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Cytochrome c oxidase subunit 1

Component of the cytochrome c oxidase, the last enzyme in the mitochondrial electron transport chain which drives oxidative phosphorylation. The respiratory chain contains 3 multisubunit complexes succinate dehydrogenase (complex II, CII), ubiquinol-cytochrome c oxidoreductase (cytochrome b-c1 complex, complex III, CIII) and cytochrome c oxidase (complex IV, CIV), that cooperate to transfer electrons derived from NADH and succinate to molecular oxygen, creating an electrochemical gradient over the inner membrane that drives transmembrane transport and the ATP synthase. Cytochrome c oxidase is the component of the respiratory chain that catalyzes the reduction of oxygen to water. Electrons originating from reduced cytochrome c in the intermembrane space (IMS) are transferred via the dinuclear copper A center (CU(A)) of subunit 2 and heme A of subunit 1 to the active site in subunit 1, a binuclear center (BNC) formed by heme A3 and copper B (CU(B)). The BNC reduces molecular oxygen to 2 water molecules using 4 electrons from cytochrome c in the IMS and 4 protons from the mitochondrial matrix.

AlphaFold DB , UniProt , Accession A0A023I8X8, Species HUMAN (Homo sapiens, Human), Gene COX1, Length 513 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
1M79.9Confident92.1Very high195 Ų19584.9 Ų84.996%0.96142%0.415SS*.  0-590-147.7177.4-137.500113D4 R5M1-D4 WeakPolarHBondContact CA-OD2 3.34Å; M1-D4 PolarHBondContact N-OD2 3.01Å; M1-R5 WeakPolarHBondContact O-CB 3.21Å; M1-R5 PolarHBondContact O-N 2.71Å
2F90.2Very high92.6Very high151 Ų15177.8 Ų77.866%0.66238%0.38SS*.Hα-helixtrans-66.9-50.8177.6-179.1-89.6000112.7D4 R5 W6F2-D4 PolarHBondContact O-N 3.21Å; F2-R5 PolarHBondContact O-N 2.86Å; F2-W6 AromaticContact CD2-CD1 3.43Å; F2-W6 VanDerWaalsContact CD2-CD1 3.43Å; F2-W6 AromaticContact CD2-NE1 3.8Å; F2-W6 AromaticContact CE2-CD1 3.32Å; F2-W6 HydrophobicContact CE2-CG 4.27Å; F2-W6 AromaticContact CE2-NE1 3.64Å; F2-W6 AromaticContact CG-CD1 3.93Å; F2-W6 AromaticContact CZ-CD1 3.73Å; F2-W6 HydrophobicContact CZ-CG 4.32Å; F2-W6 PolarHBondContact O-N 2.92Å
3A91Very high93Very high39 Ų3972.2 Ų72.232%0.32235%0.353SS..Hα-helixtrans-60.1-44.617900000111.9R5 W6 L7 F8A3-R5 VanDerWaalsContact C-N 3.3Å; A3-R5 PolarHBondContact O-N 2.68Å; A3-W6 PolarHBondContact O-N 2.86Å; A3-L7 HydrophobicContact CB-CD1 4.06Å; A3-L7 WeakPolarHBondContact O-CA 3.22Å; A3-L7 VanDerWaalsContact O-CB 3.29Å; A3-L7 WeakPolarHBondContact O-CB 3.43Å; A3-L7 PolarHBondContact O-N 3.36Å; A3-F8 HydrophobicContact CB-CE2 4.41Å; A3-F8 PolarHBondContact O-N 3.44Å
4D90.3Very high93.3Very high100 Ų10067.8 Ų67.854%0.53533%0.331SS..Hα-helixtrans-60.4-41.2178.5-47.8-50.3000112M1 F2 F8 S9M1-D4 WeakPolarHBondContact CA-OD2 3.34Å; M1-D4 PolarHBondContact N-OD2 3.01Å; F2-D4 PolarHBondContact O-N 3.21Å; D4-F8 CarbonylContact O-C 3.49Å; D4-F8 VanDerWaalsContact O-C 3.25Å; D4-S9 PolarHBondContact O-N 3.46Å
5R91.3Very high93.6Very high96 Ų9663.3 Ų63.336%0.36231%0.309SS..Hα-helixtrans-72.6-42.5-178.5-176.7176.9173-169.1-5.9113.3M1 F2 A3 S9 D14 Y502M1-R5 WeakPolarHBondContact O-CB 3.21Å; M1-R5 PolarHBondContact O-N 2.71Å; F2-R5 PolarHBondContact O-N 2.86Å; A3-R5 VanDerWaalsContact C-N 3.3Å; A3-R5 PolarHBondContact O-N 2.68Å; R5-S9 WeakPolarHBondContact O-CB 3.42Å; R5-S9 PolarHBondContact O-OG 3.46Å; R5-D14 WeakPolarHBondContact CG-OD2 3.22Å; R5-D14 IonicContact CZ-OD1 3.44Å; R5-D14 IonicContact NE-OD1 3.06Å; R5-D14 PolarHBondContact NE-OD1 3.02Å; R5-D14 IonicContact NE-OD2 3.46Å; R5-D14 PolarHBondContact NE-OD2 3.31Å; R5-D14 IonicContact NH2-OD1 2.9Å; R5-D14 PolarHBondContact NH2-OD1 3.12Å; R5-Y502 PolarHBondContact NE-OH 2.64Å; R5-Y502 PolarHBondContact NH1-OH 2.67Å; R5-Y502 PolarHBondContact NH2-OH 3.41Å
6W94Very high93.9Very high51 Ų5159.3 Ų59.319%0.19329%0.29CS..Hα-helixtrans-105.3-39.3-169.5-62.2111.7000113.7F2 A3 D14 T17 L18F2-W6 AromaticContact CD2-CD1 3.43Å; F2-W6 VanDerWaalsContact CD2-CD1 3.43Å; F2-W6 AromaticContact CD2-NE1 3.8Å; F2-W6 AromaticContact CE2-CD1 3.32Å; F2-W6 HydrophobicContact CE2-CG 4.27Å; F2-W6 AromaticContact CE2-NE1 3.64Å; F2-W6 AromaticContact CG-CD1 3.93Å; F2-W6 AromaticContact CZ-CD1 3.73Å; F2-W6 HydrophobicContact CZ-CG 4.32Å; F2-W6 PolarHBondContact O-N 2.92Å; A3-W6 PolarHBondContact O-N 2.86Å; W6-D14 HydrophobicContact CE3-CB 4.31Å; W6-D14 HydrophobicContact CZ3-CB 4.09Å; W6-T17 HydrophobicContact CH2-CG2 4.31Å; W6-T17 HydrophobicContact CZ3-CG2 4.26Å; W6-L18 HydrophobicContact CE3-CD1 4.47Å; W6-L18 HydrophobicContact CE3-CD2 3.85Å; W6-L18 HydrophobicContact CE3-CG 4.04Å; W6-L18 HydrophobicContact CZ3-CD2 4.42Å; W6-L18 HydrophobicContact CZ3-CG 4.44Å; W6-L18 WeakPolarHBondContact O-CD1 3.24Å
7L93.7Very high94.2Very high74 Ų7457.8 Ų57.839%0.38729%0.285SS..THydrogen-bonded Turntrans-84.2-42.9179.7-56.4179.7000111.3A3 N99 W103A3-L7 HydrophobicContact CB-CD1 4.06Å; A3-L7 WeakPolarHBondContact O-CA 3.22Å; A3-L7 VanDerWaalsContact O-CB 3.29Å; A3-L7 WeakPolarHBondContact O-CB 3.43Å; A3-L7 PolarHBondContact O-N 3.36Å; L7-N99 PolarHBondContact O-ND2 3.37Å; L7-W103 HydrophobicContact CB-CZ2 4.49Å; L7-W103 HydrophobicContact CD2-CH2 3.38Å; L7-W103 HydrophobicContact CD2-CZ2 3.4Å; L7-W103 VanDerWaalsContact CD2-CZ2 3.4Å; L7-W103 HydrophobicContact CD2-CZ3 4.39Å; L7-W103 PolarHBondContact O-NE1 3.42Å
8F95.2Very high94.4Very high145 Ų14555.8 Ų55.864%0.63628%0.276SS*.SBendtrans-105.924.3-176.9-53.1-62.9000112.9A3 D4A3-F8 HydrophobicContact CB-CE2 4.41Å; A3-F8 PolarHBondContact O-N 3.44Å; D4-F8 CarbonylContact O-C 3.49Å; D4-F8 VanDerWaalsContact O-C 3.25Å
9S95Very high94.6Very high4 Ų453.4 Ų53.43%0.02826%0.263CS..  trans-58.6142.9-177.4-155.70000112D4 R5 N11 D14 N99D4-S9 PolarHBondContact O-N 3.46Å; R5-S9 WeakPolarHBondContact O-CB 3.42Å; R5-S9 PolarHBondContact O-OG 3.46Å; S9-N11 PolarHBondContact OG-N 2.79Å; S9-D14 VanDerWaalsContact OG-CB 3.29Å; S9-D14 WeakPolarHBondContact OG-CB 3.3Å; S9-N99 VanDerWaalsContact O-CB 3.3Å; S9-N99 WeakPolarHBondContact O-CB 3.18Å; S9-N99 VanDerWaalsContact O-CG 3.32Å; S9-N99 PolarHBondContact O-ND2 3.29Å
10T95.6Very high94.8Very high67 Ų6752.2 Ų52.241%0.41126%0.258SS..  trans-119.37.8163.658.30000111.7P95 R96T10-P95 HydrophobicContact CG2-CB 4.33Å; T10-P95 WeakPolarHBondContact O-CB 3.47Å; T10-R96 HydrophobicContact CG2-CG 4.17Å
11N97Very high95Very high12 Ų1255 Ų556%0.06427%0.273CS..  trans-93.2126.7-179.3-172.3-84000110.5S9 K13 D14 V15 Y502S9-N11 PolarHBondContact OG-N 2.79Å; N11-K13 PolarHBondContact O-N 3.26Å; N11-K13 VanDerWaalsContact O-N 3.15Å; N11-K13 WeakPolarHBondContact OD1-CA 3.37Å; N11-K13 WeakPolarHBondContact OD1-CB 3.34Å; N11-K13 WeakPolarHBondContact OD1-CG 3.13Å; N11-K13 PolarHBondContact OD1-N 2.75Å; N11-D14 HydrophobicContact CB-CB 4.39Å; N11-D14 PolarHBondContact O-N 2.99Å; N11-V15 PolarHBondContact O-N 3.34Å; N11-V15 VanDerWaalsContact O-N 3.08Å; N11-Y502 PolarHBondContact ND2-O 3.24Å
12H97.5Very high95.9Very high0 Ų046.9 Ų46.90%023%0.232CC..Hα-helixtrans-56.5-29.5179.169.6101.2000114.5G16 N80 P84 D91 M92H12-G16 PolarHBondContact O-N 3Å; H12-N80 PolarHBondContact ND1-O 2.97Å; H12-P84 HydrophobicContact CB-CG 4.24Å; H12-D91 VanDerWaalsContact CB-OD1 3.27Å; H12-D91 WeakPolarHBondContact CB-OD1 3.48Å; H12-D91 IonicContact CD2-OD1 2.78Å; H12-D91 PolarHBondContact CD2-OD1 3.42Å; H12-D91 IonicContact CG-OD1 3.44Å; H12-D91 PolarHBondContact N-OD1 3.24Å; H12-D91 VanDerWaalsContact N-OD1 3.16Å; H12-M92 HydrophobicContact CB-CG 3.76Å
13K97.9Very high96.3Very high5 Ų539.7 Ų39.72%0.02220%0.201CC..Hα-helixtrans-76.2-40.1-179.7-53.9173.7-176174.30112N11 T17 W81 P500 P501 T504N11-K13 PolarHBondContact O-N 3.26Å; N11-K13 VanDerWaalsContact O-N 3.15Å; N11-K13 WeakPolarHBondContact OD1-CA 3.37Å; N11-K13 WeakPolarHBondContact OD1-CB 3.34Å; N11-K13 WeakPolarHBondContact OD1-CG 3.13Å; N11-K13 PolarHBondContact OD1-N 2.75Å; K13-T17 WeakPolarHBondContact O-CB 3.5Å; K13-T17 PolarHBondContact O-N 3.27Å; K13-T17 PolarHBondContact O-OG1 3.44Å; K13-W81 HydrophobicContact CB-CD2 4.13Å; K13-W81 HydrophobicContact CB-CE3 4.07Å; K13-W81 HydrophobicContact CB-CH2 3.77Å; K13-W81 HydrophobicContact CB-CZ2 3.79Å; K13-W81 HydrophobicContact CB-CZ3 3.9Å; K13-W81 HydrophobicContact CD-CE3 4.34Å; K13-W81 HydrophobicContact CD-CH2 4.22Å; K13-W81 HydrophobicContact CD-CZ3 3.83Å; K13-W81 HydrophobicContact CG-CD2 4.34Å; K13-W81 HydrophobicContact CG-CE3 3.89Å; K13-W81 HydrophobicContact CG-CH2 4.2Å; K13-W81 HydrophobicContact CG-CZ3 3.82Å; K13-W81 PolarHBondContact O-NE1 3.14Å; K13-W81 VanDerWaalsContact O-NE1 3.13Å; K13-P500 PolarHBondContact NZ-O 3.08Å; K13-P501 PolarHBondContact NZ-O 3.21Å; K13-T504 PolarHBondContact NZ-OG1 3.34Å
14D97.6Very high96.6Very high10 Ų1040.4 Ų40.45%0.05321%0.207CC..Hα-helixtrans-65.6-47.2174.8-75.3-28.8000109.7R5 W6 S9 N11 G16 T17 L18R5-D14 WeakPolarHBondContact CG-OD2 3.22Å; R5-D14 IonicContact CZ-OD1 3.44Å; R5-D14 IonicContact NE-OD1 3.06Å; R5-D14 PolarHBondContact NE-OD1 3.02Å; R5-D14 IonicContact NE-OD2 3.46Å; R5-D14 PolarHBondContact NE-OD2 3.31Å; R5-D14 IonicContact NH2-OD1 2.9Å; R5-D14 PolarHBondContact NH2-OD1 3.12Å; W6-D14 HydrophobicContact CE3-CB 4.31Å; W6-D14 HydrophobicContact CZ3-CB 4.09Å; S9-D14 VanDerWaalsContact OG-CB 3.29Å; S9-D14 WeakPolarHBondContact OG-CB 3.3Å; N11-D14 HydrophobicContact CB-CB 4.39Å; N11-D14 PolarHBondContact O-N 2.99Å; D14-G16 PolarHBondContact O-N 3.42Å; D14-T17 WeakPolarHBondContact O-CB 3.48Å; D14-T17 PolarHBondContact O-N 2.89Å; D14-T17 VanDerWaalsContact O-N 3.15Å; D14-L18 WeakPolarHBondContact O-CG 3.46Å; D14-L18 PolarHBondContact O-N 3.46Å
15V98.3Very high96.9Very high0 Ų043 Ų430%021%0.209CC..Hα-helixtrans-61-45.2175.41760000111.4N11 T17 L18 Y19 N99 F102N11-V15 PolarHBondContact O-N 3.34Å; N11-V15 VanDerWaalsContact O-N 3.08Å; V15-T17 VanDerWaalsContact C-N 3.28Å; V15-T17 PolarHBondContact O-N 3.18Å; V15-L18 WeakPolarHBondContact O-CB 3.33Å; V15-L18 PolarHBondContact O-N 3.06Å; V15-L18 VanDerWaalsContact O-N 3.15Å; V15-Y19 HydrophobicContact CG1-CD2 3.87Å; V15-Y19 HydrophobicContact CG1-CE2 3.66Å; V15-Y19 VanDerWaalsContact O-CD2 3.29Å; V15-Y19 WeakPolarHBondContact O-CD2 3.28Å; V15-Y19 PolarHBondContact O-N 3.02Å; V15-N99 HydrophobicContact CG2-CB 4.37Å; V15-F102 HydrophobicContact CG1-CB 4.18Å
16G98.1Very high97.3Very high0 Ų038.4 Ų38.40%019%0.192CC..Hα-helixtrans-59.9-37.2174.800000112.7H12 D14 Y19 L20 G77H12-G16 PolarHBondContact O-N 3Å; D14-G16 PolarHBondContact O-N 3.42Å; G16-Y19 PolarHBondContact O-N 3.19Å; G16-L20 WeakPolarHBondContact O-CG 3.43Å; G16-L20 PolarHBondContact O-N 3.37Å; G16-G77 WeakPolarHBondContact O-CA 3.48Å
17T98.3Very high97.4Very high33 Ų3336.4 Ų36.420%0.20219%0.187CC..Hα-helixtrans-65.5-41.4174.6-57.20000111.6W6 K13 D14 V15 Y19 L20 L21 W81W6-T17 HydrophobicContact CH2-CG2 4.31Å; W6-T17 HydrophobicContact CZ3-CG2 4.26Å; K13-T17 WeakPolarHBondContact O-CB 3.5Å; K13-T17 PolarHBondContact O-N 3.27Å; K13-T17 PolarHBondContact O-OG1 3.44Å; D14-T17 WeakPolarHBondContact O-CB 3.48Å; D14-T17 PolarHBondContact O-N 2.89Å; D14-T17 VanDerWaalsContact O-N 3.15Å; V15-T17 VanDerWaalsContact C-N 3.28Å; V15-T17 PolarHBondContact O-N 3.18Å; T17-Y19 VanDerWaalsContact C-N 3.34Å; T17-Y19 PolarHBondContact O-N 3.46Å; T17-L20 PolarHBondContact O-N 3.02Å; T17-L21 HydrophobicContact CG2-CD1 4.17Å; T17-L21 HydrophobicContact CG2-CG 4.41Å; T17-L21 WeakPolarHBondContact O-CG 3.28Å; T17-L21 PolarHBondContact O-N 3.48Å; T17-W81 VanDerWaalsContact OG1-CZ2 3.31Å; T17-W81 WeakPolarHBondContact OG1-CZ2 3.42Å; T17-W81 PolarHBondContact OG1-NE1 3.36Å; T17-W81 VanDerWaalsContact OG1-NE1 3.07Å
18L98.4Very high97.6Very high23 Ų2336.4 Ų36.412%0.1219%0.19CC..Hα-helixtrans-60.5-43.1175.7-68.7173.7000111.7W6 D14 V15 L21 F22 F102W6-L18 HydrophobicContact CE3-CD1 4.47Å; W6-L18 HydrophobicContact CE3-CD2 3.85Å; W6-L18 HydrophobicContact CE3-CG 4.04Å; W6-L18 HydrophobicContact CZ3-CD2 4.42Å; W6-L18 HydrophobicContact CZ3-CG 4.44Å; W6-L18 WeakPolarHBondContact O-CD1 3.24Å; D14-L18 WeakPolarHBondContact O-CG 3.46Å; D14-L18 PolarHBondContact O-N 3.46Å; V15-L18 WeakPolarHBondContact O-CB 3.33Å; V15-L18 PolarHBondContact O-N 3.06Å; V15-L18 VanDerWaalsContact O-N 3.15Å; L18-L21 PolarHBondContact O-N 2.79Å; L18-F22 VanDerWaalsContact O-CB 3.27Å; L18-F22 WeakPolarHBondContact O-CB 3.37Å; L18-F22 PolarHBondContact O-N 3Å; L18-F102 VanDerWaalsContact C-CE2 3.46Å; L18-F102 HydrophobicContact CB-CD1 4.04Å; L18-F102 HydrophobicContact CB-CD2 3.99Å; L18-F102 HydrophobicContact CB-CE1 3.74Å; L18-F102 HydrophobicContact CB-CE2 3.68Å; L18-F102 HydrophobicContact CB-CG 4.18Å; L18-F102 HydrophobicContact CB-CZ 3.57Å; L18-F102 HydrophobicContact CD1-CD1 3.9Å; L18-F102 HydrophobicContact CD1-CE1 3.83Å; L18-F102 HydrophobicContact CD1-CZ 4.49Å; L18-F102 HydrophobicContact CD2-CE1 4.45Å; L18-F102 HydrophobicContact CG-CE1 4.23Å; L18-F102 HydrophobicContact CG-CZ 4.41Å; L18-F102 WeakPolarHBondContact O-CE2 3.18Å
19Y98.7Very high97.8Very high9 Ų931.6 Ų31.64%0.03517%0.17CC..Hα-helixtrans-60.1-44173.6-84.8-72.8000112.8V15 G16 T17 G23 P72 G76 S101 F102 L105V15-Y19 HydrophobicContact CG1-CD2 3.87Å; V15-Y19 HydrophobicContact CG1-CE2 3.66Å; V15-Y19 VanDerWaalsContact O-CD2 3.29Å; V15-Y19 WeakPolarHBondContact O-CD2 3.28Å; V15-Y19 PolarHBondContact O-N 3.02Å; G16-Y19 PolarHBondContact O-N 3.19Å; T17-Y19 VanDerWaalsContact C-N 3.34Å; T17-Y19 PolarHBondContact O-N 3.46Å; Y19-G23 PolarHBondContact O-N 3.37Å; Y19-P72 HydrophobicContact CD1-CB 4.03Å; Y19-G76 VanDerWaalsContact CB-C 3.42Å; Y19-G76 VanDerWaalsContact CD2-O 3.29Å; Y19-G76 WeakPolarHBondContact CD2-O 3.34Å; Y19-G76 VanDerWaalsContact CG-C 3.44Å; Y19-G76 VanDerWaalsContact CG-CA 3.47Å; Y19-S101 WeakPolarHBondContact OH-CB 3.35Å; Y19-S101 PolarHBondContact OH-O 2.9Å; Y19-S101 PolarHBondContact OH-OG 3.44Å; Y19-F102 AromaticContact CD1-CD2 3.9Å; Y19-F102 HydrophobicContact CD1-CD2 3.9Å; Y19-F102 HydrophobicContact CD2-CB 4.27Å; Y19-F102 HydrophobicContact CD2-CD2 4.08Å; Y19-F102 HydrophobicContact CE1-CB 4.36Å; Y19-F102 HydrophobicContact CE1-CD2 4.09Å; Y19-F102 HydrophobicContact CE2-CB 3.68Å; Y19-F102 HydrophobicContact CE2-CD2 4.24Å; Y19-F102 HydrophobicContact CE2-CG 4.42Å; Y19-F102 AromaticContact CG-CD2 3.9Å; Y19-F102 HydrophobicContact CG-CD2 3.9Å; Y19-F102 WeakPolarHBondContact OH-CA 3.4Å; Y19-F102 PolarHBondContact OH-N 2.93Å; Y19-L105 HydrophobicContact CD1-CD1 3.87Å; Y19-L105 HydrophobicContact CE1-CD1 3.44Å; Y19-L105 VanDerWaalsContact CE1-CD1 3.44Å
20L98.5Very high97.9Very high30 Ų3031.4 Ų31.416%0.15717%0.169CC..Hα-helixtrans-63.1-43.9177.7-70175.3000111.9G16 T17 A24 I73 F78 F400G16-L20 WeakPolarHBondContact O-CG 3.43Å; G16-L20 PolarHBondContact O-N 3.37Å; T17-L20 PolarHBondContact O-N 3.02Å; L20-A24 VanDerWaalsContact O-CB 3.25Å; L20-A24 WeakPolarHBondContact O-CB 3.25Å; L20-A24 PolarHBondContact O-N 3.4Å; L20-I73 HydrophobicContact CD2-CG2 3.93Å; L20-F78 HydrophobicContact CD2-CE2 4.43Å; L20-F400 HydrophobicContact CD1-CD2 4.16Å; L20-F400 HydrophobicContact CD1-CE2 4.12Å
21L98.3Very high97.9Very high110 Ų11029.8 Ų29.858%0.57616%0.159SC*.Hα-helixtrans-66.7-46178.6-69.5175.5000112T17 L18 A24 W25T17-L21 HydrophobicContact CG2-CD1 4.17Å; T17-L21 HydrophobicContact CG2-CG 4.41Å; T17-L21 WeakPolarHBondContact O-CG 3.28Å; T17-L21 PolarHBondContact O-N 3.48Å; L18-L21 PolarHBondContact O-N 2.79Å; L21-A24 PolarHBondContact O-N 3.4Å; L21-W25 PolarHBondContact O-N 3.4Å
