44.7Very low47 Ų4785.2 Ų85.231%0.30547%0.47SS..Hα-helixtrans-59.6-24.6176.625-34.8000112.9L231 L268 H627 L633L231-P629 HydrophobicContact CD1-CB 4.07Å; L268-P629 HydrophobicContact CD2-CB 3.92Å; H627-P629 WeakPolarHBondContact O-CD 3.33Å; P629-L633 VanDerWaalsContact O-CD1 3.28Å; P629-L633 WeakPolarHBondContact O-CD1 3.17Å; P629-L633 VanDerWaalsContact O-CG 3.31Å; P629-L633 WeakPolarHBondContact O-CG 3.4Å
630L56.3Low44.5Very low109 Ų10984.3 Ų84.357%0.57148%0.477SS*.Hα-helixtrans-72.1-29.5179.5-57.2178.9000112.5D628 I632 L633 D634D628-L630 PolarHBondContact O-N 3.42Å; D628-L630 VanDerWaalsContact O-N 3.15Å; D628-L630 VanDerWaalsContact OD1-CB 3.24Å; D628-L630 WeakPolarHBondContact OD1-CB 3.43Å; D628-L630 WeakPolarHBondContact OD1-CG 3.32Å; D628-L630 PolarHBondContact OD1-N 3.1Å; L630-I632 PolarHBondContact O-N 3.36Å; L630-L633 CarbonylContact O-C 3.47Å; L630-L633 WeakPolarHBondContact O-CA 3.3Å; L630-L633 WeakPolarHBondContact O-CB 3.47Å; L630-L633 PolarHBondContact O-N 3.03Å; L630-D634 PolarHBondContact O-N 3.07Å
631N62.1Low44.2Very low74 Ų7485.7 Ų85.740%0.39649%0.486SS..Hα-helixtrans-67.5-35.7178.5-83.1-23.1000112.4E625 D628 L633 D634E625-N631 PolarHBondContact O-ND2 3.38Å; D628-N631 HydrophobicContact CB-CB 4.46Å; D628-N631 PolarHBondContact O-N 2.94Å; D628-N631 VanDerWaalsContact O-N 3.16Å; N631-L633 PolarHBondContact O-N 3.05Å; N631-D634 PolarHBondContact O-N 2.85Å
632I59.8Low43.9Very low21 Ų2185 Ų8511%0.10849%0.487CS..Hα-helixtrans-62.3-25.9170.1-57.8171000110.9L268 E272 F275 L630L268-I632 HydrophobicContact CB-CD1 3.96Å; L268-I632 HydrophobicContact CD2-CD1 3.74Å; L268-I632 HydrophobicContact CG-CD1 4.41Å; E272-I632 HydrophobicContact CB-CD1 4.25Å; E272-I632 HydrophobicContact CB-CG1 4.37Å; E272-I632 HydrophobicContact CB-CG2 4.1Å; F275-I632 HydrophobicContact CD2-CG2 3.68Å; F275-I632 HydrophobicContact CE2-CG2 3.9Å; L630-I632 PolarHBondContact O-N 3.36Å
633L56.7Low43.4Very low15 Ų1587.8 Ų87.88%0.07950%0.503CS..THydrogen-bonded Turntrans-102.73.4-172.3-63.4167.9000113.9K224 A227 Q228 L231 F275 P629 L630 N631K224-L633 VanDerWaalsContact CE-C 3.43Å; K224-L633 WeakPolarHBondContact CE-O 3.38Å; K224-L633 HydrophobicContact CG-CD2 4Å; K224-L633 PolarHBondContact NZ-O 3.15Å; K224-L633 VanDerWaalsContact NZ-O 3.15Å; A227-L633 HydrophobicContact CB-CD2 4.42Å; Q228-L633 HydrophobicContact CB-CD1 4.03Å; Q228-L633 HydrophobicContact CG-CD1 3.71Å; Q228-L633 HydrophobicContact CG-CD2 3.96Å; Q228-L633 HydrophobicContact CG-CG 4.38Å; L231-L633 HydrophobicContact CD1-CD1 4.32Å; F275-L633 HydrophobicContact CE2-CD2 3.85Å; F275-L633 HydrophobicContact CZ-CD2 4.28Å; P629-L633 VanDerWaalsContact O-CD1 3.28Å; P629-L633 WeakPolarHBondContact O-CD1 3.17Å; P629-L633 VanDerWaalsContact O-CG 3.31Å; P629-L633 WeakPolarHBondContact O-CG 3.4Å; L630-L633 CarbonylContact O-C 3.47Å; L630-L633 WeakPolarHBondContact O-CA 3.3Å; L630-L633 WeakPolarHBondContact O-CB 3.47Å; L630-L633 PolarHBondContact O-N 3.03Å; N631-L633 PolarHBondContact O-N 3.05Å
634D52Low43Very low94 Ų9493.8 Ų93.850%0.50353%0.531SS..  trans-89.7162.4176.3-142.6-11.4000111.8K224 L630 N631K224-D634 PolarHBondContact NZ-O 3.27Å; L630-D634 PolarHBondContact O-N 3.07Å; N631-D634 PolarHBondContact O-N 2.85Å