22F98.6Very high98Very high26 Ų2631.4 Ų31.411%0.11417%0.174CC..Hα-helixtrans-60-49.2176.7175.7-94.7000111.3L18 A24 W25 A26 F68 P72 F102 L105 P106 L109L18-F22 VanDerWaalsContact O-CB 3.27Å; L18-F22 WeakPolarHBondContact O-CB 3.37Å; L18-F22 PolarHBondContact O-N 3Å; F22-A24 VanDerWaalsContact C-N 3.34Å; F22-A24 PolarHBondContact O-N 3.05Å; F22-W25 PolarHBondContact O-N 3.27Å; F22-A26 WeakPolarHBondContact O-CB 3.23Å; F22-A26 PolarHBondContact O-N 3.04Å; F22-F68 HydrophobicContact CE1-CB 4.15Å; F22-F68 AromaticContact CE1-CD1 3.9Å; F22-F68 HydrophobicContact CE1-CD1 3.9Å; F22-F68 HydrophobicContact CZ-CB 4.48Å; F22-F68 AromaticContact CZ-CD1 3.76Å; F22-F68 HydrophobicContact CZ-CD1 3.76Å; F22-P72 HydrophobicContact CD1-CB 4.23Å; F22-P72 HydrophobicContact CD1-CG 4.39Å; F22-P72 HydrophobicContact CE1-CG 4.33Å; F22-F102 HydrophobicContact CB-CE2 3.83Å; F22-F102 HydrophobicContact CB-CZ 4.34Å; F22-F102 HydrophobicContact CG-CE2 4.3Å; F22-L105 HydrophobicContact CD1-CB 4.44Å; F22-L105 HydrophobicContact CD1-CD1 4.26Å; F22-L105 HydrophobicContact CE1-CB 3.84Å; F22-L105 HydrophobicContact CE1-CD1 4.08Å; F22-L105 HydrophobicContact CE2-CB 4.47Å; F22-L105 HydrophobicContact CZ-CB 3.83Å; F22-P106 HydrophobicContact CD2-CG 4.33Å; F22-P106 HydrophobicContact CE2-CB 4.44Å; F22-P106 HydrophobicContact CE2-CG 4.21Å; F22-L109 HydrophobicContact CE2-CB 4.3Å; F22-L109 HydrophobicContact CE2-CD2 3.72Å; F22-L109 HydrophobicContact CZ-CB 3.92Å; F22-L109 HydrophobicContact CZ-CD2 3.61Å; F22-L109 HydrophobicContact CZ-CG 4.42Å
23G98.4Very high98Very high0 Ų032.7 Ų32.70%018%0.181CC..Hα-helixtrans-65.2-35.7179.600000113.3Y19 G27 F68Y19-G23 PolarHBondContact O-N 3.37Å; G23-G27 PolarHBondContact O-N 3.4Å; G23-F68 WeakPolarHBondContact CA-O 3.27Å
24A97.6Very high98Very high54 Ų5433.7 Ų33.745%0.44619%0.188SC..Hα-helixtrans-64.5-44173.300000111.7L20 L21 F22 G27 V28L20-A24 VanDerWaalsContact O-CB 3.25Å; L20-A24 WeakPolarHBondContact O-CB 3.25Å; L20-A24 PolarHBondContact O-N 3.4Å; L21-A24 PolarHBondContact O-N 3.4Å; F22-A24 VanDerWaalsContact C-N 3.34Å; F22-A24 PolarHBondContact O-N 3.05Å; A24-G27 PolarHBondContact O-N 3.08Å; A24-V28 PolarHBondContact O-N 2.87Å; A24-V28 VanDerWaalsContact O-N 3.08Å
25W98Very high98Very high154 Ų15434.4 Ų34.458%0.58319%0.192SC*.Hα-helixtrans-62.8-47.9176.2-174.589.8000111.8L21 F22 G27 V28 L29 L109 L113L21-W25 PolarHBondContact O-N 3.4Å; F22-W25 PolarHBondContact O-N 3.27Å; W25-G27 VanDerWaalsContact C-N 3.27Å; W25-G27 PolarHBondContact O-N 3.4Å; W25-V28 PolarHBondContact O-N 3.45Å; W25-L29 HydrophobicContact CH2-CD2 3.99Å; W25-L29 HydrophobicContact CZ3-CD2 3.81Å; W25-L29 PolarHBondContact O-N 2.98Å; W25-L29 VanDerWaalsContact O-N 3.12Å; W25-L109 HydrophobicContact CE3-CD2 4.04Å; W25-L109 HydrophobicContact CZ3-CD2 3.65Å; W25-L113 HydrophobicContact CH2-CD1 4.34Å
26A98.4Very high98Very high0 Ų038.3 Ų38.30%021%0.213CC..Hα-helixtrans-61-36.7175.300000111.8F22 L29 G30 V64 F68 L109F22-A26 WeakPolarHBondContact O-CB 3.23Å; F22-A26 PolarHBondContact O-N 3.04Å; A26-L29 WeakPolarHBondContact O-CB 3.31Å; A26-L29 PolarHBondContact O-N 3.47Å; A26-G30 PolarHBondContact O-N 3.19Å; A26-V64 HydrophobicContact CB-CG1 4.27Å; A26-V64 WeakPolarHBondContact O-CG1 3.48Å; A26-F68 HydrophobicContact CB-CB 3.86Å; A26-F68 VanDerWaalsContact CB-O 3.32Å; A26-F68 WeakPolarHBondContact CB-O 3.37Å; A26-L109 HydrophobicContact CB-CD2 4.34Å
27G97.2Very high98Very high8 Ų839.3 Ų39.38%0.08222%0.218CC..Hα-helixtrans-63.4-39.8175.600000113.5G23 A24 W25 G30 T31G23-G27 PolarHBondContact O-N 3.4Å; A24-G27 PolarHBondContact O-N 3.08Å; W25-G27 VanDerWaalsContact C-N 3.27Å; W25-G27 PolarHBondContact O-N 3.4Å; G27-G30 PolarHBondContact O-N 2.74Å; G27-T31 WeakPolarHBondContact O-CB 3.46Å; G27-T31 PolarHBondContact O-N 3.45Å; G27-T31 PolarHBondContact O-OG1 3.25Å
28V97.6Very high97.9Very high74 Ų7438.2 Ų38.245%0.44821%0.21SC..Hα-helixtrans-64-43.8173.3174.10000110.5A24 W25 T31 A32A24-V28 PolarHBondContact O-N 2.87Å; A24-V28 VanDerWaalsContact O-N 3.08Å; W25-V28 PolarHBondContact O-N 3.45Å; V28-T31 PolarHBondContact O-N 3.36Å; V28-A32 PolarHBondContact O-N 3.47Å
29L98.1Very high97.9Very high44 Ų4438.7 Ų38.723%0.2322%0.217CC..Hα-helixtrans-61.2-47.8175.7178.160000112.1W25 A26 T31 A32 L33 L113W25-L29 HydrophobicContact CH2-CD2 3.99Å; W25-L29 HydrophobicContact CZ3-CD2 3.81Å; W25-L29 PolarHBondContact O-N 2.98Å; W25-L29 VanDerWaalsContact O-N 3.12Å; A26-L29 WeakPolarHBondContact O-CB 3.31Å; A26-L29 PolarHBondContact O-N 3.47Å; L29-T31 VanDerWaalsContact C-N 3.29Å; L29-T31 PolarHBondContact O-N 2.9Å; L29-A32 WeakPolarHBondContact O-CB 3.38Å; L29-A32 PolarHBondContact O-N 3.01Å; L29-L33 WeakPolarHBondContact O-CG 3.37Å; L29-L33 PolarHBondContact O-N 3.29Å; L29-L113 HydrophobicContact CD2-CD1 3.85Å; L29-L113 HydrophobicContact CD2-CD2 3.7Å; L29-L113 HydrophobicContact CD2-CG 4.38Å
30G97.8Very high97.8Very high0 Ų038.3 Ų38.30%022%0.216CC..Hα-helixtrans-61.9-37.3177.100000112.4A26 G27 L33 S34 H61A26-G30 PolarHBondContact O-N 3.19Å; G27-G30 PolarHBondContact O-N 2.74Å; G30-L33 PolarHBondContact O-N 2.9Å; G30-S34 PolarHBondContact O-N 3.35Å; G30-H61 PolarHBondContact O-ND1 3.01Å
31T96.5Very high97.7Very high33 Ų3337 Ų3720%0.20221%0.209CC..Hα-helixtrans-65.8-41.7174-570000111.4G27 V28 L29 L33 S34 L35 V465G27-T31 WeakPolarHBondContact O-CB 3.46Å; G27-T31 PolarHBondContact O-N 3.45Å; G27-T31 PolarHBondContact O-OG1 3.25Å; V28-T31 PolarHBondContact O-N 3.36Å; L29-T31 VanDerWaalsContact C-N 3.29Å; L29-T31 PolarHBondContact O-N 2.9Å; T31-L33 VanDerWaalsContact C-N 3.33Å; T31-L33 PolarHBondContact O-N 3.19Å; T31-S34 WeakPolarHBondContact O-CB 3.29Å; T31-S34 PolarHBondContact O-N 3.04Å; T31-S34 VanDerWaalsContact O-N 3.14Å; T31-L35 HydrophobicContact CG2-CD1 4.3Å; T31-L35 WeakPolarHBondContact O-CG 3.33Å; T31-L35 PolarHBondContact O-N 2.83Å; T31-V465 HydrophobicContact CG2-CG2 4.39Å
32A97.9Very high97.6Very high47 Ų4732.6 Ų32.639%0.38819%0.191SC..Hα-helixtrans-59.8-43.3175.500000111.7V28 L29 S34 L35 L36V28-A32 PolarHBondContact O-N 3.47Å; L29-A32 WeakPolarHBondContact O-CB 3.38Å; L29-A32 PolarHBondContact O-N 3.01Å; A32-S34 VanDerWaalsContact C-N 3.34Å; A32-S34 PolarHBondContact O-N 2.84Å; A32-L35 PolarHBondContact O-N 3Å; A32-L36 PolarHBondContact O-N 3.4Å; A32-L36 VanDerWaalsContact O-N 3.14Å
33L98.2Very high97.4Very high26 Ų2637.3 Ų37.314%0.13621%0.213CC..Hα-helixtrans-62.9-40.4174-63.1170.6000111.8L29 G30 T31 L35 L36 I37 I57 A60 H61 V64L29-L33 WeakPolarHBondContact O-CG 3.37Å; L29-L33 PolarHBondContact O-N 3.29Å; G30-L33 PolarHBondContact O-N 2.9Å; T31-L33 VanDerWaalsContact C-N 3.33Å; T31-L33 PolarHBondContact O-N 3.19Å; L33-L35 VanDerWaalsContact C-N 3.32Å; L33-L35 PolarHBondContact O-N 3.28Å; L33-L36 PolarHBondContact O-N 3.07Å; L33-I37 WeakPolarHBondContact O-CG1 2.99Å; L33-I37 PolarHBondContact O-N 3.46Å; L33-I37 VanDerWaalsContact O-N 3.12Å; L33-I57 HydrophobicContact CB-CG2 4.09Å; L33-I57 HydrophobicContact CD2-CG2 4.02Å; L33-A60 HydrophobicContact CD1-CB 3.85Å; L33-H61 HydrophobicContact CB-CB 3.86Å; L33-H61 HydrophobicContact CD1-CB 4.46Å; L33-V64 HydrophobicContact CD1-CG2 4.41Å
34S97.8Very high97.2Very high26 Ų2639.2 Ų39.218%0.18223%0.225CC..Hα-helixtrans-60.3-40.9175.1-161.90000112.5G30 T31 A32 L36 I37 R38 H61G30-S34 PolarHBondContact O-N 3.35Å; T31-S34 WeakPolarHBondContact O-CB 3.29Å; T31-S34 PolarHBondContact O-N 3.04Å; T31-S34 VanDerWaalsContact O-N 3.14Å; A32-S34 VanDerWaalsContact C-N 3.34Å; A32-S34 PolarHBondContact O-N 2.84Å; S34-L36 VanDerWaalsContact C-N 3.35Å; S34-I37 WeakPolarHBondContact O-CB 3.39Å; S34-I37 PolarHBondContact O-N 3.45Å; S34-R38 WeakPolarHBondContact O-CG 3.03Å; S34-R38 PolarHBondContact O-N 3.4Å; S34-H61 VanDerWaalsContact CB-CE1 3.47Å; S34-H61 WeakPolarHBondContact CB-CE1 3.29Å
35L97.6Very high96.9Very high25 Ų2538 Ų3813%0.13122%0.219CC..Hα-helixtrans-66-37.3177.9-71165.5000112.1T31 A32 L33 R38 A39 F459 L462T31-L35 HydrophobicContact CG2-CD1 4.3Å; T31-L35 WeakPolarHBondContact O-CG 3.33Å; T31-L35 PolarHBondContact O-N 2.83Å; A32-L35 PolarHBondContact O-N 3Å; L33-L35 VanDerWaalsContact C-N 3.32Å; L33-L35 PolarHBondContact O-N 3.28Å; L35-R38 PolarHBondContact O-N 3.25Å; L35-A39 VanDerWaalsContact O-CB 3.24Å; L35-A39 WeakPolarHBondContact O-CB 3.21Å; L35-A39 PolarHBondContact O-N 3.47Å; L35-F459 HydrophobicContact CD2-CD1 4.2Å; L35-F459 HydrophobicContact CD2-CE1 4.34Å; L35-L462 HydrophobicContact CD1-CB 4.19Å; L35-L462 HydrophobicContact CD1-CD1 3.83Å; L35-L462 HydrophobicContact CD1-CD2 3.73Å; L35-L462 HydrophobicContact CD1-CG 4.1Å; L35-L462 HydrophobicContact CD2-CB 4.15Å; L35-L462 HydrophobicContact CD2-CD2 4.37Å
36L97.7Very high96.4Very high83 Ų8334.5 Ų34.544%0.43521%0.211SC..Hα-helixtrans-62.6-43.4173.1-66.7175.4000111.3A32 L33 S34 R38 A39 E40 I57A32-L36 PolarHBondContact O-N 3.4Å; A32-L36 VanDerWaalsContact O-N 3.14Å; L33-L36 PolarHBondContact O-N 3.07Å; S34-L36 VanDerWaalsContact C-N 3.35Å; L36-R38 VanDerWaalsContact C-N 3.34Å; L36-R38 PolarHBondContact O-N 2.84Å; L36-A39 PolarHBondContact O-N 3.32Å; L36-E40 PolarHBondContact O-N 3.03Å; L36-I57 HydrophobicContact CB-CD1 4.5Å; L36-I57 HydrophobicContact CB-CG2 4.29Å; L36-I57 HydrophobicContact CD1-CD1 4.26Å
37I98.1Very high96.1Very high20 Ų2039.7 Ų39.710%0.10324%0.238CC..Hα-helixtrans-59.8-45.1175.4-63.6162.4000110.6L33 S34 E40 L41 Y54 I57 V58 H61L33-I37 WeakPolarHBondContact O-CG1 2.99Å; L33-I37 PolarHBondContact O-N 3.46Å; L33-I37 VanDerWaalsContact O-N 3.12Å; S34-I37 WeakPolarHBondContact O-CB 3.39Å; S34-I37 PolarHBondContact O-N 3.45Å; I37-E40 PolarHBondContact O-N 3.48Å; I37-L41 HydrophobicContact CG2-CD1 3.99Å; I37-L41 WeakPolarHBondContact O-CG 3.45Å; I37-L41 PolarHBondContact O-N 3.41Å; I37-Y54 HydrophobicContact CB-CE2 4.42Å; I37-Y54 HydrophobicContact CG2-CE2 3.88Å; I37-I57 HydrophobicContact CD1-CG2 4.13Å; I37-I57 HydrophobicContact CG1-CG2 3.73Å; I37-V58 HydrophobicContact CD1-CB 4.33Å; I37-V58 HydrophobicContact CD1-CG2 3.79Å; I37-V58 HydrophobicContact CG1-CG2 3.88Å; I37-V58 HydrophobicContact CG2-CG2 4.38Å; I37-H61 HydrophobicContact CD1-CB 3.9Å
38R97.5Very high95.9Very high10 Ų1042.3 Ų42.34%0.03825%0.25CC..Hα-helixtrans-74.5-27.7-179.7-66.9-48.4-48.4168.910.3113.4S34 L35 L36 G42 N451 S454 S455S34-R38 WeakPolarHBondContact O-CG 3.03Å; S34-R38 PolarHBondContact O-N 3.4Å; L35-R38 PolarHBondContact O-N 3.25Å; L36-R38 VanDerWaalsContact C-N 3.34Å; L36-R38 PolarHBondContact O-N 2.84Å; R38-G42 PolarHBondContact O-N 3.27Å; R38-G42 VanDerWaalsContact O-N 3.1Å; R38-N451 PolarHBondContact NH2-O 3.46Å; R38-N451 PolarHBondContact NH2-OD1 3.16Å; R38-N451 VanDerWaalsContact NH2-OD1 3.11Å; R38-S454 VanDerWaalsContact CZ-OG 3.23Å; R38-S454 VanDerWaalsContact NH2-CB 3.34Å; R38-S454 PolarHBondContact NH2-OG 2.97Å; R38-S455 PolarHBondContact NE-OG 2.88Å; R38-S455 PolarHBondContact NH2-OG 3.13Å; R38-S455 WeakPolarHBondContact O-CB 3.4Å; R38-S455 PolarHBondContact O-OG 3.35Å
39A96.7Very high95.7Very high33 Ų3341.6 Ų41.627%0.27326%0.258SS..Hα-helixtrans-68.4-44.5171.600000110.7L35 L36 L41 G42 L47L35-A39 VanDerWaalsContact O-CB 3.24Å; L35-A39 WeakPolarHBondContact O-CB 3.21Å; L35-A39 PolarHBondContact O-N 3.47Å; L36-A39 PolarHBondContact O-N 3.32Å; A39-L41 PolarHBondContact O-N 3.47Å; A39-G42 PolarHBondContact O-N 3.05Å; A39-L47 HydrophobicContact CB-CD2 4.09Å
40E97.3Very high95.5Very high2 Ų242.9 Ų42.91%0.00927%0.265CS..Hα-helixtrans-56.4-51.3173.8-170.965.7-166.500110.7L36 I37 G42 N46 L47 L48 Y54L36-E40 PolarHBondContact O-N 3.03Å; I37-E40 PolarHBondContact O-N 3.48Å; E40-G42 PolarHBondContact O-N 2.89Å; E40-G42 VanDerWaalsContact O-N 3.16Å; E40-N46 WeakPolarHBondContact OE1-CA 3.07Å; E40-L47 PolarHBondContact OE1-N 2.68Å; E40-L47 WeakPolarHBondContact OE2-CA 3.33Å; E40-L47 VanDerWaalsContact OE2-CB 3.23Å; E40-L47 WeakPolarHBondContact OE2-CB 3.43Å; E40-L47 PolarHBondContact OE2-N 2.78Å; E40-L48 HydrophobicContact CB-CD1 4.39Å; E40-L48 HydrophobicContact CG-CD1 4.35Å; E40-L48 PolarHBondContact OE1-N 3.19Å; E40-L48 VanDerWaalsContact OE2-CB 3.32Å; E40-L48 WeakPolarHBondContact OE2-CB 3.45Å; E40-L48 WeakPolarHBondContact OE2-CG 3.47Å; E40-L48 PolarHBondContact OE2-N 2.73Å; E40-Y54 HydrophobicContact CB-CD2 4.16Å; E40-Y54 HydrophobicContact CB-CE2 4.32Å; E40-Y54 HydrophobicContact CG-CD2 3.9Å; E40-Y54 HydrophobicContact CG-CE2 4.28Å
41L97.3Very high95.4Very high1 Ų146.5 Ų46.51%0.00528%0.284CS..THydrogen-bonded Turntrans-78.44.5-177.8-62.3171.4000114I37 A39 Q43 Y54 Y371 Y443 N451I37-L41 HydrophobicContact CG2-CD1 3.99Å; I37-L41 WeakPolarHBondContact O-CG 3.45Å; I37-L41 PolarHBondContact O-N 3.41Å; A39-L41 PolarHBondContact O-N 3.47Å; L41-Q43 PolarHBondContact O-N 3.23Å; L41-Y54 WeakPolarHBondContact CD1-OH 3.44Å; L41-Y54 HydrophobicContact CG-CE2 4.28Å; L41-Y371 WeakPolarHBondContact CD1-OH 3.38Å; L41-Y443 HydrophobicContact CB-CE1 4.21Å; L41-Y443 HydrophobicContact CD2-CD1 3.94Å; L41-Y443 HydrophobicContact CD2-CE1 4.11Å; L41-Y443 VanDerWaalsContact O-CE1 3.25Å; L41-Y443 WeakPolarHBondContact O-CE1 3.41Å; L41-Y443 PolarHBondContact O-OH 2.96Å; L41-N451 WeakPolarHBondContact O-CB 3.34Å
42G95.1Very high95.3Very high19 Ų1947.6 Ų47.620%0.19629%0.287CS..THydrogen-bonded Turntrans-67-26-175.500000113.5R38 A39 E40 I452R38-G42 PolarHBondContact O-N 3.27Å; R38-G42 VanDerWaalsContact O-N 3.1Å; A39-G42 PolarHBondContact O-N 3.05Å; E40-G42 PolarHBondContact O-N 2.89Å; E40-G42 VanDerWaalsContact O-N 3.16Å; G42-I452 WeakPolarHBondContact O-CG1 3.35Å
43Q93.7Very high95.3Very high124 Ų12449 Ų4958%0.57929%0.287SS*.SBendtrans-150158.317761.7-173.4-5.400109.2L41 Y443L41-Q43 PolarHBondContact O-N 3.23Å; Q43-Y443 VanDerWaalsContact C-OH 3.29Å; Q43-Y443 VanDerWaalsContact CA-OH 3.32Å; Q43-Y443 WeakPolarHBondContact CA-OH 3.25Å; Q43-Y443 PolarHBondContact N-OH 2.83Å
44P94.2Very high95.2Very high40 Ų4048 Ų4826%0.2628%0.282SS..SBendtrans-59.5148.3170.1-22.332.7000112.3Y443 D445 T448P44-Y443 HydrophobicContact CG-CD2 4.37Å; P44-Y443 HydrophobicContact CG-CE2 3.77Å; P44-D445 WeakPolarHBondContact CB-OD1 3.25Å; P44-D445 VanDerWaalsContact CG-OD1 3.31Å; P44-D445 WeakPolarHBondContact CG-OD1 3.25Å; P44-T448 HydrophobicContact CG-CG2 4.37Å; P44-T448 WeakPolarHBondContact CG-OG1 3.09Å
45G91.9Very high95.2Very high30 Ų3048.7 Ų48.731%0.30928%0.283SS..SBendtrans93.8164-176.900000114D442G45-D442 PolarHBondContact N-OD1 3.07Å
46N87.9Confident95.3Very high79 Ų7948.1 Ų48.142%0.42228%0.281SS..  trans-87.5117.1-172.5-69.8-6.9000112.3E40 D51E40-N46 WeakPolarHBondContact OE1-CA 3.07Å; N46-D51 PolarHBondContact ND2-OD1 3.31Å
47L92.6Very high95.3Very high110 Ų11045.2 Ų45.258%0.57627%0.265SS*.SBendtrans-86.9-43.4172.4167.674.8000111.1A39 E40 G49A39-L47 HydrophobicContact CB-CD2 4.09Å; E40-L47 PolarHBondContact OE1-N 2.68Å; E40-L47 WeakPolarHBondContact OE2-CA 3.33Å; E40-L47 VanDerWaalsContact OE2-CB 3.23Å; E40-L47 WeakPolarHBondContact OE2-CB 3.43Å; E40-L47 PolarHBondContact OE2-N 2.78Å; L47-G49 VanDerWaalsContact C-N 3.3Å
48L93Very high95.3Very high62 Ų6245.6 Ų45.633%0.32527%0.268SS..SBendtrans-74.1-22.4176.9-75.2169.6000112.3E40 N50 I57E40-L48 HydrophobicContact CB-CD1 4.39Å; E40-L48 HydrophobicContact CG-CD1 4.35Å; E40-L48 PolarHBondContact OE1-N 3.19Å; E40-L48 VanDerWaalsContact OE2-CB 3.32Å; E40-L48 WeakPolarHBondContact OE2-CB 3.45Å; E40-L48 WeakPolarHBondContact OE2-CG 3.47Å; E40-L48 PolarHBondContact OE2-N 2.73Å; L48-N50 PolarHBondContact O-N 3.47Å; L48-I57 HydrophobicContact CD1-CD1 3.86Å; L48-I57 HydrophobicContact CD2-CD1 4.46Å
49G92.9Very high95.3Very high59 Ų5945.2 Ų45.261%0.60827%0.268SS*.SBendtrans72.54.2178.700000115.2L47L47-G49 VanDerWaalsContact C-N 3.3Å
50N94.2Very high95.4Very high71 Ų7144.1 Ų44.138%0.3826%0.258SS..  trans-149.5113.6178.3-174.6-34000111.9L48 H52 I53 Y54L48-N50 PolarHBondContact O-N 3.47Å; N50-H52 VanDerWaalsContact C-N 3.3Å; N50-H52 PolarHBondContact O-N 2.73Å; N50-H52 WeakPolarHBondContact OD1-CA 3.35Å; N50-H52 VanDerWaalsContact OD1-CB 3.28Å; N50-H52 WeakPolarHBondContact OD1-CB 3.26Å; N50-H52 PolarHBondContact OD1-N 3.2Å; N50-I53 HydrophobicContact CB-CB 4.2Å; N50-I53 HydrophobicContact CB-CD1 3.87Å; N50-I53 HydrophobicContact CB-CG1 3.97Å; N50-I53 PolarHBondContact O-N 2.93Å; N50-I53 PolarHBondContact OD1-N 3.02Å; N50-Y54 PolarHBondContact O-N 2.98Å
51D94.6Very high95.5Very high77 Ų7745.2 Ų45.241%0.41226%0.263SS..Hα-helixtrans-65-31.1-177.8-56.4-21.1000113.2N46 Y54 N55 S441N46-D51 PolarHBondContact ND2-OD1 3.31Å; D51-Y54 WeakPolarHBondContact O-CB 3.45Å; D51-Y54 PolarHBondContact O-N 3.39Å; D51-N55 PolarHBondContact O-N 3.24Å; D51-N55 VanDerWaalsContact O-N 3.1Å; D51-N55 PolarHBondContact O-ND2 3.47Å; D51-S441 WeakPolarHBondContact CB-OG 3.21Å; D51-S441 PolarHBondContact OD1-OG 3Å
52H95.9Very high95.5Very high56 Ų5646 Ų4626%0.25927%0.27SS..Hα-helixtrans-68.3-42.4176.9-176.568.9000111.1N50 Y54 N55 V56 A120 G121 H138N50-H52 VanDerWaalsContact C-N 3.3Å; N50-H52 PolarHBondContact O-N 2.73Å; N50-H52 WeakPolarHBondContact OD1-CA 3.35Å; N50-H52 VanDerWaalsContact OD1-CB 3.28Å; N50-H52 WeakPolarHBondContact OD1-CB 3.26Å; N50-H52 PolarHBondContact OD1-N 3.2Å; H52-Y54 VanDerWaalsContact C-N 3.27Å; H52-Y54 PolarHBondContact O-N 2.96Å; H52-N55 PolarHBondContact O-N 2.9Å; H52-V56 WeakPolarHBondContact O-CG2 3.42Å; H52-V56 PolarHBondContact O-N 3.21Å; H52-A120 PolarHBondContact CD2-O 3.42Å; H52-A120 PolarHBondContact NE2-O 2.84Å; H52-G121 PolarHBondContact NE2-O 3.32Å; H52-H138 AromaticContact CE1-NE2 3.48Å; H52-H138 PolarHBondContact CE1-NE2 2.86Å
53I96.6Very high95.6Very high77 Ų7745.2 Ų45.240%0.39526%0.261SS..Hα-helixtrans-59.8-41.4175.3-66179.8000110.3N50 N55 V56 I57N50-I53 HydrophobicContact CB-CB 4.2Å; N50-I53 HydrophobicContact CB-CD1 3.87Å; N50-I53 HydrophobicContact CB-CG1 3.97Å; N50-I53 PolarHBondContact O-N 2.93Å; N50-I53 PolarHBondContact OD1-N 3.02Å; I53-N55 VanDerWaalsContact C-N 3.33Å; I53-N55 PolarHBondContact O-N 3.4Å; I53-V56 PolarHBondContact O-N 3.17Å; I53-I57 HydrophobicContact CG2-CD1 3.87Å; I53-I57 HydrophobicContact CG2-CG1 4.38Å; I53-I57 VanDerWaalsContact O-CG1 3.31Å; I53-I57 WeakPolarHBondContact O-CG1 3.38Å; I53-I57 PolarHBondContact O-N 2.98Å
54Y97.4Very high95.9Very high4 Ų439.3 Ų39.32%0.01623%0.234CC..Hα-helixtrans-56.6-46.9173.4170.9-94.5000111.7I37 E40 L41 N50 D51 H52 V56 I57 V58 Y440I37-Y54 HydrophobicContact CB-CE2 4.42Å; I37-Y54 HydrophobicContact CG2-CE2 3.88Å; E40-Y54 HydrophobicContact CB-CD2 4.16Å; E40-Y54 HydrophobicContact CB-CE2 4.32Å; E40-Y54 HydrophobicContact CG-CD2 3.9Å; E40-Y54 HydrophobicContact CG-CE2 4.28Å; L41-Y54 WeakPolarHBondContact CD1-OH 3.44Å; L41-Y54 HydrophobicContact CG-CE2 4.28Å; N50-Y54 PolarHBondContact O-N 2.98Å; D51-Y54 WeakPolarHBondContact O-CB 3.45Å; D51-Y54 PolarHBondContact O-N 3.39Å; H52-Y54 VanDerWaalsContact C-N 3.27Å; H52-Y54 PolarHBondContact O-N 2.96Å; Y54-V56 VanDerWaalsContact C-N 3.35Å; Y54-V56 PolarHBondContact O-N 3.32Å; Y54-I57 PolarHBondContact O-N 3.47Å; Y54-V58 HydrophobicContact CD1-CG2 4.13Å; Y54-V58 HydrophobicContact CD2-CG2 4.42Å; Y54-V58 HydrophobicContact CE1-CG2 3.75Å; Y54-V58 HydrophobicContact CE2-CG2 4.07Å; Y54-V58 HydrophobicContact CG-CG2 4.46Å; Y54-V58 VanDerWaalsContact O-CG2 3.3Å; Y54-V58 WeakPolarHBondContact O-CG2 3.16Å; Y54-V58 PolarHBondContact O-N 3.36Å; Y54-Y440 VanDerWaalsContact CE1-C 3.4Å; Y54-Y440 VanDerWaalsContact CE1-O 3.22Å; Y54-Y440 WeakPolarHBondContact CE1-O 3.35Å; Y54-Y440 PolarHBondContact OH-O 3.04Å
55N97.8Very high96Very high41 Ų4139 Ų3922%0.21923%0.229CC..Hα-helixtrans-65.6-34.4177.7-75.1-40.3000113.5D51 H52 I53 V58 T59 R439D51-N55 PolarHBondContact O-N 3.24Å; D51-N55 VanDerWaalsContact O-N 3.1Å; D51-N55 PolarHBondContact O-ND2 3.47Å; H52-N55 PolarHBondContact O-N 2.9Å; I53-N55 VanDerWaalsContact C-N 3.33Å; I53-N55 PolarHBondContact O-N 3.4Å; N55-V58 PolarHBondContact O-N 3.15Å; N55-T59 VanDerWaalsContact O-CB 3.31Å; N55-T59 WeakPolarHBondContact O-CB 3.37Å; N55-T59 PolarHBondContact O-N 3.07Å; N55-T59 PolarHBondContact O-OG1 3.24Å; N55-R439 PolarHBondContact OD1-O 2.99Å
56V98.2Very high96.2Very high13 Ų1337.8 Ų37.88%0.07922%0.216CC..Hα-helixtrans-63.4-45.1171.9174.80000110.5H52 I53 Y54 T59 A60 A116 A120H52-V56 WeakPolarHBondContact O-CG2 3.42Å; H52-V56 PolarHBondContact O-N 3.21Å; I53-V56 PolarHBondContact O-N 3.17Å; Y54-V56 VanDerWaalsContact C-N 3.35Å; Y54-V56 PolarHBondContact O-N 3.32Å; V56-T59 PolarHBondContact O-N 3.49Å; V56-A60 WeakPolarHBondContact O-CB 3.49Å; V56-A60 PolarHBondContact O-N 3.15Å; V56-A116 HydrophobicContact CG1-CB 3.89Å; V56-A120 WeakPolarHBondContact CG2-O 3.37Å
57I98.3Very high96.7Very high21 Ų2134.6 Ų34.611%0.10820%0.198CC..Hα-helixtrans-63.2-44.8177.3-66.6167.7000110.8L33 L36 I37 L48 I53 Y54 T59 A60 H61L33-I57 HydrophobicContact CB-CG2 4.09Å; L33-I57 HydrophobicContact CD2-CG2 4.02Å; L36-I57 HydrophobicContact CB-CD1 4.5Å; L36-I57 HydrophobicContact CB-CG2 4.29Å; L36-I57 HydrophobicContact CD1-CD1 4.26Å; I37-I57 HydrophobicContact CD1-CG2 4.13Å; I37-I57 HydrophobicContact CG1-CG2 3.73Å; L48-I57 HydrophobicContact CD1-CD1 3.86Å; L48-I57 HydrophobicContact CD2-CD1 4.46Å; I53-I57 HydrophobicContact CG2-CD1 3.87Å; I53-I57 HydrophobicContact CG2-CG1 4.38Å; I53-I57 VanDerWaalsContact O-CG1 3.31Å; I53-I57 WeakPolarHBondContact O-CG1 3.38Å; I53-I57 PolarHBondContact O-N 2.98Å; Y54-I57 PolarHBondContact O-N 3.47Å; I57-T59 VanDerWaalsContact C-N 3.32Å; I57-T59 PolarHBondContact O-N 3.13Å; I57-A60 PolarHBondContact O-N 3.04Å; I57-H61 VanDerWaalsContact O-CB 3.3Å; I57-H61 WeakPolarHBondContact O-CB 3.42Å; I57-H61 PolarHBondContact O-N 2.77Å
58V98.3Very high96.9Very high28 Ų2829.4 Ų29.417%0.1717%0.171CC..Hα-helixtrans-59.6-43.7176.1171.10000111.1I37 Y54 N55 A62I37-V58 HydrophobicContact CD1-CB 4.33Å; I37-V58 HydrophobicContact CD1-CG2 3.79Å; I37-V58 HydrophobicContact CG1-CG2 3.88Å; I37-V58 HydrophobicContact CG2-CG2 4.38Å; Y54-V58 HydrophobicContact CD1-CG2 4.13Å; Y54-V58 HydrophobicContact CD2-CG2 4.42Å; Y54-V58 HydrophobicContact CE1-CG2 3.75Å; Y54-V58 HydrophobicContact CE2-CG2 4.07Å; Y54-V58 HydrophobicContact CG-CG2 4.46Å; Y54-V58 VanDerWaalsContact O-CG2 3.3Å; Y54-V58 WeakPolarHBondContact O-CG2 3.16Å; Y54-V58 PolarHBondContact O-N 3.36Å; N55-V58 PolarHBondContact O-N 3.15Å; V58-A62 PolarHBondContact O-N 3.48Å
59T98.1Very high97.2Very high3 Ų327.1 Ų27.12%0.01816%0.159CC..Hα-helixtrans-64.6-48.7178.5-57.60000111.1N55 V56 I57 A62 F63 A122 G125N55-T59 VanDerWaalsContact O-CB 3.31Å; N55-T59 WeakPolarHBondContact O-CB 3.37Å; N55-T59 PolarHBondContact O-N 3.07Å; N55-T59 PolarHBondContact O-OG1 3.24Å; V56-T59 PolarHBondContact O-N 3.49Å; I57-T59 VanDerWaalsContact C-N 3.32Å; I57-T59 PolarHBondContact O-N 3.13Å; T59-A62 PolarHBondContact O-N 3.24Å; T59-F63 HydrophobicContact CG2-CD2 3.75Å; T59-F63 HydrophobicContact CG2-CE2 3.5Å; T59-F63 VanDerWaalsContact O-CD2 3.29Å; T59-F63 WeakPolarHBondContact O-CD2 3.29Å; T59-F63 PolarHBondContact O-N 2.71Å; T59-F63 VanDerWaalsContact O-N 3.13Å; T59-A122 WeakPolarHBondContact CB-O 3.37Å; T59-A122 WeakPolarHBondContact CG2-O 3.46Å; T59-A122 PolarHBondContact OG1-O 3.49Å; T59-G125 WeakPolarHBondContact OG1-CA 3.28Å; T59-G125 PolarHBondContact OG1-N 3.39Å
60A98.4Very high97.4Very high9 Ų924.5 Ų24.57%0.07413%0.131CC..Hα-helixtrans-62.8-43.6178.100000112.1L33 V56 I57 A62 F63 V64L33-A60 HydrophobicContact CD1-CB 3.85Å; V56-A60 WeakPolarHBondContact O-CB 3.49Å; V56-A60 PolarHBondContact O-N 3.15Å; I57-A60 PolarHBondContact O-N 3.04Å; A60-A62 VanDerWaalsContact C-N 3.35Å; A60-A62 PolarHBondContact O-N 3.15Å; A60-F63 PolarHBondContact O-N 2.89Å; A60-V64 VanDerWaalsContact O-CB 3.31Å; A60-V64 WeakPolarHBondContact O-CB 3.39Å; A60-V64 WeakPolarHBondContact O-CG2 3.38Å; A60-V64 PolarHBondContact O-N 2.82Å
61H98.2Very high97.5Very high25 Ų2521.5 Ų21.512%0.11612%0.115CC..Hα-helixtrans-54.7-51.1176.716969.1000111.2G30 L33 S34 I37 I57 V64 M65G30-H61 PolarHBondContact O-ND1 3.01Å; L33-H61 HydrophobicContact CB-CB 3.86Å; L33-H61 HydrophobicContact CD1-CB 4.46Å; S34-H61 VanDerWaalsContact CB-CE1 3.47Å; S34-H61 WeakPolarHBondContact CB-CE1 3.29Å; I37-H61 HydrophobicContact CD1-CB 3.9Å; I57-H61 VanDerWaalsContact O-CB 3.3Å; I57-H61 WeakPolarHBondContact O-CB 3.42Å; I57-H61 PolarHBondContact O-N 2.77Å; H61-V64 PolarHBondContact O-N 2.59Å; H61-M65 VanDerWaalsContact CE1-CG 3.45Å; H61-M65 WeakPolarHBondContact CE1-CG 3.18Å; H61-M65 WeakPolarHBondContact O-CB 3.48Å; H61-M65 WeakPolarHBondContact O-CG 3.49Å; H61-M65 PolarHBondContact O-N 3.08Å
62A97.6Very high97.7Very high19 Ų1918 Ų1816%0.15710%0.096CC..Hα-helixtrans-61.9-47.1-178.700000112V58 T59 A60 M65 I66 W126V58-A62 PolarHBondContact O-N 3.48Å; T59-A62 PolarHBondContact O-N 3.24Å; A60-A62 VanDerWaalsContact C-N 3.35Å; A60-A62 PolarHBondContact O-N 3.15Å; A62-M65 PolarHBondContact O-N 3.23Å; A62-I66 WeakPolarHBondContact O-CB 3.4Å; A62-I66 WeakPolarHBondContact O-CG1 3.27Å; A62-I66 PolarHBondContact O-N 2.9Å; A62-W126 HydrophobicContact CB-CB 3.59Å; A62-W126 HydrophobicContact CB-CG 4.03Å
63F98.3Very high97.8Very high1 Ų116 Ų160%0.0049%0.087CC..Hα-helixtrans-64.2-45.3178.4-75.9-52.5000112.8T59 A60 M65 I66 F67 F68 L112 W126 V128 T146 L150T59-F63 HydrophobicContact CG2-CD2 3.75Å; T59-F63 HydrophobicContact CG2-CE2 3.5Å; T59-F63 VanDerWaalsContact O-CD2 3.29Å; T59-F63 WeakPolarHBondContact O-CD2 3.29Å; T59-F63 PolarHBondContact O-N 2.71Å; T59-F63 VanDerWaalsContact O-N 3.13Å; A60-F63 PolarHBondContact O-N 2.89Å; F63-M65 PolarHBondContact O-N 3.46Å; F63-I66 PolarHBondContact O-N 3.16Å; F63-F67 AromaticContact CD1-CD2 3.72Å; F63-F67 HydrophobicContact CD1-CD2 3.72Å; F63-F67 AromaticContact CD1-CE2 3.66Å; F63-F67 HydrophobicContact CD1-CE2 3.66Å; F63-F67 HydrophobicContact CE1-CD2 4.49Å; F63-F67 HydrophobicContact CE1-CE2 4.01Å; F63-F67 PolarHBondContact O-N 3.44Å; F63-F68 WeakPolarHBondContact O-CD2 3.41Å; F63-L112 HydrophobicContact CB-CD1 4.02Å; F63-L112 HydrophobicContact CB-CD2 3.58Å; F63-L112 HydrophobicContact CB-CG 4.47Å; F63-L112 HydrophobicContact CD2-CD1 3.9Å; F63-L112 HydrophobicContact CG-CD1 4.21Å; F63-W126 HydrophobicContact CD1-CB 4.46Å; F63-W126 HydrophobicContact CE1-CB 4.17Å; F63-W126 WeakPolarHBondContact CE1-O 3.35Å; F63-W126 HydrophobicContact CE2-CB 4.42Å; F63-W126 HydrophobicContact CZ-CB 4.16Å; F63-W126 WeakPolarHBondContact CZ-O 3.37Å; F63-V128 HydrophobicContact CE2-CG2 4.2Å; F63-V128 HydrophobicContact CZ-CG2 3.63Å; F63-T146 HydrophobicContact CD2-CG2 4.22Å; F63-T146 HydrophobicContact CE2-CG2 3.59Å; F63-T146 HydrophobicContact CZ-CG2 3.96Å; F63-L150 HydrophobicContact CD1-CD2 3.79Å; F63-L150 HydrophobicContact CE1-CD1 3.76Å; F63-L150 HydrophobicContact CE1-CD2 3.74Å; F63-L150 HydrophobicContact CE1-CG 4.27Å; F63-L150 HydrophobicContact CZ-CD1 3.93Å
64V98.6Very high97.8Very high0 Ų012.4 Ų12.40%07%0.069CC..Iπ-helixtrans-59.5-47.5178171.90000110.8A26 L33 A60 H61 F68 M69 L109 L112A26-V64 HydrophobicContact CB-CG1 4.27Å; A26-V64 WeakPolarHBondContact O-CG1 3.48Å; L33-V64 HydrophobicContact CD1-CG2 4.41Å; A60-V64 VanDerWaalsContact O-CB 3.31Å; A60-V64 WeakPolarHBondContact O-CB 3.39Å; A60-V64 WeakPolarHBondContact O-CG2 3.38Å; A60-V64 PolarHBondContact O-N 2.82Å; H61-V64 PolarHBondContact O-N 2.59Å; V64-F68 CarbonylContact O-C 3.28Å; V64-F68 WeakPolarHBondContact O-CA 3.31Å; V64-F68 WeakPolarHBondContact O-CB 3.28Å; V64-F68 PolarHBondContact O-N 3.34Å; V64-F68 VanDerWaalsContact O-N 3.12Å; V64-M69 PolarHBondContact O-N 2.99Å; V64-L109 HydrophobicContact CG2-CD1 4.2Å; V64-L112 HydrophobicContact CG2-CD2 3.78Å
65M97.9Very high97.7Very high33 Ų3313 Ų1316%0.1637%0.072CC..Iπ-helixtrans-67.3-42.4-178-67.8-61.6-71.800112.5H61 A62 F63 M69 V70H61-M65 VanDerWaalsContact CE1-CG 3.45Å; H61-M65 WeakPolarHBondContact CE1-CG 3.18Å; H61-M65 WeakPolarHBondContact O-CB 3.48Å; H61-M65 WeakPolarHBondContact O-CG 3.49Å; H61-M65 PolarHBondContact O-N 3.08Å; A62-M65 PolarHBondContact O-N 3.23Å; F63-M65 PolarHBondContact O-N 3.46Å; M65-M69 HydrophobicContact CE-SD 3.43Å; M65-M69 WeakPolarHBondContact CE-SD 3.18Å; M65-M69 WeakPolarHBondContact O-CB 3.3Å; M65-M69 HydrophobicContact SD-SD 3.92Å; M65-V70 WeakPolarHBondContact O-CG2 3.48Å; M65-V70 PolarHBondContact O-N 3.33Å
66I95.8Very high97.7Very high6 Ų611.3 Ų11.33%0.0316%0.064CC..Iπ-helixtrans-75.8-59.8-176.7-67.1170.1000111A62 F63 M71 W126 L246 L381A62-I66 WeakPolarHBondContact O-CB 3.4Å; A62-I66 WeakPolarHBondContact O-CG1 3.27Å; A62-I66 PolarHBondContact O-N 2.9Å; F63-I66 PolarHBondContact O-N 3.16Å; I66-M71 HydrophobicContact CG2-CE 4.39Å; I66-M71 PolarHBondContact O-N 2.96Å; I66-W126 HydrophobicContact CD1-CE3 4.18Å; I66-W126 HydrophobicContact CD1-CZ3 4.31Å; I66-L246 HydrophobicContact CG1-CD1 4.35Å; I66-L246 HydrophobicContact CG2-CD1 3.77Å; I66-L246 HydrophobicContact CG2-CD2 4.12Å; I66-L381 HydrophobicContact CG1-CD2 4.11Å
67F97.3Very high97.7Very high12 Ų1210.7 Ų10.75%0.0536%0.061CC..Iπ-helixtrans-87.2-23.6-167.8-65.3-88.5000113.8F63 M71 P72 L150 F238F63-F67 AromaticContact CD1-CD2 3.72Å; F63-F67 HydrophobicContact CD1-CD2 3.72Å; F63-F67 AromaticContact CD1-CE2 3.66Å; F63-F67 HydrophobicContact CD1-CE2 3.66Å; F63-F67 HydrophobicContact CE1-CD2 4.49Å; F63-F67 HydrophobicContact CE1-CE2 4.01Å; F63-F67 PolarHBondContact O-N 3.44Å; F67-M71 HydrophobicContact CB-CE 4.16Å; F67-M71 HydrophobicContact CD1-CE 3.1Å; F67-M71 HydrophobicContact CE1-CE 3.56Å; F67-M71 HydrophobicContact CG-CE 3.79Å; F67-P72 WeakPolarHBondContact O-CD 3.47Å; F67-P72 WeakPolarHBondContact O-CG 3.37Å; F67-L150 HydrophobicContact CD1-CD2 4.37Å; F67-L150 HydrophobicContact CD2-CD2 4.06Å; F67-L150 HydrophobicContact CE1-CD2 4.36Å; F67-L150 HydrophobicContact CE2-CD2 4.01Å; F67-L150 HydrophobicContact CG-CD2 4.26Å; F67-L150 HydrophobicContact CZ-CD2 4.17Å; F67-F238 HydrophobicContact CE1-CZ 4.08Å; F67-F238 HydrophobicContact CZ-CE1 4.29Å; F67-F238 HydrophobicContact CZ-CZ 4.02Å