635E42.4Very low42.2Very low83 Ų8399.1 Ų99.139%0.38854%0.544SS..  trans-111.6132.1170.3-74-66.5142.700109.5K224 K279 G637 R638K224-E635 IonicContact NZ-OE1 2.99Å; K224-E635 PolarHBondContact NZ-OE1 3.47Å; K279-E635 IonicContact NZ-OE1 2.65Å; K279-E635 PolarHBondContact NZ-OE1 2.93Å; K279-E635 IonicContact NZ-OE2 2.82Å; K279-E635 PolarHBondContact NZ-OE2 3.41Å; E635-G637 PolarHBondContact O-N 3.09Å; E635-R638 PolarHBondContact O-N 3.05Å
636P37.5Very low41.2Very low93 Ų9398.9 Ų98.960%0.60456%0.556SS**THydrogen-bonded Turntrans-73.571.6-176.331.5-36.2000111.6P109P109-P636 HydrophobicContact CB-CB 4.17Å; P109-P636 HydrophobicContact CB-CG 4.07Å; P109-P636 HydrophobicContact CG-CB 4.44Å
637G38.3Very low39.9Very low79 Ų79107 Ų10781%0.81459%0.593SS**THydrogen-bonded Turntrans177-8-176.500000115.3E635E635-G637 PolarHBondContact O-N 3.09Å
638R32.4Very low38.6Very low207 Ų207109.3 Ų109.378%0.78162%0.619SS**  trans-112.131.5-176.7-142.6-177-166.7-168.33.7115.9E635 T640E635-R638 PolarHBondContact O-N 3.05Å; R638-T640 PolarHBondContact O-N 3.1Å
639K31.7Very low36.8Very low199 Ų199115.1 Ų115.187%0.86564%0.644SS**  trans-67.293.9164.7-72.6-168.1175.2-173.50109.8S641K639-S641 PolarHBondContact O-N 2.78Å
640T26.8Very low35.3Very low126 Ų126119 Ų11977%0.77367%0.672SS**  trans-64.9110.5164.747.50000108.5R638 G642R638-T640 PolarHBondContact O-N 3.1Å; T640-G642 PolarHBondContact O-N 3.05Å
641S27.2Very low33.7Very low121 Ų121116.8 Ų116.885%0.84668%0.676SS**  trans-58.8106.4177.7-610000110.7K639 S643K639-S641 PolarHBondContact O-N 2.78Å; S641-S643 PolarHBondContact O-N 2.65Å
642G24.9Very low32Very low68 Ų68120.8 Ų120.870%0.70170%0.703SS**  trans-65.5103.9170.400000109.2T640 F644T640-G642 PolarHBondContact O-N 3.05Å; G642-F644 PolarHBondContact O-N 3.45Å; G642-F644 VanDerWaalsContact O-N 3.07Å
643S24.8Very low30.3Very low110 Ų110123.4 Ų123.477%0.76974%0.736SS**  trans-62.9108.6178.5-174.60000110.2S641S641-S643 PolarHBondContact O-N 2.65Å
644F25.2Very low28.9Very low193 Ų193131.7 Ų131.785%0.84677%0.773SS**PPolyproline II helixtrans-81.8131.2161.5-95.4-91.7000108.9G642 S646G642-F644 PolarHBondContact O-N 3.45Å; G642-F644 VanDerWaalsContact O-N 3.07Å; F644-S646 PolarHBondContact O-N 3.33Å
645F23.4Very low28.5Very low196 Ų196132.2 Ų132.286%0.8678%0.782SS**PPolyproline II helixtrans-55.9130-178.2-93.8-114.9000111.4
646S22.6Very low27.7Very low121 Ų121136 Ų13685%0.84680%0.804SS**PPolyproline II helixtrans-99.5122.9158.6-63.60000107.8F644F644-S646 PolarHBondContact O-N 3.33Å
647E23.1Very low27.8Very low189 Ų189137 Ų13788%0.88381%0.81SS**  trans-119.2120.1172.7-169168.5-161.100109.3
648A24.3Very low27.1Very low89 Ų89137.7 Ų137.774%0.73681%0.809SS**  trans-128.3158.2165.500000105.8
649E24.6Very low26.8Very low183 Ų183134 Ų13486%0.85581%0.814SS**  cis-142.2166.522.5-54.1169.5114.800111.3
650S24.7Very low26.5Very low128 Ų128127.3 Ų127.390%0.89580%0.802SS**  -172.9144.3122.338.50000110.1
651G23.4Very low26.6Very low63 Ų63127.5 Ų127.565%0.64981%0.809SS**  trans-153.3153.8177.100000112.4