68F98.4Very high97.7Very high0 Ų09.8 Ų9.80%06%0.056CC..Iπ-helixtrans-115.1-18.3-172.9-59.9-79.3000114.1F22 G23 A26 F63 V64 P72 S108 L109 L112 A153F22-F68 HydrophobicContact CE1-CB 4.15Å; F22-F68 AromaticContact CE1-CD1 3.9Å; F22-F68 HydrophobicContact CE1-CD1 3.9Å; F22-F68 HydrophobicContact CZ-CB 4.48Å; F22-F68 AromaticContact CZ-CD1 3.76Å; F22-F68 HydrophobicContact CZ-CD1 3.76Å; G23-F68 WeakPolarHBondContact CA-O 3.27Å; A26-F68 HydrophobicContact CB-CB 3.86Å; A26-F68 VanDerWaalsContact CB-O 3.32Å; A26-F68 WeakPolarHBondContact CB-O 3.37Å; F63-F68 WeakPolarHBondContact O-CD2 3.41Å; V64-F68 CarbonylContact O-C 3.28Å; V64-F68 WeakPolarHBondContact O-CA 3.31Å; V64-F68 WeakPolarHBondContact O-CB 3.28Å; V64-F68 PolarHBondContact O-N 3.34Å; V64-F68 VanDerWaalsContact O-N 3.12Å; F68-P72 WeakPolarHBondContact O-CG 3.29Å; F68-S108 VanDerWaalsContact CE1-OG 3.3Å; F68-S108 WeakPolarHBondContact CE1-OG 3.5Å; F68-S108 WeakPolarHBondContact CZ-OG 3.31Å; F68-L109 HydrophobicContact CB-CD1 4.25Å; F68-L109 HydrophobicContact CD1-CB 3.72Å; F68-L109 HydrophobicContact CD1-CD1 4.11Å; F68-L109 HydrophobicContact CD1-CG 4.34Å; F68-L109 HydrophobicContact CD2-CD1 4.05Å; F68-L109 HydrophobicContact CE1-CB 3.68Å; F68-L109 HydrophobicContact CE1-CD1 4.46Å; F68-L109 VanDerWaalsContact CE1-N 3.33Å; F68-L109 HydrophobicContact CE2-CD1 4.42Å; F68-L109 HydrophobicContact CG-CB 4.35Å; F68-L109 HydrophobicContact CG-CD1 3.85Å; F68-L109 HydrophobicContact CZ-CB 4.31Å; F68-L112 HydrophobicContact CD2-CD2 3.98Å; F68-L112 HydrophobicContact CE2-CB 4.45Å; F68-L112 HydrophobicContact CE2-CD2 3.62Å; F68-A153 HydrophobicContact CZ-CB 4.48Å
69M97.9Very high97.7Very high14 Ų148.4 Ų8.47%0.0695%0.048CC..Iπ-helixtrans-105.6-70.3172-179.2-138.9174.100111.9V64 M65 P72 I73 V386V64-M69 PolarHBondContact O-N 2.99Å; M65-M69 HydrophobicContact CE-SD 3.43Å; M65-M69 WeakPolarHBondContact CE-SD 3.18Å; M65-M69 WeakPolarHBondContact O-CB 3.3Å; M65-M69 HydrophobicContact SD-SD 3.92Å; M69-P72 WeakPolarHBondContact O-CD 3.36Å; M69-I73 HydrophobicContact CE-CD1 4.26Å; M69-I73 HydrophobicContact CG-CD1 3.88Å; M69-I73 WeakPolarHBondContact O-CB 3.4Å; M69-I73 VanDerWaalsContact O-CG1 3.25Å; M69-I73 WeakPolarHBondContact O-CG1 3.39Å; M69-I73 PolarHBondContact O-N 3.3Å; M69-V386 HydrophobicContact CE-CG1 4.3Å; M69-V386 HydrophobicContact CE-CG2 4.13Å
70V97.7Very high97.7Very high4 Ų48.3 Ų8.32%0.0245%0.047CC..Iπ-helixtrans-64.3-51.9-167.7174.20000111.8M65 I73 M74 L246 A385M65-V70 WeakPolarHBondContact O-CG2 3.48Å; M65-V70 PolarHBondContact O-N 3.33Å; V70-I73 PolarHBondContact O-N 3.33Å; V70-M74 HydrophobicContact CG1-CE 4.1Å; V70-M74 HydrophobicContact CG1-CG 4.36Å; V70-M74 WeakPolarHBondContact O-CB 3.48Å; V70-M74 WeakPolarHBondContact O-CG 3.34Å; V70-M74 PolarHBondContact O-N 3.34Å; V70-L246 HydrophobicContact CB-CD2 4.13Å; V70-L246 HydrophobicContact CG1-CB 4.3Å; V70-L246 HydrophobicContact CG1-CD2 3.72Å; V70-A385 HydrophobicContact CG1-CB 3.78Å; V70-A385 HydrophobicContact CG2-CB 4.49Å
71M96.4Very high97.7Very high9 Ų98.5 Ų8.54%0.0445%0.046CC..Hα-helixtrans-59.2-52.4178.6-94.7-160.9-80.400112.7I66 F67 I73 M74 I75 G76 L195 E242 I245 L246I66-M71 HydrophobicContact CG2-CE 4.39Å; I66-M71 PolarHBondContact O-N 2.96Å; F67-M71 HydrophobicContact CB-CE 4.16Å; F67-M71 HydrophobicContact CD1-CE 3.1Å; F67-M71 HydrophobicContact CE1-CE 3.56Å; F67-M71 HydrophobicContact CG-CE 3.79Å; M71-I73 PolarHBondContact O-N 3.04Å; M71-M74 PolarHBondContact O-N 3.02Å; M71-I75 PolarHBondContact O-N 2.61Å; M71-G76 PolarHBondContact O-N 3.44Å; M71-L195 HydrophobicContact SD-CD2 4.26Å; M71-E242 WeakPolarHBondContact CE-OE1 3.38Å; M71-I245 HydrophobicContact SD-CG2 4.48Å; M71-L246 HydrophobicContact CG-CD2 3.63Å
72P98.3Very high97.7Very high4 Ų47.3 Ų7.33%0.0264%0.04CC..Iπ-helixtrans-58-41.7177.5-33.842.8000113.7Y19 F22 F67 F68 M69 G76 G77 L105Y19-P72 HydrophobicContact CD1-CB 4.03Å; F22-P72 HydrophobicContact CD1-CB 4.23Å; F22-P72 HydrophobicContact CD1-CG 4.39Å; F22-P72 HydrophobicContact CE1-CG 4.33Å; F67-P72 WeakPolarHBondContact O-CD 3.47Å; F67-P72 WeakPolarHBondContact O-CG 3.37Å; F68-P72 WeakPolarHBondContact O-CG 3.29Å; M69-P72 WeakPolarHBondContact O-CD 3.36Å; P72-G76 CarbonylContact O-C 3.6Å; P72-G76 VanDerWaalsContact O-C 3.28Å; P72-G76 WeakPolarHBondContact O-CA 3.49Å; P72-G76 PolarHBondContact O-N 3.17Å; P72-G76 VanDerWaalsContact O-N 3.12Å; P72-G77 PolarHBondContact O-N 3.44Å; P72-L105 HydrophobicContact CB-CD1 4.1Å; P72-L105 HydrophobicContact CG-CD1 3.72Å
73I98.6Very high97.7Very high13 Ų136.4 Ų6.47%0.0673%0.033CC..Iπ-helixtrans-69.7-49.9179.9-67.5174.8000111.1L20 M69 V70 M71 G77 F78 I389L20-I73 HydrophobicContact CD2-CG2 3.93Å; M69-I73 HydrophobicContact CE-CD1 4.26Å; M69-I73 HydrophobicContact CG-CD1 3.88Å; M69-I73 WeakPolarHBondContact O-CB 3.4Å; M69-I73 VanDerWaalsContact O-CG1 3.25Å; M69-I73 WeakPolarHBondContact O-CG1 3.39Å; M69-I73 PolarHBondContact O-N 3.3Å; V70-I73 PolarHBondContact O-N 3.33Å; M71-I73 PolarHBondContact O-N 3.04Å; I73-G77 VanDerWaalsContact O-CA 3.31Å; I73-G77 WeakPolarHBondContact O-CA 3.46Å; I73-G77 PolarHBondContact O-N 3.36Å; I73-F78 HydrophobicContact CG2-CD2 4.01Å; I73-F78 HydrophobicContact CG2-CE2 3.77Å; I73-F78 WeakPolarHBondContact O-CD2 3.44Å; I73-F78 PolarHBondContact O-N 3.44Å; I73-I389 HydrophobicContact CB-CD1 4.15Å; I73-I389 HydrophobicContact CG2-CB 4.37Å; I73-I389 HydrophobicContact CG2-CD1 3.9Å; I73-I389 HydrophobicContact CG2-CG1 3.81Å; I73-I389 HydrophobicContact CG2-CG2 3.69Å
74M96.6Very high97.6Very high1 Ų16.3 Ų6.31%0.0053%0.032CC..Iπ-helixtrans-73.6-47.6-171.1-71.3-134.4-60.100113.6V70 M71 G79 L246 P249 M253 A385 I389V70-M74 HydrophobicContact CG1-CE 4.1Å; V70-M74 HydrophobicContact CG1-CG 4.36Å; V70-M74 WeakPolarHBondContact O-CB 3.48Å; V70-M74 WeakPolarHBondContact O-CG 3.34Å; V70-M74 PolarHBondContact O-N 3.34Å; M71-M74 PolarHBondContact O-N 3.02Å; M74-G79 PolarHBondContact O-N 2.94Å; M74-L246 WeakPolarHBondContact CE-O 3.44Å; M74-P249 HydrophobicContact CB-CB 4.05Å; M74-P249 HydrophobicContact CB-CG 4.29Å; M74-P249 HydrophobicContact CE-CB 4.06Å; M74-P249 HydrophobicContact CE-CG 4.07Å; M74-P249 HydrophobicContact SD-CB 4.08Å; M74-M253 HydrophobicContact CG-CE 4.09Å; M74-M253 HydrophobicContact SD-CE 3.52Å; M74-M253 VanDerWaalsContact SD-CE 3.52Å; M74-A385 HydrophobicContact CE-CB 4.34Å; M74-I389 HydrophobicContact CG-CD1 3.74Å; M74-I389 HydrophobicContact CG-CG1 3.59Å; M74-I389 HydrophobicContact SD-CD1 4.48Å; M74-I389 HydrophobicContact SD-CG1 4.09Å
75I95.8Very high97.5Very high18 Ų186.4 Ų6.49%0.0923%0.033CC..Iπ-helixtrans-93.8-49.5-176.7-58.7173.9000109.5M71 G79 F164 T191 L195 I245 P249M71-I75 PolarHBondContact O-N 2.61Å; I75-G79 WeakPolarHBondContact O-CA 3.37Å; I75-G79 PolarHBondContact O-N 3.1Å; I75-F164 HydrophobicContact CG2-CD2 4.09Å; I75-F164 HydrophobicContact CG2-CE2 3.62Å; I75-F164 HydrophobicContact CG2-CZ 4.41Å; I75-F164 VanDerWaalsContact O-CZ 3.31Å; I75-F164 WeakPolarHBondContact O-CZ 3.42Å; I75-T191 HydrophobicContact CD1-CG2 3.31Å; I75-T191 HydrophobicContact CG1-CG2 4.05Å; I75-L195 HydrophobicContact CD1-CD1 3.75Å; I75-I245 HydrophobicContact CD1-CG2 3.82Å; I75-P249 HydrophobicContact CG1-CG 3.99Å
76G97Very high97.4Very high5 Ų54.9 Ų4.95%0.0523%0.025CC..Iπ-helixtrans-66.9-47.8-179.800000112.9Y19 M71 P72 N80Y19-G76 VanDerWaalsContact CB-C 3.42Å; Y19-G76 VanDerWaalsContact CD2-O 3.29Å; Y19-G76 WeakPolarHBondContact CD2-O 3.34Å; Y19-G76 VanDerWaalsContact CG-C 3.44Å; Y19-G76 VanDerWaalsContact CG-CA 3.47Å; M71-G76 PolarHBondContact O-N 3.44Å; P72-G76 CarbonylContact O-C 3.6Å; P72-G76 VanDerWaalsContact O-C 3.28Å; P72-G76 WeakPolarHBondContact O-CA 3.49Å; P72-G76 PolarHBondContact O-N 3.17Å; P72-G76 VanDerWaalsContact O-N 3.12Å; G76-N80 WeakPolarHBondContact O-CB 3.18Å; G76-N80 PolarHBondContact O-ND2 2.97Å
77G98.2Very high97.3Very high0 Ų04.6 Ų4.60%02%0.024CC..Iπ-helixtrans-80.7-72.3-174.700000112.3G16 P72 I73 G79 N80 W81G16-G77 WeakPolarHBondContact O-CA 3.48Å; P72-G77 PolarHBondContact O-N 3.44Å; I73-G77 VanDerWaalsContact O-CA 3.31Å; I73-G77 WeakPolarHBondContact O-CA 3.46Å; I73-G77 PolarHBondContact O-N 3.36Å; G77-G79 VanDerWaalsContact C-N 3.35Å; G77-G79 PolarHBondContact O-N 3.15Å; G77-N80 PolarHBondContact O-N 3.3Å; G77-W81 WeakPolarHBondContact O-CB 3.15Å; G77-W81 PolarHBondContact O-N 3.27Å
78F98.6Very high97.1Very high1 Ų14.2 Ų4.20%0.0042%0.023CC..Iπ-helixtrans-62.2-40.6-180-73.1-73.2000112.2L20 I73 W81 L82 F184 M253 I389 F393 W396 F400L20-F78 HydrophobicContact CD2-CE2 4.43Å; I73-F78 HydrophobicContact CG2-CD2 4.01Å; I73-F78 HydrophobicContact CG2-CE2 3.77Å; I73-F78 WeakPolarHBondContact O-CD2 3.44Å; I73-F78 PolarHBondContact O-N 3.44Å; F78-W81 PolarHBondContact O-N 3.09Å; F78-L82 HydrophobicContact CB-CD1 4.28Å; F78-L82 HydrophobicContact CD1-CD1 3.9Å; F78-L82 VanDerWaalsContact O-CB 3.23Å; F78-L82 WeakPolarHBondContact O-CB 3.31Å; F78-L82 WeakPolarHBondContact O-CG 3.24Å; F78-L82 PolarHBondContact O-N 3.26Å; F78-F184 HydrophobicContact CB-CE2 4.35Å; F78-F184 HydrophobicContact CB-CZ 3.77Å; F78-M253 HydrophobicContact CB-SD 4.41Å; F78-M253 HydrophobicContact CD1-SD 4.06Å; F78-M253 HydrophobicContact CD2-CE 4.17Å; F78-M253 HydrophobicContact CD2-SD 3.68Å; F78-M253 HydrophobicContact CE1-SD 4.23Å; F78-M253 HydrophobicContact CE2-CE 4.44Å; F78-M253 HydrophobicContact CE2-SD 3.86Å; F78-M253 HydrophobicContact CG-SD 3.79Å; F78-M253 HydrophobicContact CZ-SD 4.14Å; F78-I389 HydrophobicContact CE2-CG2 4.46Å; F78-F393 HydrophobicContact CZ-CB 4.34Å; F78-W396 AromaticContact CD1-CE3 3.97Å; F78-W396 HydrophobicContact CD1-CE3 3.97Å; F78-W396 AromaticContact CE1-CE3 3.69Å; F78-W396 HydrophobicContact CE1-CE3 3.69Å; F78-W396 HydrophobicContact CE1-CZ3 4.41Å; F78-F400 HydrophobicContact CD1-CE2 4.17Å; F78-F400 AromaticContact CD1-CZ 3.81Å; F78-F400 HydrophobicContact CD1-CZ 3.81Å; F78-F400 AromaticContact CE1-CE2 3.68Å; F78-F400 HydrophobicContact CE1-CE2 3.68Å; F78-F400 AromaticContact CE1-CZ 3.75Å; F78-F400 HydrophobicContact CE1-CZ 3.75Å; F78-F400 HydrophobicContact CZ-CE2 4.48Å
79G98.3Very high96.9Very high0 Ų04.2 Ų4.20%02%0.023CC..Iπ-helixtrans-59.2-51.5177.900000112.2M74 I75 G77 W81 V83 F164M74-G79 PolarHBondContact O-N 2.94Å; I75-G79 WeakPolarHBondContact O-CA 3.37Å; I75-G79 PolarHBondContact O-N 3.1Å; G77-G79 VanDerWaalsContact C-N 3.35Å; G77-G79 PolarHBondContact O-N 3.15Å; G79-W81 PolarHBondContact O-N 3.15Å; G79-V83 WeakPolarHBondContact O-CB 3.47Å; G79-V83 VanDerWaalsContact O-CG2 3.29Å; G79-V83 WeakPolarHBondContact O-CG2 3.09Å; G79-V83 PolarHBondContact O-N 3.39Å; G79-F164 VanDerWaalsContact C-CE1 3.45Å
80N98.3Very high96.7Very high1 Ų16.2 Ų6.21%0.0054%0.037CC..Hα-helixtrans-65.6-38.8179.1-82.5-67.9000113H12 G76 G77 P84 N98H12-N80 PolarHBondContact ND1-O 2.97Å; G76-N80 WeakPolarHBondContact O-CB 3.18Å; G76-N80 PolarHBondContact O-ND2 2.97Å; G77-N80 PolarHBondContact O-N 3.3Å; N80-P84 WeakPolarHBondContact O-CD 3.25Å; N80-N98 PolarHBondContact OD1-ND2 3.23Å; N80-N98 PolarHBondContact OD1-OD1 3.08Å
81W97.8Very high96.6Very high12 Ų127 Ų75%0.0454%0.041CC..Hα-helixtrans-66.3-50.5177.2-9799000112.5K13 T17 G77 F78 G79 L85 F400 P500K13-W81 HydrophobicContact CB-CD2 4.13Å; K13-W81 HydrophobicContact CB-CE3 4.07Å; K13-W81 HydrophobicContact CB-CH2 3.77Å; K13-W81 HydrophobicContact CB-CZ2 3.79Å; K13-W81 HydrophobicContact CB-CZ3 3.9Å; K13-W81 HydrophobicContact CD-CE3 4.34Å; K13-W81 HydrophobicContact CD-CH2 4.22Å; K13-W81 HydrophobicContact CD-CZ3 3.83Å; K13-W81 HydrophobicContact CG-CD2 4.34Å; K13-W81 HydrophobicContact CG-CE3 3.89Å; K13-W81 HydrophobicContact CG-CH2 4.2Å; K13-W81 HydrophobicContact CG-CZ3 3.82Å; K13-W81 PolarHBondContact O-NE1 3.14Å; K13-W81 VanDerWaalsContact O-NE1 3.13Å; T17-W81 VanDerWaalsContact OG1-CZ2 3.31Å; T17-W81 WeakPolarHBondContact OG1-CZ2 3.42Å; T17-W81 PolarHBondContact OG1-NE1 3.36Å; T17-W81 VanDerWaalsContact OG1-NE1 3.07Å; G77-W81 WeakPolarHBondContact O-CB 3.15Å; G77-W81 PolarHBondContact O-N 3.27Å; F78-W81 PolarHBondContact O-N 3.09Å; G79-W81 PolarHBondContact O-N 3.15Å; W81-L85 HydrophobicContact CE3-CD1 4.39Å; W81-L85 VanDerWaalsContact O-CD1 3.28Å; W81-L85 WeakPolarHBondContact O-CD1 3.34Å; W81-L85 VanDerWaalsContact O-CG 3.29Å; W81-L85 WeakPolarHBondContact O-CG 3.4Å; W81-F400 HydrophobicContact CB-CD1 4.48Å; W81-F400 HydrophobicContact CB-CE1 3.78Å; W81-F400 HydrophobicContact CB-CZ 4.32Å; W81-F400 AromaticContact CD2-CD1 3.59Å; W81-F400 HydrophobicContact CD2-CD1 3.59Å; W81-F400 AromaticContact CD2-CE1 3.8Å; W81-F400 HydrophobicContact CD2-CE1 3.8Å; W81-F400 AromaticContact CE2-CD1 3.97Å; W81-F400 AromaticContact CE3-CD1 3.64Å; W81-F400 HydrophobicContact CE3-CD1 3.64Å; W81-F400 AromaticContact CE3-CE1 3.96Å; W81-F400 HydrophobicContact CE3-CE1 3.96Å; W81-F400 AromaticContact CG-CD1 3.99Å; W81-F400 HydrophobicContact CG-CD1 3.99Å; W81-F400 AromaticContact CG-CE1 3.74Å; W81-F400 HydrophobicContact CG-CE1 3.74Å; W81-F400 HydrophobicContact CG-CZ 4.42Å; W81-F400 HydrophobicContact CH2-CD1 4.37Å; W81-F400 HydrophobicContact CZ2-CB 4.45Å; W81-F400 HydrophobicContact CZ2-CD1 4.35Å; W81-F400 HydrophobicContact CZ3-CD1 4.04Å; W81-P500 HydrophobicContact CZ3-CG 4.42Å
82L98.1Very high96.6Very high0 Ų06.7 Ų6.70%04%0.04CC..Hα-helixtrans-94.3-32-163.9-59.3177.6000113.3F78 L85 M86 F184 W396 L399 F400F78-L82 HydrophobicContact CB-CD1 4.28Å; F78-L82 HydrophobicContact CD1-CD1 3.9Å; F78-L82 VanDerWaalsContact O-CB 3.23Å; F78-L82 WeakPolarHBondContact O-CB 3.31Å; F78-L82 WeakPolarHBondContact O-CG 3.24Å; F78-L82 PolarHBondContact O-N 3.26Å; L82-L85 PolarHBondContact O-N 3.03Å; L82-M86 HydrophobicContact CB-CE 4.05Å; L82-M86 HydrophobicContact CB-CG 4.46Å; L82-M86 HydrophobicContact CB-SD 4.08Å; L82-M86 HydrophobicContact CD1-CE 4.02Å; L82-M86 HydrophobicContact CD2-CE 4.33Å; L82-M86 HydrophobicContact CG-CE 4.37Å; L82-M86 VanDerWaalsContact O-CB 3.25Å; L82-M86 WeakPolarHBondContact O-CB 3.31Å; L82-M86 VanDerWaalsContact O-CG 3.27Å; L82-M86 WeakPolarHBondContact O-CG 3.32Å; L82-M86 PolarHBondContact O-N 3.18Å; L82-F184 HydrophobicContact CB-CD1 4.04Å; L82-F184 HydrophobicContact CB-CE1 3.72Å; L82-F184 HydrophobicContact CD1-CD1 4.31Å; L82-F184 HydrophobicContact CD1-CE1 4.03Å; L82-F184 HydrophobicContact CD1-CZ 4.29Å; L82-F184 HydrophobicContact CG-CE1 4.45Å; L82-W396 HydrophobicContact CD1-CD2 3.78Å; L82-W396 HydrophobicContact CD1-CE3 3.97Å; L82-W396 HydrophobicContact CD1-CG 4.37Å; L82-W396 HydrophobicContact CD1-CH2 4.24Å; L82-W396 HydrophobicContact CD1-CZ2 3.97Å; L82-W396 HydrophobicContact CD1-CZ3 4.22Å; L82-W396 HydrophobicContact CD2-CD2 4.34Å; L82-W396 HydrophobicContact CD2-CG 4.12Å; L82-L399 HydrophobicContact CD2-CD2 3.82Å; L82-F400 HydrophobicContact CD2-CE1 4.13Å; L82-F400 HydrophobicContact CD2-CZ 4.44Å
83V98.1Very high96.6Very high0 Ų08 Ų80%05%0.051CC..Hα-helixtrans-60.6-53.8-174.7168.80000111.8G79 L85 M86 I87 F164 I168 F184 V188G79-V83 WeakPolarHBondContact O-CB 3.47Å; G79-V83 VanDerWaalsContact O-CG2 3.29Å; G79-V83 WeakPolarHBondContact O-CG2 3.09Å; G79-V83 PolarHBondContact O-N 3.39Å; V83-L85 VanDerWaalsContact C-N 3.27Å; V83-L85 PolarHBondContact O-N 3.1Å; V83-M86 PolarHBondContact O-N 2.93Å; V83-I87 HydrophobicContact CG1-CD1 4.41Å; V83-I87 WeakPolarHBondContact O-CG1 3.47Å; V83-I87 PolarHBondContact O-N 2.94Å; V83-I87 VanDerWaalsContact O-N 3.11Å; V83-F164 HydrophobicContact CB-CD1 4.39Å; V83-F164 HydrophobicContact CB-CE1 4.28Å; V83-F164 HydrophobicContact CG1-CD1 4.4Å; V83-F164 HydrophobicContact CG2-CD1 4.22Å; V83-F164 HydrophobicContact CG2-CE1 4.14Å; V83-I168 HydrophobicContact CG1-CD1 3.97Å; V83-I168 HydrophobicContact CG1-CG1 3.52Å; V83-F184 HydrophobicContact CG2-CE1 4.2Å; V83-V188 HydrophobicContact CG2-CB 4.11Å; V83-V188 HydrophobicContact CG2-CG1 4Å; V83-V188 HydrophobicContact CG2-CG2 4.12Å