652T26.8Very low26.6Very low158 Ų158125.9 Ų125.997%0.96980%0.803SS**  trans172.8151150.623.60000109.7
653G24.7Very low26.7Very low76 Ų76128.6 Ų128.678%0.78481%0.806SS**  trans113.6106.4161.100000117.4
654H27Very low26.7Very low189 Ų189128.6 Ų128.688%0.87580%0.804SS**  trans-93.7179.4159.3-83.3-65.3000109.4
655P42.3Very low26.8Very low106 Ų106126.5 Ų126.569%0.68880%0.799SS**  -131.3-151.1-91.133.8-9.5000112.5
656L25.9Very low27.1Very low161 Ų161126.3 Ų126.384%0.84380%0.798SS**  trans100.1154.6162-57.6176.6000118.2
657P39Very low27.2Very low114 Ų114123.7 Ų123.774%0.7479%0.791SS**  trans-126.7172.8-146.444-31.8000116.4
658A23.8Very low27.3Very low94 Ų94122.7 Ų122.778%0.77779%0.79SS**  161.5132.1121.400000115.6
659S26.2Very low28.1Very low129 Ų129124.4 Ų124.490%0.90279%0.794SS**  trans42.8132.4137.1-156.10000123.8
660G25.4Very low28.1Very low59 Ų59120.5 Ų120.561%0.60879%0.787SS**  137.7148115.700000121.3
661S29Very low29.1Very low131 Ų131119.3 Ų119.392%0.91678%0.776SS**  trans74.5144.6162.680.80000118.3
662A28.5Very low29.2Very low86 Ų86126 Ų12671%0.71179%0.788SS**  cis-146.7177.6-2.500000110
663T26.7Very low29.2Very low126 Ų126123.1 Ų123.177%0.77377%0.774SS**  cis-161.1151.423.5-18.50000112.1
664C24.5Very low29.2Very low109 Ų109124.1 Ų124.174%0.73677%0.769SS**  trans58.2105.7161.3-58.70000119.3
665M27.9Very low29.2Very low149 Ų149122.9 Ų122.973%0.73476%0.764SS**  67.7133.767.9-62-79.5-8200113.4
666F29.4Very low28.5Very low193 Ų193124.5 Ų124.585%0.84677%0.766SS**  cis-121.5-161.515.2-80.8-90.4000111.8
667G24.1Very low28.5Very low66 Ų66121.8 Ų121.868%0.6877%0.767SS**  cis-169.9-148.214.200000115.6
668L25.8Very low28Very low167 Ų167124.1 Ų124.187%0.87477%0.772SS**  trans-148.5166.2-164.6-86.6171.7000112.6
669P40.1Very low28.2Very low126 Ų126126.5 Ų126.582%0.81878%0.778SS**  cis-133.7-16927.943-24.3000118.1
670S24.8Very low28.2Very low101 Ų101125 Ų12571%0.70677%0.767SS**  trans-102.4-160.4-172.862.20000112.3
671P46.2Very low28.3Very low103 Ų103129.2 Ų129.267%0.66978%0.775SS**  cis-138.6-177.1-4.643.5-26.2000116.2
672F25.5Very low28.3Very low204 Ų204131.9 Ų131.990%0.89577%0.773SS**  trans-168.4165.4130.5-109.1-70.1000112.7
673S25.6Very low28.1Very low96 Ų96139.7 Ų139.767%0.67178%0.784SS**  trans-88.6-179.7-179.261.70000112.2
674S25.7Very low27.9Very low98 Ų98137.3 Ų137.369%0.68579%0.785SS**  cis-151.3143.222.6-510000109.1
675Q27.5Very low28Very low163 Ų163137 Ų13776%0.76279%0.79SS**  75.3122.773.6-145.9-167.2-31.900116.2
676D26.5Very low28Very low139 Ų139134.9 Ų134.974%0.74380%0.796SS**  trans52.8118.5161.4-58.6-27.2000122.8
677A26.4Very low27.8Very low104 Ų104131.1 Ų131.186%0.8679%0.794SS**  -171.3140.3109.600000112.9
678L29.2Very low28Very low163 Ų163132.9 Ų132.985%0.85380%0.795SS**  trans-95.4140.7165.4-72.4160.5000109.5
679T26.3Very low28Very low144 Ų144134.1 Ų134.188%0.88380%0.797SS**  -179.1152.9123.524.20000115.5
680S26.2Very low27.5Very low98 Ų98134.2 Ų134.269%0.68580%0.795SS**  trans-39.4165.7174.455.10000122.5
681L27.6Very low27.7Very low147 Ų147138.1 Ų138.177%0.7780%0.802SS**  trans97.884.3139.2-118.675.1000120.3
682Q28.8Very low26.8Very low187 Ų187140 Ų14087%0.87481%0.806SS**  44.1103.4114.5-163.1174.36.500118.8
683R24.6Very low27Very low251 Ų251138 Ų13895%0.94780%0.804SS**  trans-154.7146.2162-164.9-175.3-62.3179.71.2107.2
684G23.9Very low27.1Very low76 Ų76139.6 Ų139.678%0.78481%0.809SS**  cis-163.8-153.8-3.400000109.7
685A26.6Very low27.2Very low102 Ų102140.4 Ų140.484%0.84382%0.815SS**  trans-123.5165.6-17900000113
686A27.1Very low27.2Very low104 Ų104137.8 Ų137.886%0.8682%0.815SS**  trans84.7153.9162.100000120.5
687S25.6Very low27.3Very low115 Ų115139 Ų13980%0.80482%0.821SS**  trans87.695.4160.5-157.50000120.4
688S28.1Very low27.5Very low102 Ų102139.2 Ų139.271%0.71381%0.813SS**  38.2123.6121.6179.90000120.6
689E25.6Very low27.6Very low193 Ų193137.6 Ų137.690%0.90281%0.812SS**  -155150.7118.3-115.7165.3-157.800111.6
690V30.3Very low27.8Very low128 Ų128139 Ų13978%0.77681%0.812SS**  trans-113.5140.8176.4172.30000107.8
691Q28.5Very low27.9Very low183 Ų183141 Ų14186%0.85582%0.816SS**  trans-136.3102.6179.5-166.8158.143.200111.8
692D28Very low28.1Very low143 Ų143140 Ų14077%0.76582%0.816SS**  trans-64.1143.8171.5-71.1-61.4000111.8
693L28.5Very low28.1Very low161 Ų161137.7 Ų137.784%0.84381%0.814SS**  trans-118.482.7173.1-140.298.3000111S695L693-S695 PolarHBondContact O-N 3.36Å
694V28.5Very low28.3Very low130 Ų130135.8 Ų135.879%0.78881%0.813SS**  trans-59.7123.1173.8175.20000109.9
695S26.7Very low28.6Very low115 Ų115140.9 Ų140.980%0.80482%0.819SS**  trans-108.5108.2172.431.40000109.9L693L693-S695 PolarHBondContact O-N 3.36Å
696S28.1Very low28.6Very low109 Ų109139.9 Ų139.976%0.76282%0.818SS**  trans-93.1136.4-18047.80000111.8
697L29Very low28.7Very low165 Ų165138.9 Ų138.986%0.86482%0.818SS**  trans-123.1140.7172-70.9173.1000109.6
698P31Very low28.8Very low108 Ų108138.2 Ų138.270%0.70182%0.82SS**PPolyproline II helixtrans-79.2153.2178.733-35000111.9
699P30.4Very low28.9Very low129 Ų129146.5 Ų146.584%0.83885%0.847SS**PPolyproline II helixtrans-71.2136.3177.229.9-34.7000111.5
700I30.1Very low29.1Very low172 Ų172144.2 Ų144.288%0.88284%0.844SS**PPolyproline II helixtrans-82.4122.8175.4-63.2174.9000109.2
701N28.7Very low29Very low141 Ų141145 Ų14575%0.75485%0.848SS**  trans-152.5152165.3-131.1-31.6000110.9
702T31.6Very low29Very low127 Ų127142.9 Ų142.978%0.77985%0.847SS**  trans50.997.2173.852.40000118.8
703V29Very low29.1Very low137 Ų137142.9 Ų142.983%0.8385%0.852SS**  trans-138.296.6140.6-175.60000108.9
704F30.3Very low29.1Very low212 Ų212141.8 Ų141.893%0.9385%0.853SS**  trans-149.563.2172-125.7-68.4000112.1
705M30.1Very low29.2Very low182 Ų182142.5 Ų142.590%0.89786%0.857SS**  trans-146.1145.4155.3-74.1-160.1-64.800106.2
706G26.4Very low29.3Very low81 Ų81144.5 Ų144.584%0.83586%0.861SS**  cis125.571.315.600000108.5
707G27.9Very low29.4Very low84 Ų84147.2 Ų147.287%0.86687%0.869SS**  trans-113.7120-176.700000111.1
708A28.6Very low29.5Very low100 Ų100145.8 Ų145.883%0.82687%0.869SS**  trans-124126.317500000110.1
709Q29.7Very low29.3Very low276 Ų276149.2 Ų149.2100%1.2988%0.884SS**  trans-160.20161.9-121.4168.766.800109

Retrieved 709 of 709 residues in 650.8 ms (Link to these results)

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