84P96.8Very high96.6Very high0 Ų011.2 Ų11.20%06%0.064CC..Hα-helixtrans-60.4-38.4177.2-25.537.5000112.4H12 N80 G88 A89 M92H12-P84 HydrophobicContact CB-CG 4.24Å; N80-P84 WeakPolarHBondContact O-CD 3.25Å; P84-G88 PolarHBondContact O-N 3.37Å; P84-A89 HydrophobicContact CB-CB 4.27Å; P84-A89 PolarHBondContact O-N 3.46Å; P84-M92 HydrophobicContact CG-CG 4.04Å; P84-M92 HydrophobicContact CG-SD 3.56Å; P84-M92 VanDerWaalsContact CG-SD 3.56Å
85L95.8Very high96.6Very high1 Ų113 Ų131%0.0058%0.076CC..Hα-helixtrans-63.8-46.3178.6-68-178.2000113.1W81 L82 V83 I87 G88 L399 L492 E493 P500 T504 F505W81-L85 HydrophobicContact CE3-CD1 4.39Å; W81-L85 VanDerWaalsContact O-CD1 3.28Å; W81-L85 WeakPolarHBondContact O-CD1 3.34Å; W81-L85 VanDerWaalsContact O-CG 3.29Å; W81-L85 WeakPolarHBondContact O-CG 3.4Å; L82-L85 PolarHBondContact O-N 3.03Å; V83-L85 VanDerWaalsContact C-N 3.27Å; V83-L85 PolarHBondContact O-N 3.1Å; L85-I87 VanDerWaalsContact C-N 3.31Å; L85-I87 PolarHBondContact O-N 3.25Å; L85-G88 PolarHBondContact O-N 2.81Å; L85-L399 HydrophobicContact CD1-CD2 4.23Å; L85-L492 WeakPolarHBondContact O-CB 3.18Å; L85-E493 HydrophobicContact CB-CB 3.82Å; L85-E493 HydrophobicContact CD1-CB 4.27Å; L85-P500 HydrophobicContact CD1-CG 4.2Å; L85-T504 HydrophobicContact CD2-CG2 4.08Å; L85-F505 HydrophobicContact CD2-CE2 4.05Å
86M95.3Very high96.7Very high1 Ų122 Ų221%0.00511%0.109CC..Hα-helixtrans-75-19.6-176.8-74.2-17917500113.4L82 V83 P182 F184 V185 W396 E493L82-M86 HydrophobicContact CB-CE 4.05Å; L82-M86 HydrophobicContact CB-CG 4.46Å; L82-M86 HydrophobicContact CB-SD 4.08Å; L82-M86 HydrophobicContact CD1-CE 4.02Å; L82-M86 HydrophobicContact CD2-CE 4.33Å; L82-M86 HydrophobicContact CG-CE 4.37Å; L82-M86 VanDerWaalsContact O-CB 3.25Å; L82-M86 WeakPolarHBondContact O-CB 3.31Å; L82-M86 VanDerWaalsContact O-CG 3.27Å; L82-M86 WeakPolarHBondContact O-CG 3.32Å; L82-M86 PolarHBondContact O-N 3.18Å; V83-M86 PolarHBondContact O-N 2.93Å; M86-P182 HydrophobicContact CB-CG 4.19Å; M86-F184 HydrophobicContact CE-CD1 4.46Å; M86-F184 HydrophobicContact SD-CB 3.96Å; M86-F184 HydrophobicContact SD-CD1 3.76Å; M86-F184 HydrophobicContact SD-CG 4.25Å; M86-V185 HydrophobicContact CB-CG2 3.74Å; M86-V185 HydrophobicContact SD-CG2 4.37Å; M86-W396 HydrophobicContact CE-CZ2 3.93Å; M86-E493 HydrophobicContact CE-CG 4.41Å; M86-E493 HydrophobicContact CG-CB 4.48Å
87I95Very high96.7Very high0 Ų024.5 Ų24.50%012%0.12CC..Hα-helixtrans-101.1-3.3173.174.5-178.6000113.3V83 L85 A89 T167 K172 P173 V185V83-I87 HydrophobicContact CG1-CD1 4.41Å; V83-I87 WeakPolarHBondContact O-CG1 3.47Å; V83-I87 PolarHBondContact O-N 2.94Å; V83-I87 VanDerWaalsContact O-N 3.11Å; L85-I87 VanDerWaalsContact C-N 3.31Å; L85-I87 PolarHBondContact O-N 3.25Å; I87-A89 HydrophobicContact CD1-CB 3.85Å; I87-A89 HydrophobicContact CG1-CB 3.66Å; I87-T167 HydrophobicContact CD1-CG2 3.98Å; I87-K172 HydrophobicContact CB-CG 4.06Å; I87-K172 HydrophobicContact CD1-CG 4.32Å; I87-K172 HydrophobicContact CG2-CG 4.33Å; I87-P173 WeakPolarHBondContact O-CD 3.28Å; I87-V185 HydrophobicContact CG2-CB 4.41Å; I87-V185 HydrophobicContact CG2-CG1 3.74Å; I87-V185 HydrophobicContact CG2-CG2 3.85Å
88G93.4Very high96.7Very high4 Ų424.6 Ų24.64%0.04112%0.121CC..THydrogen-bonded Turntrans73.623.8-177.600000114.7P84 L85P84-G88 PolarHBondContact O-N 3.37Å; L85-G88 PolarHBondContact O-N 2.81Å
89A94.2Very high96.7Very high0 Ų025.6 Ų25.60%013%0.126CC..  trans-88.5142.6178.200000111.3P84 I87 D91 M171 F505P84-A89 HydrophobicContact CB-CB 4.27Å; P84-A89 PolarHBondContact O-N 3.46Å; I87-A89 HydrophobicContact CD1-CB 3.85Å; I87-A89 HydrophobicContact CG1-CB 3.66Å; A89-D91 VanDerWaalsContact C-N 3.32Å; A89-D91 PolarHBondContact O-N 3.39Å; A89-M171 HydrophobicContact CB-CB 3.97Å; A89-M171 HydrophobicContact CB-CE 4.44Å; A89-F505 VanDerWaalsContact O-CD2 3.31Å; A89-F505 WeakPolarHBondContact O-CD2 3.49Å
90P93.3Very high96.6Very high57 Ų5730.7 Ų30.737%0.3715%0.151SC..SBendtrans-65.3-33.518023.4-33000113.6M171P90-M171 HydrophobicContact CG-CE 4.34Å
91D95.3Very high96.6Very high19 Ų1930.6 Ų30.610%0.10215%0.151CC..SBendtrans-162.1-173.3178.1-146-45.8000109.4H12 A89 M171H12-D91 VanDerWaalsContact CB-OD1 3.27Å; H12-D91 WeakPolarHBondContact CB-OD1 3.48Å; H12-D91 IonicContact CD2-OD1 2.78Å; H12-D91 PolarHBondContact CD2-OD1 3.42Å; H12-D91 IonicContact CG-OD1 3.44Å; H12-D91 PolarHBondContact N-OD1 3.24Å; H12-D91 VanDerWaalsContact N-OD1 3.16Å; A89-D91 VanDerWaalsContact C-N 3.32Å; A89-D91 PolarHBondContact O-N 3.39Å; D91-M171 WeakPolarHBondContact O-CE 3.37Å
92M96.8Very high96.7Very high3 Ų330.5 Ų30.52%0.01515%0.15CC..  trans-74.2155.4169.1-62.5-70.8-71.600111.8H12 P84 F94 P95 N163 F164 T167H12-M92 HydrophobicContact CB-CG 3.76Å; P84-M92 HydrophobicContact CG-CG 4.04Å; P84-M92 HydrophobicContact CG-SD 3.56Å; P84-M92 VanDerWaalsContact CG-SD 3.56Å; M92-F94 VanDerWaalsContact C-N 3.35Å; M92-F94 PolarHBondContact O-N 2.99Å; M92-P95 WeakPolarHBondContact O-CD 3.38Å; M92-P95 WeakPolarHBondContact O-CG 3.39Å; M92-N163 HydrophobicContact CE-CB 4.26Å; M92-N163 WeakPolarHBondContact CE-ND2 3.46Å; M92-F164 HydrophobicContact CE-CD1 3.51Å; M92-F164 HydrophobicContact CE-CE1 3.55Å; M92-F164 HydrophobicContact CE-CG 4.04Å; M92-F164 HydrophobicContact CE-CZ 4.14Å; M92-F164 HydrophobicContact SD-CD1 4.36Å; M92-F164 HydrophobicContact SD-CE1 4.15Å; M92-T167 HydrophobicContact SD-CG2 3.95Å
93A97.7Very high96.7Very high31 Ų3135 Ų3526%0.25617%0.168SC..SBendtrans-63.6-37-177.800000113.6P95 N163 T166 T167 M171A93-P95 WeakPolarHBondContact O-CD 3.23Å; A93-N163 PolarHBondContact N-OD1 3.41Å; A93-T166 HydrophobicContact CB-CG2 3.66Å; A93-T167 WeakPolarHBondContact CB-OG1 3.37Å; A93-T167 PolarHBondContact N-OG1 2.93Å; A93-M171 WeakPolarHBondContact CA-SD 3.43Å; A93-M171 HydrophobicContact CB-CG 4.48Å; A93-M171 HydrophobicContact CB-SD 3.59Å; A93-M171 VanDerWaalsContact CB-SD 3.59Å; A93-M171 PolarHBondContact N-SD 3.24Å
94F98.2Very high96.7Very high81 Ų8136.4 Ų36.436%0.35518%0.175SC..  trans-122.475.6179.2-53.2-54.2000111.5M92 R96 M97 N98 I162 N163 T166M92-F94 VanDerWaalsContact C-N 3.35Å; M92-F94 PolarHBondContact O-N 2.99Å; F94-R96 VanDerWaalsContact C-N 3.32Å; F94-R96 PolarHBondContact O-N 3.38Å; F94-M97 HydrophobicContact CB-CB 3.69Å; F94-M97 HydrophobicContact CB-SD 4.32Å; F94-M97 HydrophobicContact CD2-CE 4.33Å; F94-M97 HydrophobicContact CD2-SD 4.16Å; F94-M97 HydrophobicContact CG-CE 4.49Å; F94-M97 WeakPolarHBondContact O-CB 3.25Å; F94-M97 PolarHBondContact O-N 3.19Å; F94-M97 VanDerWaalsContact O-N 3.13Å; F94-N98 PolarHBondContact O-N 3.27Å; F94-I162 HydrophobicContact CE2-CG2 4.16Å; F94-N163 HydrophobicContact CD2-CB 4.35Å; F94-N163 PolarHBondContact N-OD1 3.07Å; F94-N163 PolarHBondContact O-ND2 3.38Å; F94-T166 HydrophobicContact CE2-CG2 3.74Å; F94-T166 WeakPolarHBondContact CE2-OG1 3.38Å; F94-T166 HydrophobicContact CZ-CG2 3.77Å
95P97.3Very high96.8Very high39 Ų3936.6 Ų36.625%0.25318%0.176SC..Hα-helixtrans-58.6-36.9-173.3-28.236.4000115.1T10 M92 A93 N98 N99T10-P95 HydrophobicContact CG2-CB 4.33Å; T10-P95 WeakPolarHBondContact O-CB 3.47Å; M92-P95 WeakPolarHBondContact O-CD 3.38Å; M92-P95 WeakPolarHBondContact O-CG 3.39Å; A93-P95 WeakPolarHBondContact O-CD 3.23Å; P95-N98 VanDerWaalsContact O-CB 3.26Å; P95-N98 WeakPolarHBondContact O-CB 3.34Å; P95-N98 PolarHBondContact O-N 3.12Å; P95-N99 PolarHBondContact O-N 3.47Å; P95-N99 VanDerWaalsContact O-N 3.09Å
96R97.8Very high96.9Very high208 Ų20838 Ų3879%0.78519%0.185SC*.Hα-helixtrans-72.5-37.9178.2-65.3178.4-176.6-107.30112.4T10 F94 N98 N99 M100T10-R96 HydrophobicContact CG2-CG 4.17Å; F94-R96 VanDerWaalsContact C-N 3.32Å; F94-R96 PolarHBondContact O-N 3.38Å; R96-N98 VanDerWaalsContact C-N 3.25Å; R96-N98 PolarHBondContact O-N 3.4Å; R96-N99 PolarHBondContact O-N 2.81Å; R96-M100 WeakPolarHBondContact O-CB 3.49Å; R96-M100 PolarHBondContact O-N 2.84Å
97M97.3Very high97.1Very high57 Ų5740.5 Ų40.528%0.28120%0.202SC..Hα-helixtrans-64.1-36.9173.4-175.7-175.8-68.600110.4F94 M100 S101 L159 I162F94-M97 HydrophobicContact CB-CB 3.69Å; F94-M97 HydrophobicContact CB-SD 4.32Å; F94-M97 HydrophobicContact CD2-CE 4.33Å; F94-M97 HydrophobicContact CD2-SD 4.16Å; F94-M97 HydrophobicContact CG-CE 4.49Å; F94-M97 WeakPolarHBondContact O-CB 3.25Å; F94-M97 PolarHBondContact O-N 3.19Å; F94-M97 VanDerWaalsContact O-N 3.13Å; M97-M100 PolarHBondContact O-N 2.74Å; M97-S101 PolarHBondContact O-N 3.46Å; M97-L159 HydrophobicContact CE-CD2 4.38Å; M97-L159 HydrophobicContact CG-CB 3.89Å; M97-L159 HydrophobicContact CG-CD2 3.95Å; M97-L159 HydrophobicContact CG-CG 4.35Å; M97-L159 HydrophobicContact SD-CB 4.3Å; M97-L159 HydrophobicContact SD-CD2 4.01Å; M97-I162 HydrophobicContact SD-CG2 4.38Å
98N97.9Very high97.2Very high2 Ų240.5 Ų40.51%0.01120%0.202CC..Hα-helixtrans-62.3-42.8174.5-15640.2000113.2N80 F94 P95 R96 S101 F102 N163N80-N98 PolarHBondContact OD1-ND2 3.23Å; N80-N98 PolarHBondContact OD1-OD1 3.08Å; F94-N98 PolarHBondContact O-N 3.27Å; P95-N98 VanDerWaalsContact O-CB 3.26Å; P95-N98 WeakPolarHBondContact O-CB 3.34Å; P95-N98 PolarHBondContact O-N 3.12Å; R96-N98 VanDerWaalsContact C-N 3.25Å; R96-N98 PolarHBondContact O-N 3.4Å; N98-S101 PolarHBondContact O-OG 3.33Å; N98-F102 PolarHBondContact O-N 2.89Å; N98-N163 VanDerWaalsContact CB-ND2 3.33Å; N98-N163 WeakPolarHBondContact CB-ND2 3.29Å; N98-N163 PolarHBondContact OD1-ND2 2.9Å
99N98.1Very high97.5Very high21 Ų2140.6 Ų40.611%0.11220%0.201CC..Hα-helixtrans-65.9-44.4174.9-171.535.5000110.7L7 S9 V15 P95 R96 S101 F102 W103L7-N99 PolarHBondContact O-ND2 3.37Å; S9-N99 VanDerWaalsContact O-CB 3.3Å; S9-N99 WeakPolarHBondContact O-CB 3.18Å; S9-N99 VanDerWaalsContact O-CG 3.32Å; S9-N99 PolarHBondContact O-ND2 3.29Å; V15-N99 HydrophobicContact CG2-CB 4.37Å; P95-N99 PolarHBondContact O-N 3.47Å; P95-N99 VanDerWaalsContact O-N 3.09Å; R96-N99 PolarHBondContact O-N 2.81Å; N99-S101 VanDerWaalsContact C-N 3.33Å; N99-S101 PolarHBondContact O-N 2.83Å; N99-F102 PolarHBondContact O-N 3.23Å; N99-W103 PolarHBondContact O-N 2.94Å; N99-W103 VanDerWaalsContact O-N 3.11Å; N99-W103 PolarHBondContact OD1-NE1 3.34Å
100M97.3Very high97.7Very high107 Ų10746.2 Ų46.253%0.52723%0.23SC..Hα-helixtrans-61.1-39.7177.3-175.9176.5177.500112.4R96 M97 F102 W103 L104 L159R96-M100 WeakPolarHBondContact O-CB 3.49Å; R96-M100 PolarHBondContact O-N 2.84Å; M97-M100 PolarHBondContact O-N 2.74Å; M100-F102 VanDerWaalsContact C-N 3.28Å; M100-F102 PolarHBondContact O-N 3.06Å; M100-W103 PolarHBondContact O-N 3.18Å; M100-L104 WeakPolarHBondContact O-CG 3.46Å; M100-L104 PolarHBondContact O-N 3Å; M100-L159 HydrophobicContact CG-CD1 4.3Å; M100-L159 HydrophobicContact SD-CD1 4.31Å
101S97.9Very high97.9Very high0 Ų045.8 Ų45.80%023%0.225CC..Hα-helixtrans-60-40.4177.162.20000111.2Y19 M97 N98 N99 S156Y19-S101 WeakPolarHBondContact OH-CB 3.35Å; Y19-S101 PolarHBondContact OH-O 2.9Å; Y19-S101 PolarHBondContact OH-OG 3.44Å; M97-S101 PolarHBondContact O-N 3.46Å; N98-S101 PolarHBondContact O-OG 3.33Å; N99-S101 VanDerWaalsContact C-N 3.33Å; N99-S101 PolarHBondContact O-N 2.83Å; S101-S156 WeakPolarHBondContact CB-O 3.14Å; S101-S156 WeakPolarHBondContact O-CB 3.11Å; S101-S156 PolarHBondContact O-OG 2.84Å
102F98.6Very high98.1Very high9 Ų945.1 Ų45.14%0.03922%0.221CC..Hα-helixtrans-63.8-49.9174.7171.1-101.8000111.9V15 L18 Y19 F22 N98 N99 M100 L104 L105 P106V15-F102 HydrophobicContact CG1-CB 4.18Å; L18-F102 VanDerWaalsContact C-CE2 3.46Å; L18-F102 HydrophobicContact CB-CD1 4.04Å; L18-F102 HydrophobicContact CB-CD2 3.99Å; L18-F102 HydrophobicContact CB-CE1 3.74Å; L18-F102 HydrophobicContact CB-CE2 3.68Å; L18-F102 HydrophobicContact CB-CG 4.18Å; L18-F102 HydrophobicContact CB-CZ 3.57Å; L18-F102 HydrophobicContact CD1-CD1 3.9Å; L18-F102 HydrophobicContact CD1-CE1 3.83Å; L18-F102 HydrophobicContact CD1-CZ 4.49Å; L18-F102 HydrophobicContact CD2-CE1 4.45Å; L18-F102 HydrophobicContact CG-CE1 4.23Å; L18-F102 HydrophobicContact CG-CZ 4.41Å; L18-F102 WeakPolarHBondContact O-CE2 3.18Å; Y19-F102 AromaticContact CD1-CD2 3.9Å; Y19-F102 HydrophobicContact CD1-CD2 3.9Å; Y19-F102 HydrophobicContact CD2-CB 4.27Å; Y19-F102 HydrophobicContact CD2-CD2 4.08Å; Y19-F102 HydrophobicContact CE1-CB 4.36Å; Y19-F102 HydrophobicContact CE1-CD2 4.09Å; Y19-F102 HydrophobicContact CE2-CB 3.68Å; Y19-F102 HydrophobicContact CE2-CD2 4.24Å; Y19-F102 HydrophobicContact CE2-CG 4.42Å; Y19-F102 AromaticContact CG-CD2 3.9Å; Y19-F102 HydrophobicContact CG-CD2 3.9Å; Y19-F102 WeakPolarHBondContact OH-CA 3.4Å; Y19-F102 PolarHBondContact OH-N 2.93Å; F22-F102 HydrophobicContact CB-CE2 3.83Å; F22-F102 HydrophobicContact CB-CZ 4.34Å; F22-F102 HydrophobicContact CG-CE2 4.3Å; N98-F102 PolarHBondContact O-N 2.89Å; N99-F102 PolarHBondContact O-N 3.23Å; M100-F102 VanDerWaalsContact C-N 3.28Å; M100-F102 PolarHBondContact O-N 3.06Å; F102-L104 PolarHBondContact O-N 3.4Å; F102-L104 VanDerWaalsContact O-N 3.09Å; F102-L105 WeakPolarHBondContact O-CB 3.25Å; F102-L105 PolarHBondContact O-N 3.45Å; F102-P106 HydrophobicContact CZ-CG 4.39Å; F102-P106 WeakPolarHBondContact O-CD 3.44Å
103W98.3Very high98.1Very high95 Ų9547.2 Ų47.236%0.3623%0.232SC..Hα-helixtrans-67.9-11.3-172.4-77.6110.9000115.1L7 N99 M100 P106 P107L7-W103 HydrophobicContact CB-CZ2 4.49Å; L7-W103 HydrophobicContact CD2-CH2 3.38Å; L7-W103 HydrophobicContact CD2-CZ2 3.4Å; L7-W103 VanDerWaalsContact CD2-CZ2 3.4Å; L7-W103 HydrophobicContact CD2-CZ3 4.39Å; L7-W103 PolarHBondContact O-NE1 3.42Å; N99-W103 PolarHBondContact O-N 2.94Å; N99-W103 VanDerWaalsContact O-N 3.11Å; N99-W103 PolarHBondContact OD1-NE1 3.34Å; M100-W103 PolarHBondContact O-N 3.18Å; W103-P106 HydrophobicContact CE3-CG 4.33Å; W103-P107 WeakPolarHBondContact O-CD 3.19Å; W103-P107 WeakPolarHBondContact O-CG 3.48Å
104L98.4Very high98.1Very high29 Ų2947.6 Ų47.615%0.15224%0.235CC..THydrogen-bonded Turntrans-77.6-20.9170.2-69.9171.7000113.2M100 F102 P107 S108 L152 V155 L159M100-L104 WeakPolarHBondContact O-CG 3.46Å; M100-L104 PolarHBondContact O-N 3Å; F102-L104 PolarHBondContact O-N 3.4Å; F102-L104 VanDerWaalsContact O-N 3.09Å; L104-P107 WeakPolarHBondContact O-CD 3.38Å; L104-P107 WeakPolarHBondContact O-CG 3.38Å; L104-S108 WeakPolarHBondContact O-CB 3.43Å; L104-S108 PolarHBondContact O-N 2.72Å; L104-L152 HydrophobicContact CD2-CD2 4.29Å; L104-V155 HydrophobicContact CD1-CB 4.18Å; L104-V155 HydrophobicContact CD1-CG1 3.66Å; L104-L159 HydrophobicContact CD1-CD1 4.02Å
105L98.6Very high98.1Very high4 Ų443.8 Ų43.82%0.02122%0.219CC..Hα-helixtrans-73-44.3-178.7-67.2-178000114.4Y19 F22 P72 F102 S108 L109 A153Y19-L105 HydrophobicContact CD1-CD1 3.87Å; Y19-L105 HydrophobicContact CE1-CD1 3.44Å; Y19-L105 VanDerWaalsContact CE1-CD1 3.44Å; F22-L105 HydrophobicContact CD1-CB 4.44Å; F22-L105 HydrophobicContact CD1-CD1 4.26Å; F22-L105 HydrophobicContact CE1-CB 3.84Å; F22-L105 HydrophobicContact CE1-CD1 4.08Å; F22-L105 HydrophobicContact CE2-CB 4.47Å; F22-L105 HydrophobicContact CZ-CB 3.83Å; P72-L105 HydrophobicContact CB-CD1 4.1Å; P72-L105 HydrophobicContact CG-CD1 3.72Å; F102-L105 WeakPolarHBondContact O-CB 3.25Å; F102-L105 PolarHBondContact O-N 3.45Å; L105-S108 WeakPolarHBondContact O-CB 3.09Å; L105-S108 PolarHBondContact O-N 3.46Å; L105-L109 PolarHBondContact O-N 2.74Å; L105-A153 HydrophobicContact CD2-CB 4.38Å
106P98.5Very high98Very high32 Ų3243.4 Ų43.421%0.20822%0.219CC..Hα-helixtrans-55.9-50.5175.6-25.233.9000114.6F22 F102 W103 S108 L109 L110F22-P106 HydrophobicContact CD2-CG 4.33Å; F22-P106 HydrophobicContact CE2-CB 4.44Å; F22-P106 HydrophobicContact CE2-CG 4.21Å; F102-P106 HydrophobicContact CZ-CG 4.39Å; F102-P106 WeakPolarHBondContact O-CD 3.44Å; W103-P106 HydrophobicContact CE3-CG 4.33Å; P106-S108 VanDerWaalsContact C-N 3.3Å; P106-S108 PolarHBondContact O-N 3.05Å; P106-L109 PolarHBondContact O-N 2.79Å; P106-L110 WeakPolarHBondContact O-CG 3.43Å; P106-L110 PolarHBondContact O-N 3.46Å
107P98.6Very high97.8Very high53 Ų5341.2 Ų41.234%0.34422%0.219SC..Hα-helixtrans-65.5-34176.725.1-32.3000112.3W103 L104 L110 L111 L152W103-P107 WeakPolarHBondContact O-CD 3.19Å; W103-P107 WeakPolarHBondContact O-CG 3.48Å; L104-P107 WeakPolarHBondContact O-CD 3.38Å; L104-P107 WeakPolarHBondContact O-CG 3.38Å; P107-L110 PolarHBondContact O-N 3.35Å; P107-L111 WeakPolarHBondContact O-CG 3.26Å; P107-L111 PolarHBondContact O-N 3.34Å; P107-L152 HydrophobicContact CB-CD1 4.38Å
108S98.7Very high97.7Very high0 Ų041 Ų410%022%0.221CC..Hα-helixtrans-59.5-48.5173.3175.10000111.8F68 L104 L105 P106 L110 L111 L112 S149 A153F68-S108 VanDerWaalsContact CE1-OG 3.3Å; F68-S108 WeakPolarHBondContact CE1-OG 3.5Å; F68-S108 WeakPolarHBondContact CZ-OG 3.31Å; L104-S108 WeakPolarHBondContact O-CB 3.43Å; L104-S108 PolarHBondContact O-N 2.72Å; L105-S108 WeakPolarHBondContact O-CB 3.09Å; L105-S108 PolarHBondContact O-N 3.46Å; P106-S108 VanDerWaalsContact C-N 3.3Å; P106-S108 PolarHBondContact O-N 3.05Å; S108-L110 VanDerWaalsContact C-N 3.34Å; S108-L110 PolarHBondContact O-N 3.23Å; S108-L111 WeakPolarHBondContact O-CB 3.35Å; S108-L111 PolarHBondContact O-N 2.77Å; S108-L112 PolarHBondContact O-N 3.42Å; S108-L112 VanDerWaalsContact O-N 3.08Å; S108-S149 WeakPolarHBondContact O-CB 3.27Å; S108-S149 PolarHBondContact O-OG 2.84Å; S108-S149 VanDerWaalsContact O-OG 3.05Å; S108-S149 PolarHBondContact OG-O 3.43Å; S108-S149 PolarHBondContact OG-OG 2.68Å; S108-A153 PolarHBondContact OG-N 3.47Å
109L98.6Very high97.5Very high5 Ų546.8 Ų46.83%0.02625%0.248CC..Hα-helixtrans-63.5-40.4176.8-178.355.1000111.8F22 W25 A26 V64 F68 L105 P106 L111 L112 L113F22-L109 HydrophobicContact CE2-CB 4.3Å; F22-L109 HydrophobicContact CE2-CD2 3.72Å; F22-L109 HydrophobicContact CZ-CB 3.92Å; F22-L109 HydrophobicContact CZ-CD2 3.61Å; F22-L109 HydrophobicContact CZ-CG 4.42Å; W25-L109 HydrophobicContact CE3-CD2 4.04Å; W25-L109 HydrophobicContact CZ3-CD2 3.65Å; A26-L109 HydrophobicContact CB-CD2 4.34Å; V64-L109 HydrophobicContact CG2-CD1 4.2Å; F68-L109 HydrophobicContact CB-CD1 4.25Å; F68-L109 HydrophobicContact CD1-CB 3.72Å; F68-L109 HydrophobicContact CD1-CD1 4.11Å; F68-L109 HydrophobicContact CD1-CG 4.34Å; F68-L109 HydrophobicContact CD2-CD1 4.05Å; F68-L109 HydrophobicContact CE1-CB 3.68Å; F68-L109 HydrophobicContact CE1-CD1 4.46Å; F68-L109 VanDerWaalsContact CE1-N 3.33Å; F68-L109 HydrophobicContact CE2-CD1 4.42Å; F68-L109 HydrophobicContact CG-CB 4.35Å; F68-L109 HydrophobicContact CG-CD1 3.85Å; F68-L109 HydrophobicContact CZ-CB 4.31Å; L105-L109 PolarHBondContact O-N 2.74Å; P106-L109 PolarHBondContact O-N 2.79Å; L109-L111 VanDerWaalsContact C-N 3.3Å; L109-L111 PolarHBondContact O-N 3.35Å; L109-L112 HydrophobicContact CD1-CD2 4.42Å; L109-L112 WeakPolarHBondContact O-CB 3.33Å; L109-L112 PolarHBondContact O-N 3.25Å; L109-L112 VanDerWaalsContact O-N 3.16Å; L109-L113 HydrophobicContact CD1-CD1 4.36Å; L109-L113 HydrophobicContact CD1-CD2 4.4Å; L109-L113 HydrophobicContact CD1-CG 4.13Å; L109-L113 HydrophobicContact CG-CD1 4.21Å; L109-L113 HydrophobicContact CG-CG 4.39Å; L109-L113 WeakPolarHBondContact O-CG 3.33Å; L109-L113 PolarHBondContact O-N 2.95Å
110L98.4Very high97.2Very high118 Ų11848.9 Ų48.962%0.61827%0.268SS*.Hα-helixtrans-61.1-39.1176-70.6174.1000112.1P106 P107 S108 L113 A114P106-L110 WeakPolarHBondContact O-CG 3.43Å; P106-L110 PolarHBondContact O-N 3.46Å; P107-L110 PolarHBondContact O-N 3.35Å; S108-L110 VanDerWaalsContact C-N 3.34Å; S108-L110 PolarHBondContact O-N 3.23Å; L110-L113 PolarHBondContact O-N 3.09Å; L110-A114 VanDerWaalsContact O-CB 3.23Å; L110-A114 WeakPolarHBondContact O-CB 3.41Å; L110-A114 PolarHBondContact O-N 3.27Å
111L98.6Very high97.2Very high48 Ų4843.8 Ų43.825%0.25124%0.243SC..Hα-helixtrans-63.8-40.8173.8-70.8172.2000111.9P107 S108 L109 A114 S115 L145 F148 L152P107-L111 WeakPolarHBondContact O-CG 3.26Å; P107-L111 PolarHBondContact O-N 3.34Å; S108-L111 WeakPolarHBondContact O-CB 3.35Å; S108-L111 PolarHBondContact O-N 2.77Å; L109-L111 VanDerWaalsContact C-N 3.3Å; L109-L111 PolarHBondContact O-N 3.35Å; L111-A114 PolarHBondContact O-N 3.25Å; L111-S115 WeakPolarHBondContact O-CB 3.5Å; L111-S115 PolarHBondContact O-N 3.11Å; L111-L145 HydrophobicContact CD2-CD2 3.85Å; L111-F148 HydrophobicContact CD1-CB 3.95Å; L111-L152 HydrophobicContact CD1-CD1 3.66Å
112L98.4Very high97.2Very high6 Ų644 Ų443%0.03125%0.245CC..Hα-helixtrans-63.8-43.2175.4-176.368.7000112F63 V64 F68 S108 L109 S115 A116 T146F63-L112 HydrophobicContact CB-CD1 4.02Å; F63-L112 HydrophobicContact CB-CD2 3.58Å; F63-L112 HydrophobicContact CB-CG 4.47Å; F63-L112 HydrophobicContact CD2-CD1 3.9Å; F63-L112 HydrophobicContact CG-CD1 4.21Å; V64-L112 HydrophobicContact CG2-CD2 3.78Å; F68-L112 HydrophobicContact CD2-CD2 3.98Å; F68-L112 HydrophobicContact CE2-CB 4.45Å; F68-L112 HydrophobicContact CE2-CD2 3.62Å; S108-L112 PolarHBondContact O-N 3.42Å; S108-L112 VanDerWaalsContact O-N 3.08Å; L109-L112 HydrophobicContact CD1-CD2 4.42Å; L109-L112 WeakPolarHBondContact O-CB 3.33Å; L109-L112 PolarHBondContact O-N 3.25Å; L109-L112 VanDerWaalsContact O-N 3.16Å; L112-S115 VanDerWaalsContact O-CB 3.28Å; L112-S115 WeakPolarHBondContact O-CB 3.48Å; L112-S115 PolarHBondContact O-N 3.38Å; L112-A116 PolarHBondContact O-N 3.21Å; L112-T146 HydrophobicContact CD1-CG2 4.33Å
113L97.6Very high97.1Very high46 Ų4643.9 Ų43.924%0.24125%0.246CC..Hα-helixtrans-70.5-37.7178.8-61.5-179.3000111.6W25 L29 L109 L110 S115 A116 M117W25-L113 HydrophobicContact CH2-CD1 4.34Å; L29-L113 HydrophobicContact CD2-CD1 3.85Å; L29-L113 HydrophobicContact CD2-CD2 3.7Å; L29-L113 HydrophobicContact CD2-CG 4.38Å; L109-L113 HydrophobicContact CD1-CD1 4.36Å; L109-L113 HydrophobicContact CD1-CD2 4.4Å; L109-L113 HydrophobicContact CD1-CG 4.13Å; L109-L113 HydrophobicContact CG-CD1 4.21Å; L109-L113 HydrophobicContact CG-CG 4.39Å; L109-L113 WeakPolarHBondContact O-CG 3.33Å; L109-L113 PolarHBondContact O-N 2.95Å; L110-L113 PolarHBondContact O-N 3.09Å; L113-S115 VanDerWaalsContact C-N 3.3Å; L113-S115 PolarHBondContact O-N 3.04Å; L113-A116 PolarHBondContact O-N 3.38Å; L113-M117 WeakPolarHBondContact O-CG 3.36Å; L113-M117 PolarHBondContact O-N 2.91Å
114A97.8Very high97Very high39 Ų3939.5 Ų39.532%0.32223%0.23SC..Hα-helixtrans-61.5-41171.200000111L110 L111 A116 M117 V118 L145L110-A114 VanDerWaalsContact O-CB 3.23Å; L110-A114 WeakPolarHBondContact O-CB 3.41Å; L110-A114 PolarHBondContact O-N 3.27Å; L111-A114 PolarHBondContact O-N 3.25Å; A114-A116 VanDerWaalsContact C-N 3.25Å; A114-A116 PolarHBondContact O-N 2.79Å; A114-M117 PolarHBondContact O-N 3.36Å; A114-V118 WeakPolarHBondContact O-CB 3.2Å; A114-V118 VanDerWaalsContact O-CG2 3.28Å; A114-V118 WeakPolarHBondContact O-CG2 3.34Å; A114-V118 PolarHBondContact O-N 3.41Å; A114-L145 HydrophobicContact CB-CD1 4.29Å
115S97.8Very high96.9Very high2 Ų238.3 Ų38.31%0.01423%0.225CC..Hα-helixtrans-54.4-40.9175172.10000112.2L111 L112 L113 M117 G121 S142 T146L111-S115 WeakPolarHBondContact O-CB 3.5Å; L111-S115 PolarHBondContact O-N 3.11Å; L112-S115 VanDerWaalsContact O-CB 3.28Å; L112-S115 WeakPolarHBondContact O-CB 3.48Å; L112-S115 PolarHBondContact O-N 3.38Å; L113-S115 VanDerWaalsContact C-N 3.3Å; L113-S115 PolarHBondContact O-N 3.04Å; S115-M117 VanDerWaalsContact C-N 3.27Å; S115-M117 PolarHBondContact O-N 2.73Å; S115-G121 VanDerWaalsContact O-CA 3.3Å; S115-G121 WeakPolarHBondContact O-CA 3.39Å; S115-S142 WeakPolarHBondContact CB-O 3.12Å; S115-S142 WeakPolarHBondContact O-CB 3.33Å; S115-S142 PolarHBondContact OG-O 3.32Å; S115-T146 PolarHBondContact OG-OG1 3.33Å
116A94.4Very high96.8Very high31 Ų3139.6 Ų39.626%0.25623%0.229SC..Hα-helixtrans-70.3-21.1178.400000113.9V56 L112 L113 A114V56-A116 HydrophobicContact CG1-CB 3.89Å; L112-A116 PolarHBondContact O-N 3.21Å; L113-A116 PolarHBondContact O-N 3.38Å; A114-A116 VanDerWaalsContact C-N 3.25Å; A114-A116 PolarHBondContact O-N 2.79Å
117M94Very high96.7Very high161 Ų16138 Ų3879%0.79322%0.22SC*.Hα-helixtrans-104-19-175.5-60.4-59.4-65.300113.6L113 A114 S115L113-M117 WeakPolarHBondContact O-CG 3.36Å; L113-M117 PolarHBondContact O-N 2.91Å; A114-M117 PolarHBondContact O-N 3.36Å; S115-M117 VanDerWaalsContact C-N 3.27Å; S115-M117 PolarHBondContact O-N 2.73Å
118V95.4Very high96.6Very high52 Ų5235.6 Ų35.632%0.31520%0.204SC..SBendtrans-83.3129.1179.8169.10000109.7A114 A120 G121 A141 L145A114-V118 WeakPolarHBondContact O-CB 3.2Å; A114-V118 VanDerWaalsContact O-CG2 3.28Å; A114-V118 WeakPolarHBondContact O-CG2 3.34Å; A114-V118 PolarHBondContact O-N 3.41Å; V118-A120 PolarHBondContact O-N 3.46Å; V118-G121 PolarHBondContact O-N 2.96Å; V118-A141 HydrophobicContact CG1-CB 4.37Å; V118-L145 HydrophobicContact CB-CD1 4.1Å; V118-L145 HydrophobicContact CG1-CD1 4.39Å; V118-L145 HydrophobicContact CG2-CD1 3.9Å
119E93.1Very high96.6Very high125 Ų12537.8 Ų37.858%0.58421%0.212SC*.THydrogen-bonded Turntrans53.3-120.9-178.5-59.9168.2-16700112G140 A141E119-G140 VanDerWaalsContact CD-CA 3.47Å; E119-G140 VanDerWaalsContact OE1-CA 3.31Å; E119-G140 WeakPolarHBondContact OE1-CA 3.33Å; E119-G140 WeakPolarHBondContact OE2-CA 3.13Å; E119-G140 PolarHBondContact OE2-N 3.03Å; E119-A141 VanDerWaalsContact CD-N 3.32Å; E119-A141 PolarHBondContact OE1-N 2.86Å; E119-A141 PolarHBondContact OE2-N 3.25Å
120A92.9Very high96.5Very high64 Ų6438.1 Ų38.153%0.52922%0.215SC..THydrogen-bonded Turntrans-92.1-8.1177.500000113H52 V56 V118H52-A120 PolarHBondContact CD2-O 3.42Å; H52-A120 PolarHBondContact NE2-O 2.84Å; V56-A120 WeakPolarHBondContact CG2-O 3.37Å; V118-A120 PolarHBondContact O-N 3.46Å
121G96.5Very high96.4Very high0 Ų036.7 Ų36.70%021%0.213CC..  trans80.4166.6-172.300000114.5H52 S115 V118 G123 S142H52-G121 PolarHBondContact NE2-O 3.32Å; S115-G121 VanDerWaalsContact O-CA 3.3Å; S115-G121 WeakPolarHBondContact O-CA 3.39Å; V118-G121 PolarHBondContact O-N 2.96Å; G121-G123 PolarHBondContact O-N 3.33Å; G121-S142 PolarHBondContact O-OG 3.09Å; G121-S142 VanDerWaalsContact O-OG 3.06Å
122A97.2Very high96.3Very high4 Ų438.2 Ų38.23%0.03322%0.221CC..  trans-88.495.8178.900000111.2T59 V143T59-A122 WeakPolarHBondContact CB-O 3.37Å; T59-A122 WeakPolarHBondContact CG2-O 3.46Å; T59-A122 PolarHBondContact OG1-O 3.49Å; A122-V143 HydrophobicContact CB-CG2 4.29Å
123G96.8Very high96.2Very high7 Ų738 Ų387%0.07222%0.219CC..  trans-96.128-17900000114.1G121 H138G121-G123 PolarHBondContact O-N 3.33Å; G123-H138 PolarHBondContact N-NE2 2.93Å; G123-H138 VanDerWaalsContact N-NE2 3.2Å
124T96.6Very high96.1Very high4 Ų436.5 Ų36.53%0.02522%0.216CC..SBendtrans-88.2-7-169.957.20000113.8L132 A133 V143T124-L132 HydrophobicContact CG2-CG 4.39Å; T124-A133 HydrophobicContact CG2-CB 3.83Å; T124-V143 HydrophobicContact CG2-CG2 4.05Å
125G96.3Very high96Very high4 Ų437.9 Ų37.94%0.04122%0.218CC..THydrogen-bonded Turntrans76.5161.5-16400000112T59 T127 V128T59-G125 WeakPolarHBondContact OG1-CA 3.28Å; T59-G125 PolarHBondContact OG1-N 3.39Å; G125-T127 PolarHBondContact O-N 2.94Å; G125-V128 PolarHBondContact O-N 3.46Å
126W96.5Very high95.7Very high30 Ų3048.8 Ų48.811%0.11426%0.26CS..THydrogen-bonded Turntrans-62.8-14-176.580.4-82.1000114.8A62 F63 I66 F235 W236A62-W126 HydrophobicContact CB-CB 3.59Å; A62-W126 HydrophobicContact CB-CG 4.03Å; F63-W126 HydrophobicContact CD1-CB 4.46Å; F63-W126 HydrophobicContact CE1-CB 4.17Å; F63-W126 WeakPolarHBondContact CE1-O 3.35Å; F63-W126 HydrophobicContact CE2-CB 4.42Å; F63-W126 HydrophobicContact CZ-CB 4.16Å; F63-W126 WeakPolarHBondContact CZ-O 3.37Å; I66-W126 HydrophobicContact CD1-CE3 4.18Å; I66-W126 HydrophobicContact CD1-CZ3 4.31Å; W126-F235 HydrophobicContact CD2-CZ 4.31Å; W126-F235 AromaticContact CE3-CZ 3.71Å; W126-F235 HydrophobicContact CE3-CZ 3.71Å; W126-F235 AromaticContact CH2-CE1 3.89Å; W126-F235 HydrophobicContact CH2-CE1 3.89Å; W126-F235 AromaticContact CH2-CZ 3.85Å; W126-F235 HydrophobicContact CH2-CZ 3.85Å; W126-F235 HydrophobicContact CZ2-CE1 4.33Å; W126-F235 HydrophobicContact CZ2-CZ 4.43Å; W126-F235 HydrophobicContact CZ3-CE1 4Å; W126-F235 AromaticContact CZ3-CZ 3.46Å; W126-F235 HydrophobicContact CZ3-CZ 3.46Å; W126-F235 VanDerWaalsContact CZ3-CZ 3.46Å; W126-W236 HydrophobicContact CH2-CH2 4.27Å; W126-W236 HydrophobicContact CH2-CZ3 4.06Å; W126-W236 AromaticContact CZ2-CH2 3.79Å; W126-W236 HydrophobicContact CZ2-CH2 3.79Å; W126-W236 HydrophobicContact CZ2-CZ3 4.02Å
127T96.4Very high95.7Very high0 Ų049.9 Ų49.90%027%0.266CS..THydrogen-bonded Turntrans-82.2-21.9176.757.20000112.9G125 Y129 Y231 F235 W236G125-T127 PolarHBondContact O-N 2.94Å; T127-Y129 VanDerWaalsContact C-N 3.33Å; T127-Y129 VanDerWaalsContact CB-CE1 3.49Å; T127-Y129 HydrophobicContact CG2-CE1 4.24Å; T127-Y129 HydrophobicContact CG2-CE2 4.37Å; T127-Y129 PolarHBondContact O-N 3.13Å; T127-Y231 WeakPolarHBondContact O-CE1 3.22Å; T127-Y231 PolarHBondContact O-OH 3.36Å; T127-F235 HydrophobicContact CG2-CD1 4.35Å; T127-F235 HydrophobicContact CG2-CE1 3.67Å; T127-F235 HydrophobicContact CG2-CZ 3.93Å; T127-W236 HydrophobicContact CG2-CH2 4.38Å; T127-W236 HydrophobicContact CG2-CZ2 4.14Å
128V97.5Very high95.8Very high2 Ų242.9 Ų42.91%0.01223%0.231CC..THydrogen-bonded Turntrans55.245.4176-1590000112.3F63 G125 A133 V143 L209 Y231F63-V128 HydrophobicContact CE2-CG2 4.2Å; F63-V128 HydrophobicContact CZ-CG2 3.63Å; G125-V128 PolarHBondContact O-N 3.46Å; V128-A133 HydrophobicContact CG1-CB 3.64Å; V128-A133 WeakPolarHBondContact O-CB 3.23Å; V128-V143 HydrophobicContact CG1-CG1 4.02Å; V128-L209 HydrophobicContact CG1-CD2 3.82Å; V128-Y231 PolarHBondContact O-OH 3.26Å
129Y97.4Very high95.7Very high45 Ų4545.3 Ų45.318%0.17625%0.248CC..  trans-70.6130-175.1-69.5-25.7000113T127 L132 A133 Y231 Q232 F235 W236T127-Y129 VanDerWaalsContact C-N 3.33Å; T127-Y129 VanDerWaalsContact CB-CE1 3.49Å; T127-Y129 HydrophobicContact CG2-CE1 4.24Å; T127-Y129 HydrophobicContact CG2-CE2 4.37Å; T127-Y129 PolarHBondContact O-N 3.13Å; Y129-L132 WeakPolarHBondContact O-CB 3.34Å; Y129-L132 PolarHBondContact O-N 3.22Å; Y129-A133 PolarHBondContact O-N 3.38Å; Y129-Y231 AromaticContact CD1-CD1 3.59Å; Y129-Y231 HydrophobicContact CD1-CD1 3.59Å; Y129-Y231 AromaticContact CD1-CE1 3.61Å; Y129-Y231 HydrophobicContact CD1-CE1 3.61Å; Y129-Y231 HydrophobicContact CE1-CD1 4.11Å; Y129-Y231 HydrophobicContact CE1-CE1 4.12Å; Y129-Q232 HydrophobicContact CD1-CG 4.23Å; Y129-Q232 HydrophobicContact CE1-CG 3.87Å; Y129-Q232 HydrophobicContact CE2-CG 4.44Å; Y129-F235 HydrophobicContact CE1-CD1 4.36Å; Y129-F235 HydrophobicContact CE1-CG 4.44Å; Y129-W236 AromaticContact CZ-NE1 3.97Å; Y129-W236 WeakPolarHBondContact OH-CZ2 3.47Å; Y129-W236 PolarHBondContact OH-NE1 3.37Å
130P96.4Very high95.7Very high13 Ų1340 Ų408%0.08423%0.227CC..THydrogen-bonded Turntrans-67.8152.8157.729.3-30.9000110.2L132 L209 F220 Y231P130-L132 VanDerWaalsContact C-N 3.35Å; P130-L209 HydrophobicContact CB-CD1 4.13Å; P130-L209 HydrophobicContact CG-CD1 4.43Å; P130-F220 HydrophobicContact CB-CB 3.84Å; P130-F220 HydrophobicContact CG-CB 3.54Å; P130-F220 HydrophobicContact CG-CD2 4.01Å; P130-F220 HydrophobicContact CG-CG 3.79Å; P130-Y231 HydrophobicContact CG-CD1 4.42Å; P130-Y231 HydrophobicContact CG-CD2 4.08Å; P130-Y231 HydrophobicContact CG-CG 3.8Å
131P95.9Very high95.9Very high88 Ų8838.7 Ų38.757%0.57122%0.216SC*.THydrogen-bonded Turncis-80.5-6.71.433.5-36.3000114A133 G134P131-A133 VanDerWaalsContact C-N 3.28Å; P131-A133 PolarHBondContact O-N 2.87Å; P131-G134 PolarHBondContact O-N 3.09Å
132L96.9Very high96Very high80 Ų8038.9 Ų38.942%0.41922%0.217SC..THydrogen-bonded Turntrans-60.6-37.3-178.9-177.765000111.9T124 Y129 P130 G134 S137 H138T124-L132 HydrophobicContact CG2-CG 4.39Å; Y129-L132 WeakPolarHBondContact O-CB 3.34Å; Y129-L132 PolarHBondContact O-N 3.22Å; P130-L132 VanDerWaalsContact C-N 3.35Å; L132-G134 VanDerWaalsContact C-N 3.27Å; L132-G134 PolarHBondContact O-N 3.09Å; L132-S137 VanDerWaalsContact O-CB 3.22Å; L132-S137 WeakPolarHBondContact O-CB 3.4Å; L132-H138 PolarHBondContact O-ND1 3.3Å
133A97.2Very high96.1Very high0 Ų038.7 Ų38.70%022%0.216CC..THydrogen-bonded Turntrans-79.8-3.3174.900000114.4T124 V128 Y129 P131 V143 L209 R213T124-A133 HydrophobicContact CG2-CB 3.83Å; V128-A133 HydrophobicContact CG1-CB 3.64Å; V128-A133 WeakPolarHBondContact O-CB 3.23Å; Y129-A133 PolarHBondContact O-N 3.38Å; P131-A133 VanDerWaalsContact C-N 3.28Å; P131-A133 PolarHBondContact O-N 2.87Å; A133-V143 HydrophobicContact CB-CG1 4.29Å; A133-L209 HydrophobicContact CB-CD1 4.39Å; A133-L209 HydrophobicContact CB-CD2 3.9Å; A133-R213 WeakPolarHBondContact O-CD 3.24Å; A133-R213 PolarHBondContact O-NH1 3.4Å
134G95.8Very high96.1Very high16 Ų1639 Ų3917%0.16522%0.216CC..SBendtrans-79.8169.3176.800000113.1P131 L132 Y136 S137 H138P131-G134 PolarHBondContact O-N 3.09Å; L132-G134 VanDerWaalsContact C-N 3.27Å; L132-G134 PolarHBondContact O-N 3.09Å; G134-Y136 PolarHBondContact O-N 2.98Å; G134-S137 PolarHBondContact O-N 3.49Å; G134-S137 VanDerWaalsContact O-N 3.17Å; G134-H138 PolarHBondContact O-N 3.25Å
135N94Very high96.2Very high68 Ų6840.5 Ų40.536%0.36422%0.224SC..THydrogen-bonded Turntrans-63.4-23.9-176.5-75.7-11.8000114.5S137 P139 R213N135-S137 VanDerWaalsContact C-N 3.26Å; N135-S137 PolarHBondContact O-N 3.43Å; N135-P139 VanDerWaalsContact O-CA 3.25Å; N135-P139 WeakPolarHBondContact O-CA 3.36Å; N135-P139 WeakPolarHBondContact O-CB 3.5Å; N135-R213 PolarHBondContact ND2-O 3.32Å; N135-R213 PolarHBondContact OD1-NH1 2.72Å
136Y92Very high96.3Very high230 Ų23040.5 Ų40.590%0.90222%0.222SC*.THydrogen-bonded Turntrans-63.1-35.8177.4-170.5-92.3000112.1G134G134-Y136 PolarHBondContact O-N 2.98Å
137S94.4Very high96.4Very high55 Ų5539.1 Ų39.139%0.38522%0.217SC..THydrogen-bonded Turntrans-103.7-34.5-177.6-56.90000113L132 G134 N135L132-S137 VanDerWaalsContact O-CB 3.22Å; L132-S137 WeakPolarHBondContact O-CB 3.4Å; G134-S137 PolarHBondContact O-N 3.49Å; G134-S137 VanDerWaalsContact O-N 3.17Å; N135-S137 VanDerWaalsContact C-N 3.26Å; N135-S137 PolarHBondContact O-N 3.43Å
138H96.6Very high96.5Very high14 Ų1443.9 Ų43.97%0.06524%0.238CC..SBendtrans-127.983.1177.5-72.778.1000109.6H52 G123 L132 G134 G140 V143 R213H52-H138 AromaticContact CE1-NE2 3.48Å; H52-H138 PolarHBondContact CE1-NE2 2.86Å; G123-H138 PolarHBondContact N-NE2 2.93Å; G123-H138 VanDerWaalsContact N-NE2 3.2Å; L132-H138 PolarHBondContact O-ND1 3.3Å; G134-H138 PolarHBondContact O-N 3.25Å; H138-G140 PolarHBondContact O-N 3.34Å; H138-V143 HydrophobicContact CB-CG2 3.71Å; H138-R213 PolarHBondContact O-NH1 3.14Å; H138-R213 PolarHBondContact O-NH2 2.98Å
139P93Very high96.6Very high102 Ų10243.8 Ų43.866%0.66224%0.238SC*.  trans-74.3-17.8-165.526.2-35.1000116.2N135N135-P139 VanDerWaalsContact O-CA 3.25Å; N135-P139 WeakPolarHBondContact O-CA 3.36Å; N135-P139 WeakPolarHBondContact O-CB 3.5Å
140G94.4Very high96.6Very high14 Ų1442.1 Ų42.114%0.14423%0.232CC..SBendtrans-124.7-161-179.200000114.4E119 H138 S142 R213E119-G140 VanDerWaalsContact CD-CA 3.47Å; E119-G140 VanDerWaalsContact OE1-CA 3.31Å; E119-G140 WeakPolarHBondContact OE1-CA 3.33Å; E119-G140 WeakPolarHBondContact OE2-CA 3.13Å; E119-G140 PolarHBondContact OE2-N 3.03Å; H138-G140 PolarHBondContact O-N 3.34Å; G140-S142 PolarHBondContact O-N 3.48Å; G140-S142 VanDerWaalsContact O-N 3.07Å; G140-R213 PolarHBondContact O-NH2 3.31Å
141A96.8Very high96.8Very high37 Ų3743.6 Ų43.631%0.30624%0.237SC..THydrogen-bonded Turntrans-76.9-4.1-147.900000114.9V118 E119 V143 D144 L145V118-A141 HydrophobicContact CG1-CB 4.37Å; E119-A141 VanDerWaalsContact CD-N 3.32Å; E119-A141 PolarHBondContact OE1-N 2.86Å; E119-A141 PolarHBondContact OE2-N 3.25Å; A141-V143 PolarHBondContact O-N 3.44Å; A141-D144 PolarHBondContact O-N 3.39Å; A141-L145 WeakPolarHBondContact O-CG 3.46Å; A141-L145 PolarHBondContact O-N 2.98Å
142S97.8Very high96.9Very high3 Ų342 Ų422%0.02122%0.224CC..Hα-helixtrans-59.3-46.6-175.864.90000112S115 G121 G140 D144 L145 T146S115-S142 WeakPolarHBondContact CB-O 3.12Å; S115-S142 WeakPolarHBondContact O-CB 3.33Å; S115-S142 PolarHBondContact OG-O 3.32Å; G121-S142 PolarHBondContact O-OG 3.09Å; G121-S142 VanDerWaalsContact O-OG 3.06Å; G140-S142 PolarHBondContact O-N 3.48Å; G140-S142 VanDerWaalsContact O-N 3.07Å; S142-D144 VanDerWaalsContact C-N 3.35Å; S142-D144 PolarHBondContact O-N 2.91Å; S142-L145 PolarHBondContact O-N 2.9Å; S142-T146 PolarHBondContact O-N 3.2Å; S142-T146 VanDerWaalsContact O-N 3.15Å; S142-T146 PolarHBondContact O-OG1 3.13Å
143V98.4Very high96.9Very high0 Ų038.2 Ų38.20%020%0.204CC..Hα-helixtrans-67.4-37.5178.8177.20000111.1A122 T124 V128 A133 H138 A141 L145 T146 I147A122-V143 HydrophobicContact CB-CG2 4.29Å; T124-V143 HydrophobicContact CG2-CG2 4.05Å; V128-V143 HydrophobicContact CG1-CG1 4.02Å; A133-V143 HydrophobicContact CB-CG1 4.29Å; H138-V143 HydrophobicContact CB-CG2 3.71Å; A141-V143 PolarHBondContact O-N 3.44Å; V143-L145 PolarHBondContact O-N 2.82Å; V143-T146 WeakPolarHBondContact O-CB 3.42Å; V143-T146 PolarHBondContact O-N 3.27Å; V143-T146 VanDerWaalsContact O-N 3.15Å; V143-I147 HydrophobicContact CG1-CD1 4.08Å; V143-I147 HydrophobicContact CG1-CG1 4.48Å; V143-I147 WeakPolarHBondContact O-CG1 3.35Å; V143-I147 PolarHBondContact O-N 3.49Å
144D98.4Very high97Very high15 Ų1538.9 Ų38.98%0.0821%0.211CC..Hα-helixtrans-63.8-41.6178.6-53.7-53.8000111.4A141 S142 T146 I147 F148 L210 R213 N214A141-D144 PolarHBondContact O-N 3.39Å; S142-D144 VanDerWaalsContact C-N 3.35Å; S142-D144 PolarHBondContact O-N 2.91Å; D144-T146 VanDerWaalsContact C-N 3.34Å; D144-T146 PolarHBondContact O-N 3.32Å; D144-I147 WeakPolarHBondContact O-CB 3.38Å; D144-I147 PolarHBondContact O-N 3.05Å; D144-F148 HydrophobicContact CB-CE2 4.41Å; D144-F148 WeakPolarHBondContact O-CD2 3.35Å; D144-F148 PolarHBondContact O-N 3.38Å; D144-L210 HydrophobicContact CB-CD1 4Å; D144-L210 VanDerWaalsContact OD1-CD1 3.3Å; D144-L210 WeakPolarHBondContact OD1-CD1 3.13Å; D144-R213 IonicContact OD1-CZ 3.78Å; D144-R213 IonicContact OD1-NE 3.47Å; D144-R213 PolarHBondContact OD1-NE 3.36Å; D144-R213 IonicContact OD1-NH2 2.91Å; D144-R213 PolarHBondContact OD1-NH2 3.4Å; D144-R213 IonicContact OD2-CZ 3.69Å; D144-R213 IonicContact OD2-NE 2.79Å; D144-R213 IonicContact OD2-NH2 3.58Å; D144-R213 PolarHBondContact OD2-NH2 2.87Å; D144-N214 PolarHBondContact OD1-ND2 3.47Å
145L98.5Very high97.1Very high35 Ų3541.4 Ų41.418%0.18322%0.223CC..Hα-helixtrans-62.9-37.8173.4-69.8174.9000112.4L111 A114 V118 A141 S142 V143 F148 S149L111-L145 HydrophobicContact CD2-CD2 3.85Å; A114-L145 HydrophobicContact CB-CD1 4.29Å; V118-L145 HydrophobicContact CB-CD1 4.1Å; V118-L145 HydrophobicContact CG1-CD1 4.39Å; V118-L145 HydrophobicContact CG2-CD1 3.9Å; A141-L145 WeakPolarHBondContact O-CG 3.46Å; A141-L145 PolarHBondContact O-N 2.98Å; S142-L145 PolarHBondContact O-N 2.9Å; V143-L145 PolarHBondContact O-N 2.82Å; L145-F148 PolarHBondContact O-N 3.22Å; L145-S149 WeakPolarHBondContact O-CB 3.35Å; L145-S149 PolarHBondContact O-N 3.37Å
146T98.5Very high97.3Very high3 Ų338.3 Ų38.32%0.01821%0.207CC..Hα-helixtrans-62.5-45172.2-66.90000110.6F63 L112 S115 S142 V143 D144 F148 S149 L150F63-T146 HydrophobicContact CD2-CG2 4.22Å; F63-T146 HydrophobicContact CE2-CG2 3.59Å; F63-T146 HydrophobicContact CZ-CG2 3.96Å; L112-T146 HydrophobicContact CD1-CG2 4.33Å; S115-T146 PolarHBondContact OG-OG1 3.33Å; S142-T146 PolarHBondContact O-N 3.2Å; S142-T146 VanDerWaalsContact O-N 3.15Å; S142-T146 PolarHBondContact O-OG1 3.13Å; V143-T146 WeakPolarHBondContact O-CB 3.42Å; V143-T146 PolarHBondContact O-N 3.27Å; V143-T146 VanDerWaalsContact O-N 3.15Å; D144-T146 VanDerWaalsContact C-N 3.34Å; D144-T146 PolarHBondContact O-N 3.32Å; T146-F148 PolarHBondContact O-N 2.98Å; T146-S149 WeakPolarHBondContact O-CB 3.32Å; T146-S149 PolarHBondContact O-N 2.87Å; T146-L150 HydrophobicContact CG2-CD1 4.24Å; T146-L150 HydrophobicContact CG2-CG 4.5Å; T146-L150 WeakPolarHBondContact O-CG 3.47Å; T146-L150 PolarHBondContact O-N 2.79Å
147I98.7Very high97.6Very high1 Ų128.4 Ų28.41%0.00517%0.171CC..Hα-helixtrans-60.9-46178.1-68.2168.6000110.7V143 D144 S149 L150 H151 I206 L209 L210V143-I147 HydrophobicContact CG1-CD1 4.08Å; V143-I147 HydrophobicContact CG1-CG1 4.48Å; V143-I147 WeakPolarHBondContact O-CG1 3.35Å; V143-I147 PolarHBondContact O-N 3.49Å; D144-I147 WeakPolarHBondContact O-CB 3.38Å; D144-I147 PolarHBondContact O-N 3.05Å; I147-S149 PolarHBondContact O-N 2.94Å; I147-L150 PolarHBondContact O-N 2.85Å; I147-H151 WeakPolarHBondContact CG2-CE1 3.44Å; I147-H151 WeakPolarHBondContact CG2-ND1 3.16Å; I147-H151 PolarHBondContact O-N 3.45Å; I147-H151 PolarHBondContact O-ND1 3.47Å; I147-I206 HydrophobicContact CG1-CB 4.4Å; I147-I206 HydrophobicContact CG2-CB 4.11Å; I147-I206 HydrophobicContact CG2-CD1 4.25Å; I147-I206 HydrophobicContact CG2-CG1 4.24Å; I147-L209 HydrophobicContact CD1-CD2 4.15Å; I147-L209 HydrophobicContact CD1-CG 4.21Å; I147-L210 HydrophobicContact CD1-CB 4.18Å; I147-L210 HydrophobicContact CD1-CD1 4.14Å; I147-L210 HydrophobicContact CG2-CB 4.23Å; I147-L210 HydrophobicContact CG2-CD1 4.33Å; I147-L210 HydrophobicContact CG2-CD2 4.35Å
148F98.7Very high97.8Very high100 Ų10027.9 Ų27.944%0.43916%0.163SC..Hα-helixtrans-64.3-39176.8-70-54.4000112.8L111 D144 L145 T146 L150 H151 L152 L210L111-F148 HydrophobicContact CD1-CB 3.95Å; D144-F148 HydrophobicContact CB-CE2 4.41Å; D144-F148 WeakPolarHBondContact O-CD2 3.35Å; D144-F148 PolarHBondContact O-N 3.38Å; L145-F148 PolarHBondContact O-N 3.22Å; T146-F148 PolarHBondContact O-N 2.98Å; F148-L150 PolarHBondContact O-N 3.48Å; F148-H151 PolarHBondContact O-N 3.39Å; F148-L152 PolarHBondContact O-N 2.83Å; F148-L152 VanDerWaalsContact O-N 3.08Å; F148-L210 HydrophobicContact CE1-CD2 3.9Å; F148-L210 HydrophobicContact CZ-CD1 4.45Å; F148-L210 HydrophobicContact CZ-CD2 3.98Å
149S98.8Very high97.9Very high0 Ų028.7 Ų28.70%017%0.168CC..Hα-helixtrans-54.7-52.2171.7163.60000110.9S108 L145 T146 I147 H151 L152 A153S108-S149 WeakPolarHBondContact O-CB 3.27Å; S108-S149 PolarHBondContact O-OG 2.84Å; S108-S149 VanDerWaalsContact O-OG 3.05Å; S108-S149 PolarHBondContact OG-O 3.43Å; S108-S149 PolarHBondContact OG-OG 2.68Å; L145-S149 WeakPolarHBondContact O-CB 3.35Å; L145-S149 PolarHBondContact O-N 3.37Å; T146-S149 WeakPolarHBondContact O-CB 3.32Å; T146-S149 PolarHBondContact O-N 2.87Å; I147-S149 PolarHBondContact O-N 2.94Å; S149-H151 VanDerWaalsContact C-N 3.34Å; S149-H151 PolarHBondContact O-N 3.24Å; S149-L152 PolarHBondContact O-N 3.43Å; S149-A153 PolarHBondContact O-N 3.25Å
150L98.3Very high98.1Very high10 Ų1024.2 Ų24.25%0.05214%0.14CC..Hα-helixtrans-64.1-35.8-178.7-67.2177.2000112.9F63 F67 T146 I147 F148 G154 I206F63-L150 HydrophobicContact CD1-CD2 3.79Å; F63-L150 HydrophobicContact CE1-CD1 3.76Å; F63-L150 HydrophobicContact CE1-CD2 3.74Å; F63-L150 HydrophobicContact CE1-CG 4.27Å; F63-L150 HydrophobicContact CZ-CD1 3.93Å; F67-L150 HydrophobicContact CD1-CD2 4.37Å; F67-L150 HydrophobicContact CD2-CD2 4.06Å; F67-L150 HydrophobicContact CE1-CD2 4.36Å; F67-L150 HydrophobicContact CE2-CD2 4.01Å; F67-L150 HydrophobicContact CG-CD2 4.26Å; F67-L150 HydrophobicContact CZ-CD2 4.17Å; T146-L150 HydrophobicContact CG2-CD1 4.24Å; T146-L150 HydrophobicContact CG2-CG 4.5Å; T146-L150 WeakPolarHBondContact O-CG 3.47Å; T146-L150 PolarHBondContact O-N 2.79Å; I147-L150 PolarHBondContact O-N 2.85Å; F148-L150 PolarHBondContact O-N 3.48Å; L150-G154 PolarHBondContact O-N 3.26Å; L150-I206 HydrophobicContact CB-CD1 3.84Å
151H98.8Very high98.3Very high44 Ų4423.6 Ų23.620%0.20413%0.134CC..Hα-helixtrans-61.5-48.4172.8-78.695.2000112.1I147 F148 S149 A153 G154 V155 I206 T207I147-H151 WeakPolarHBondContact CG2-CE1 3.44Å; I147-H151 WeakPolarHBondContact CG2-ND1 3.16Å; I147-H151 PolarHBondContact O-N 3.45Å; I147-H151 PolarHBondContact O-ND1 3.47Å; F148-H151 PolarHBondContact O-N 3.39Å; S149-H151 VanDerWaalsContact C-N 3.34Å; S149-H151 PolarHBondContact O-N 3.24Å; H151-A153 PolarHBondContact O-N 3.48Å; H151-G154 PolarHBondContact O-N 3.12Å; H151-V155 WeakPolarHBondContact O-CG2 3.4Å; H151-V155 PolarHBondContact O-N 3.26Å; H151-I206 VanDerWaalsContact CE1-CD1 3.45Å; H151-I206 WeakPolarHBondContact CE1-CD1 3.47Å; H151-I206 VanDerWaalsContact CE1-CG1 3.4Å; H151-I206 WeakPolarHBondContact CE1-CG1 3.31Å; H151-T207 PolarHBondContact NE2-OG1 3.14Å
152L98.5Very high98.4Very high54 Ų5424.5 Ų24.528%0.28313%0.133SC..Hα-helixtrans-63.4-41.9179.3-70.8-175.5000112.1L104 P107 L111 F148 S149 G154 V155 S156L104-L152 HydrophobicContact CD2-CD2 4.29Å; P107-L152 HydrophobicContact CB-CD1 4.38Å; L111-L152 HydrophobicContact CD1-CD1 3.66Å; F148-L152 PolarHBondContact O-N 2.83Å; F148-L152 VanDerWaalsContact O-N 3.08Å; S149-L152 PolarHBondContact O-N 3.43Å; L152-G154 VanDerWaalsContact C-N 3.33Å; L152-V155 PolarHBondContact O-N 3.27Å; L152-S156 PolarHBondContact O-N 2.92Å
153A98.4Very high98.5Very high2 Ų224.4 Ų24.42%0.01713%0.132CC..Hα-helixtrans-62.2-41.4173.800000111.6F68 L105 S108 S149 H151 S156 S157F68-A153 HydrophobicContact CZ-CB 4.48Å; L105-A153 HydrophobicContact CD2-CB 4.38Å; S108-A153 PolarHBondContact OG-N 3.47Å; S149-A153 PolarHBondContact O-N 3.25Å; H151-A153 PolarHBondContact O-N 3.48Å; A153-S156 WeakPolarHBondContact O-CB 3.32Å; A153-S156 PolarHBondContact O-N 2.76Å; A153-S157 PolarHBondContact O-N 2.97Å; A153-S157 PolarHBondContact O-OG 3.14Å
154G98.1Very high98.5Very high13 Ų1324.5 Ų24.513%0.13413%0.133CC..Hα-helixtrans-61.9-44.8175.900000112.8L150 H151 L152 S156 S157 I158L150-G154 PolarHBondContact O-N 3.26Å; H151-G154 PolarHBondContact O-N 3.12Å; L152-G154 VanDerWaalsContact C-N 3.33Å; G154-S156 PolarHBondContact O-N 3.49Å; G154-S157 PolarHBondContact O-N 3.05Å; G154-I158 WeakPolarHBondContact O-CG1 3.43Å; G154-I158 PolarHBondContact O-N 3.4Å
155V98.6Very high98.5Very high69 Ų6925.2 Ų25.242%0.41814%0.136SC..Hα-helixtrans-61.9-44.3175.4176.10000110.8L104 H151 L152 S157 I158 L159L104-V155 HydrophobicContact CD1-CB 4.18Å; L104-V155 HydrophobicContact CD1-CG1 3.66Å; H151-V155 WeakPolarHBondContact O-CG2 3.4Å; H151-V155 PolarHBondContact O-N 3.26Å; L152-V155 PolarHBondContact O-N 3.27Å; V155-S157 VanDerWaalsContact C-N 3.33Å; V155-S157 PolarHBondContact O-N 3.47Å; V155-I158 PolarHBondContact O-N 3.02Å; V155-L159 HydrophobicContact CG1-CD1 4.05Å; V155-L159 HydrophobicContact CG1-CG 4.31Å; V155-L159 VanDerWaalsContact O-CG 3.31Å; V155-L159 WeakPolarHBondContact O-CG 3.26Å; V155-L159 PolarHBondContact O-N 3.44Å
156S98.6Very high98.5Very high4 Ų425.1 Ų25.13%0.02814%0.137CC..Hα-helixtrans-51.3-52.2172.6156.30000111.5S101 L152 A153 G154 L159 G160S101-S156 WeakPolarHBondContact CB-O 3.14Å; S101-S156 WeakPolarHBondContact O-CB 3.11Å; S101-S156 PolarHBondContact O-OG 2.84Å; L152-S156 PolarHBondContact O-N 2.92Å; A153-S156 WeakPolarHBondContact O-CB 3.32Å; A153-S156 PolarHBondContact O-N 2.76Å; G154-S156 PolarHBondContact O-N 3.49Å; S156-L159 PolarHBondContact O-N 3.46Å; S156-G160 PolarHBondContact O-N 3.24Å
157S98Very high98.5Very high21 Ų2125 Ų2515%0.14714%0.136CC..Hα-helixtrans-67.8-36.3-176.7-66.40000113.4A153 G154 V155 G160 A161A153-S157 PolarHBondContact O-N 2.97Å; A153-S157 PolarHBondContact O-OG 3.14Å; G154-S157 PolarHBondContact O-N 3.05Å; V155-S157 VanDerWaalsContact C-N 3.33Å; V155-S157 PolarHBondContact O-N 3.47Å; S157-G160 PolarHBondContact O-N 2.85Å; S157-A161 VanDerWaalsContact O-CB 3.29Å; S157-A161 WeakPolarHBondContact O-CB 3.31Å; S157-A161 PolarHBondContact O-N 3.35Å
158I98.4Very high98.4Very high44 Ų4424.9 Ų24.923%0.22614%0.136CC..Hα-helixtrans-65.6-45.8175.6-69.4168.3000110.9G154 V155 G160 A161 I162 L196 L199G154-I158 WeakPolarHBondContact O-CG1 3.43Å; G154-I158 PolarHBondContact O-N 3.4Å; V155-I158 PolarHBondContact O-N 3.02Å; I158-G160 VanDerWaalsContact C-N 3.33Å; I158-G160 PolarHBondContact O-N 3.46Å; I158-A161 PolarHBondContact O-N 3.39Å; I158-I162 HydrophobicContact CG2-CD1 3.96Å; I158-I162 WeakPolarHBondContact O-CG1 3.43Å; I158-I162 PolarHBondContact O-N 3.32Å; I158-L196 HydrophobicContact CG2-CD1 4.18Å; I158-L199 HydrophobicContact CD1-CB 4.09Å; I158-L199 HydrophobicContact CG1-CB 4.12Å; I158-L199 HydrophobicContact CG1-CD1 3.86Å
159L98.4Very high98.3Very high31 Ų3124.3 Ų24.316%0.16214%0.137CC..Hα-helixtrans-60.7-44.4176.8-68.6178.2000111.2M97 M100 L104 V155 S156 N163M97-L159 HydrophobicContact CE-CD2 4.38Å; M97-L159 HydrophobicContact CG-CB 3.89Å; M97-L159 HydrophobicContact CG-CD2 3.95Å; M97-L159 HydrophobicContact CG-CG 4.35Å; M97-L159 HydrophobicContact SD-CB 4.3Å; M97-L159 HydrophobicContact SD-CD2 4.01Å; M100-L159 HydrophobicContact CG-CD1 4.3Å; M100-L159 HydrophobicContact SD-CD1 4.31Å; L104-L159 HydrophobicContact CD1-CD1 4.02Å; V155-L159 HydrophobicContact CG1-CD1 4.05Å; V155-L159 HydrophobicContact CG1-CG 4.31Å; V155-L159 VanDerWaalsContact O-CG 3.31Å; V155-L159 WeakPolarHBondContact O-CG 3.26Å; V155-L159 PolarHBondContact O-N 3.44Å; S156-L159 PolarHBondContact O-N 3.46Å; L159-N163 WeakPolarHBondContact O-CB 3.37Å; L159-N163 PolarHBondContact O-N 2.87Å
160G98.2Very high98.2Very high8 Ų829.9 Ų29.98%0.08217%0.166CC..Hα-helixtrans-59.7-45.8173.800000112.4S156 S157 I158 I162 N163 F164S156-G160 PolarHBondContact O-N 3.24Å; S157-G160 PolarHBondContact O-N 2.85Å; I158-G160 VanDerWaalsContact C-N 3.33Å; I158-G160 PolarHBondContact O-N 3.46Å; G160-I162 PolarHBondContact O-N 3.03Å; G160-N163 WeakPolarHBondContact O-CB 3.48Å; G160-N163 PolarHBondContact O-N 3.4Å; G160-F164 WeakPolarHBondContact O-CD2 3.49Å; G160-F164 PolarHBondContact O-N 2.81Å
161A98.5Very high98Very high1 Ų132 Ų321%0.00818%0.177CC..Hα-helixtrans-60.5-46.6179.700000112.8S157 I158 N163 F164 I165 A192 L195S157-A161 VanDerWaalsContact O-CB 3.29Å; S157-A161 WeakPolarHBondContact O-CB 3.31Å; S157-A161 PolarHBondContact O-N 3.35Å; I158-A161 PolarHBondContact O-N 3.39Å; A161-N163 VanDerWaalsContact C-N 3.26Å; A161-N163 PolarHBondContact O-N 3.26Å; A161-F164 PolarHBondContact O-N 2.83Å; A161-I165 VanDerWaalsContact O-CG1 3.27Å; A161-I165 WeakPolarHBondContact O-CG1 3.29Å; A161-I165 PolarHBondContact O-N 3.25Å; A161-A192 HydrophobicContact CB-CB 4.03Å; A161-A192 WeakPolarHBondContact CB-O 3.39Å; A161-L195 HydrophobicContact CB-CB 4.04Å
162I98.6Very high97.7Very high57 Ų5731.6 Ų31.629%0.29217%0.174SC..Hα-helixtrans-58.1-42.8176-67.7166.5000110.4F94 M97 I158 G160 T166 L196F94-I162 HydrophobicContact CE2-CG2 4.16Å; M97-I162 HydrophobicContact SD-CG2 4.38Å; I158-I162 HydrophobicContact CG2-CD1 3.96Å; I158-I162 WeakPolarHBondContact O-CG1 3.43Å; I158-I162 PolarHBondContact O-N 3.32Å; G160-I162 PolarHBondContact O-N 3.03Å; I162-T166 WeakPolarHBondContact O-CB 3.2Å; I162-T166 PolarHBondContact O-N 3.15Å; I162-T166 PolarHBondContact O-OG1 3.49Å; I162-L196 HydrophobicContact CD1-CD1 4.46Å; I162-L196 HydrophobicContact CG1-CD1 4.09Å
163N98.6Very high97.3Very high0 Ų029.4 Ų29.40%016%0.163CC..Hα-helixtrans-67.3-44.6179.6-168.520.8000112.3M92 A93 F94 N98 L159 G160 A161 T166 T167M92-N163 HydrophobicContact CE-CB 4.26Å; M92-N163 WeakPolarHBondContact CE-ND2 3.46Å; A93-N163 PolarHBondContact N-OD1 3.41Å; F94-N163 HydrophobicContact CD2-CB 4.35Å; F94-N163 PolarHBondContact N-OD1 3.07Å; F94-N163 PolarHBondContact O-ND2 3.38Å; N98-N163 VanDerWaalsContact CB-ND2 3.33Å; N98-N163 WeakPolarHBondContact CB-ND2 3.29Å; N98-N163 PolarHBondContact OD1-ND2 2.9Å; L159-N163 WeakPolarHBondContact O-CB 3.37Å; L159-N163 PolarHBondContact O-N 2.87Å; G160-N163 WeakPolarHBondContact O-CB 3.48Å; G160-N163 PolarHBondContact O-N 3.4Å; A161-N163 VanDerWaalsContact C-N 3.26Å; A161-N163 PolarHBondContact O-N 3.26Å; N163-T166 PolarHBondContact O-N 2.85Å; N163-T167 VanDerWaalsContact O-CB 3.28Å; N163-T167 WeakPolarHBondContact O-CB 3.44Å; N163-T167 PolarHBondContact O-N 3.39Å; N163-T167 PolarHBondContact O-OG1 3.12Å; N163-T167 PolarHBondContact OD1-OG1 3.29Å
164F98.6Very high96.7Very high3 Ų335.6 Ų35.61%0.01320%0.203CC..Hα-helixtrans-61.7-47.6175.8-79.8-61.3000112.4I75 G79 V83 M92 G160 A161 T166 T167 I168 V188 A192I75-F164 HydrophobicContact CG2-CD2 4.09Å; I75-F164 HydrophobicContact CG2-CE2 3.62Å; I75-F164 HydrophobicContact CG2-CZ 4.41Å; I75-F164 VanDerWaalsContact O-CZ 3.31Å; I75-F164 WeakPolarHBondContact O-CZ 3.42Å; G79-F164 VanDerWaalsContact C-CE1 3.45Å; V83-F164 HydrophobicContact CB-CD1 4.39Å; V83-F164 HydrophobicContact CB-CE1 4.28Å; V83-F164 HydrophobicContact CG1-CD1 4.4Å; V83-F164 HydrophobicContact CG2-CD1 4.22Å; V83-F164 HydrophobicContact CG2-CE1 4.14Å; M92-F164 HydrophobicContact CE-CD1 3.51Å; M92-F164 HydrophobicContact CE-CE1 3.55Å; M92-F164 HydrophobicContact CE-CG 4.04Å; M92-F164 HydrophobicContact CE-CZ 4.14Å; M92-F164 HydrophobicContact SD-CD1 4.36Å; M92-F164 HydrophobicContact SD-CE1 4.15Å; G160-F164 WeakPolarHBondContact O-CD2 3.49Å; G160-F164 PolarHBondContact O-N 2.81Å; A161-F164 PolarHBondContact O-N 2.83Å; F164-T166 VanDerWaalsContact C-N 3.34Å; F164-T166 PolarHBondContact O-N 2.88Å; F164-T167 PolarHBondContact O-N 3.38Å; F164-I168 WeakPolarHBondContact O-CB 3.39Å; F164-I168 VanDerWaalsContact O-CG1 3.24Å; F164-I168 WeakPolarHBondContact O-CG1 3.31Å; F164-I168 PolarHBondContact O-N 2.97Å; F164-V188 HydrophobicContact CB-CG1 4.29Å; F164-V188 HydrophobicContact CD1-CG1 3.75Å; F164-V188 HydrophobicContact CD2-CG1 4.33Å; F164-V188 HydrophobicContact CE1-CG1 4.19Å; F164-V188 HydrophobicContact CG-CG1 3.87Å; F164-A192 HydrophobicContact CB-CB 4.04Å
165I98.6Very high96.1Very high30 Ų3037.9 Ų37.915%0.15422%0.221CC..Hα-helixtrans-57.4-50.5178.3-68.9164.8000109.8A161 T167 I168 I169 L189 A192 V193 L196A161-I165 VanDerWaalsContact O-CG1 3.27Å; A161-I165 WeakPolarHBondContact O-CG1 3.29Å; A161-I165 PolarHBondContact O-N 3.25Å; I165-T167 PolarHBondContact O-N 2.99Å; I165-I168 PolarHBondContact O-N 2.91Å; I165-I169 HydrophobicContact CG2-CD1 3.68Å; I165-I169 WeakPolarHBondContact O-CB 3.42Å; I165-I169 VanDerWaalsContact O-CG1 3.31Å; I165-I169 WeakPolarHBondContact O-CG1 3.47Å; I165-I169 PolarHBondContact O-N 3.2Å; I165-L189 HydrophobicContact CG1-CD1 4.25Å; I165-A192 HydrophobicContact CD1-CB 4.17Å; I165-A192 HydrophobicContact CG1-CB 3.75Å; I165-V193 HydrophobicContact CD1-CG2 4.03Å; I165-V193 HydrophobicContact CG1-CG2 4.25Å; I165-L196 HydrophobicContact CD1-CD2 4.05Å
166T98.4Very high95.7Very high32 Ų3235.1 Ų35.120%0.19620%0.203CC..Hα-helixtrans-61.9-44.2-178.9-53.70000111.7A93 F94 I162 N163 F164 N170A93-T166 HydrophobicContact CB-CG2 3.66Å; F94-T166 HydrophobicContact CE2-CG2 3.74Å; F94-T166 WeakPolarHBondContact CE2-OG1 3.38Å; F94-T166 HydrophobicContact CZ-CG2 3.77Å; I162-T166 WeakPolarHBondContact O-CB 3.2Å; I162-T166 PolarHBondContact O-N 3.15Å; I162-T166 PolarHBondContact O-OG1 3.49Å; N163-T166 PolarHBondContact O-N 2.85Å; F164-T166 VanDerWaalsContact C-N 3.34Å; F164-T166 PolarHBondContact O-N 2.88Å; T166-N170 VanDerWaalsContact O-CB 3.28Å; T166-N170 WeakPolarHBondContact O-CB 3.4Å; T166-N170 PolarHBondContact O-N 2.99Å; T166-N170 PolarHBondContact O-ND2 3.08Å
167T98.1Very high95.3Very high0 Ų038.6 Ų38.60%022%0.224CC..Hα-helixtrans-63.2-50.8179.8-57.10000111.2I87 M92 A93 N163 F164 I165 I169 M171I87-T167 HydrophobicContact CD1-CG2 3.98Å; M92-T167 HydrophobicContact SD-CG2 3.95Å; A93-T167 WeakPolarHBondContact CB-OG1 3.37Å; A93-T167 PolarHBondContact N-OG1 2.93Å; N163-T167 VanDerWaalsContact O-CB 3.28Å; N163-T167 WeakPolarHBondContact O-CB 3.44Å; N163-T167 PolarHBondContact O-N 3.39Å; N163-T167 PolarHBondContact O-OG1 3.12Å; N163-T167 PolarHBondContact OD1-OG1 3.29Å; F164-T167 PolarHBondContact O-N 3.38Å; I165-T167 PolarHBondContact O-N 2.99Å; T167-I169 PolarHBondContact O-N 3.41Å; T167-M171 HydrophobicContact CG2-CB 4.41Å; T167-M171 HydrophobicContact CG2-SD 4.01Å; T167-M171 WeakPolarHBondContact O-CB 3.29Å; T167-M171 PolarHBondContact O-N 2.96Å
168I98.1Very high95.1Very high0 Ų039.6 Ų39.60%023%0.227CC..Hα-helixtrans-66.4-37.6-176-66.2170.1000111.5V83 F164 I165 K172 V185 V188 L189V83-I168 HydrophobicContact CG1-CD1 3.97Å; V83-I168 HydrophobicContact CG1-CG1 3.52Å; F164-I168 WeakPolarHBondContact O-CB 3.39Å; F164-I168 VanDerWaalsContact O-CG1 3.24Å; F164-I168 WeakPolarHBondContact O-CG1 3.31Å; F164-I168 PolarHBondContact O-N 2.97Å; I165-I168 PolarHBondContact O-N 2.91Å; I168-K172 WeakPolarHBondContact O-CD 3.36Å; I168-K172 WeakPolarHBondContact O-CE 3.31Å; I168-K172 VanDerWaalsContact O-CG 3.29Å; I168-K172 WeakPolarHBondContact O-CG 3.27Å; I168-V185 HydrophobicContact CB-CG1 4.4Å; I168-V185 HydrophobicContact CD1-CG1 3.94Å; I168-V185 HydrophobicContact CG1-CG1 3.89Å; I168-V185 HydrophobicContact CG2-CG1 3.66Å; I168-V188 HydrophobicContact CD1-CB 4.47Å; I168-V188 HydrophobicContact CD1-CG1 4.29Å; I168-L189 HydrophobicContact CB-CD1 4.36Å; I168-L189 HydrophobicContact CD1-CB 3.88Å; I168-L189 HydrophobicContact CD1-CD1 4.47Å; I168-L189 HydrophobicContact CG2-CB 4.27Å; I168-L189 HydrophobicContact CG2-CD1 4.25Å; I168-L189 HydrophobicContact CG2-CD2 4.06Å; I168-L189 HydrophobicContact CG2-CG 4.43Å
169I96.4Very high94.7Very high88 Ų8842.6 Ų42.645%0.45124%0.236SC..Hα-helixtrans-77.6-43-177.9-64.8174.5000110.9I165 T167 L189I165-I169 HydrophobicContact CG2-CD1 3.68Å; I165-I169 WeakPolarHBondContact O-CB 3.42Å; I165-I169 VanDerWaalsContact O-CG1 3.31Å; I165-I169 WeakPolarHBondContact O-CG1 3.47Å; I165-I169 PolarHBondContact O-N 3.2Å; T167-I169 PolarHBondContact O-N 3.41Å; I169-L189 HydrophobicContact CG1-CD1 4.44Å
170N96.2Very high94.4Very high116 Ų11645.2 Ų45.262%0.6225%0.248SC*.Hα-helixtrans-104.2-21.3-165.3-60.1-43.9000115.5T166T166-N170 VanDerWaalsContact O-CB 3.28Å; T166-N170 WeakPolarHBondContact O-CB 3.4Å; T166-N170 PolarHBondContact O-N 2.99Å; T166-N170 PolarHBondContact O-ND2 3.08Å
171M94.9Very high94.2Very high55 Ų5544.9 Ų44.927%0.27124%0.244SC..SBendtrans-103.87.5-170.8-60.1-174.969.400114.7A89 P90 D91 A93 T167A89-M171 HydrophobicContact CB-CB 3.97Å; A89-M171 HydrophobicContact CB-CE 4.44Å; P90-M171 HydrophobicContact CG-CE 4.34Å; D91-M171 WeakPolarHBondContact O-CE 3.37Å; A93-M171 WeakPolarHBondContact CA-SD 3.43Å; A93-M171 HydrophobicContact CB-CG 4.48Å; A93-M171 HydrophobicContact CB-SD 3.59Å; A93-M171 VanDerWaalsContact CB-SD 3.59Å; A93-M171 PolarHBondContact N-SD 3.24Å; T167-M171 HydrophobicContact CG2-CB 4.41Å; T167-M171 HydrophobicContact CG2-SD 4.01Å; T167-M171 WeakPolarHBondContact O-CB 3.29Å; T167-M171 PolarHBondContact O-N 2.96Å
172K92.1Very high94Very high36 Ų3646.5 Ų46.516%0.15725%0.254CS..SBendtrans-70.1150.7173.2-62.3172.9-62.2-177.10110.7I87 I168 M176 T181I87-K172 HydrophobicContact CB-CG 4.06Å; I87-K172 HydrophobicContact CD1-CG 4.32Å; I87-K172 HydrophobicContact CG2-CG 4.33Å; I168-K172 WeakPolarHBondContact O-CD 3.36Å; I168-K172 WeakPolarHBondContact O-CE 3.31Å; I168-K172 VanDerWaalsContact O-CG 3.29Å; I168-K172 WeakPolarHBondContact O-CG 3.27Å; K172-M176 HydrophobicContact CB-SD 4.5Å; K172-M176 HydrophobicContact CD-SD 4.36Å; K172-M176 HydrophobicContact CG-SD 4.39Å; K172-T181 HydrophobicContact CD-CG2 3.54Å
173P89.1Confident93.9Very high7 Ų744 Ų445%0.04524%0.241CC..  trans-52.7140.1167.8-2732000111I87 A175 M176 V509I87-P173 WeakPolarHBondContact O-CD 3.28Å; P173-A175 PolarHBondContact O-N 3.46Å; P173-M176 PolarHBondContact O-N 3.43Å; P173-V509 HydrophobicContact CG-CB 4.21Å
174P85.4Confident93.9Very high133 Ų13344 Ų4486%0.86424%0.241SC*.THydrogen-bonded Turntrans-55.5-25.8-178.7-28.335.1000114.8
175A86.3Confident93.8Very high60 Ų6043.9 Ų43.950%0.49624%0.241SC..THydrogen-bonded Turntrans-78.1-16178.300000114P173P173-A175 PolarHBondContact O-N 3.46Å
176M89.5Confident93.8Very high11 Ų1143.1 Ų43.15%0.05424%0.236CC..  trans-94.2110.4-176.9-176.7-174.3-78.600110.8K172 P173 Q180 T181 L492 M511K172-M176 HydrophobicContact CB-SD 4.5Å; K172-M176 HydrophobicContact CD-SD 4.36Å; K172-M176 HydrophobicContact CG-SD 4.39Å; P173-M176 PolarHBondContact O-N 3.43Å; M176-Q180 HydrophobicContact CG-CB 4.24Å; M176-T181 HydrophobicContact CG-CG2 4.36Å; M176-T181 HydrophobicContact SD-CG2 3.85Å; M176-L492 HydrophobicContact CE-CD1 4.19Å; M176-M511 HydrophobicContact CE-CE 3.64Å; M176-M511 HydrophobicContact CE-CG 4.45Å; M176-M511 HydrophobicContact CE-SD 4.18Å
177T91.8Very high93.8Very high77 Ų7741.6 Ų41.647%0.47223%0.227SC..  trans-72.2160.9170.269.40000111.1Y179 Q180T177-Y179 VanDerWaalsContact C-N 3.26Å; T177-Y179 PolarHBondContact O-N 3.39Å; T177-Q180 PolarHBondContact O-N 3.31Å; T177-Q180 VanDerWaalsContact OG1-CD 3.32Å; T177-Q180 WeakPolarHBondContact OG1-CG 3.46Å; T177-Q180 PolarHBondContact OG1-OE1 3.3Å
178Q92.4Very high93.8Very high42 Ų4241.7 Ų41.720%0.19623%0.227CC..G310 helixtrans-60-36.6177.9-175.457.935.100112.5Q180 T181 W186Q178-Q180 PolarHBondContact O-N 3.22Å; Q178-T181 PolarHBondContact NE2-OG1 3.25Å; Q178-T181 PolarHBondContact O-N 2.88Å; Q178-T181 PolarHBondContact O-OG1 3.27Å; Q178-W186 HydrophobicContact CB-CZ2 4.43Å; Q178-W186 HydrophobicContact CG-CH2 3.45Å; Q178-W186 VanDerWaalsContact CG-CH2 3.45Å; Q178-W186 HydrophobicContact CG-CZ2 3.5Å; Q178-W186 HydrophobicContact CG-CZ3 4.21Å; Q178-W186 WeakPolarHBondContact O-CZ2 3.47Å; Q178-W186 PolarHBondContact O-NE1 2.91Å
179Y91.4Very high93.8Very high107 Ų10742.5 Ų42.542%0.4223%0.231SC..G310 helixtrans-71.1-8.7176.6-68.8-65.2000113.9T177 W186 Y270 M271 W275T177-Y179 VanDerWaalsContact C-N 3.26Å; T177-Y179 PolarHBondContact O-N 3.39Å; Y179-W186 AromaticContact CD1-CZ2 3.89Å; Y179-W186 HydrophobicContact CD1-CZ2 3.89Å; Y179-W186 HydrophobicContact CE1-CH2 4.42Å; Y179-W186 HydrophobicContact CE1-CZ2 4.19Å; Y179-Y270 WeakPolarHBondContact O-CE1 3.41Å; Y179-Y270 PolarHBondContact O-OH 3.48Å; Y179-M271 HydrophobicContact CD1-CE 3.48Å; Y179-M271 VanDerWaalsContact CD1-CE 3.48Å; Y179-M271 HydrophobicContact CD1-SD 3.75Å; Y179-M271 HydrophobicContact CE1-CE 3.65Å; Y179-M271 HydrophobicContact CE1-SD 4.45Å; Y179-M271 HydrophobicContact CG-CE 4.08Å; Y179-M271 HydrophobicContact CG-SD 4.26Å; Y179-W275 HydrophobicContact CE1-CZ2 4.49Å
180Q90.4Very high93.9Very high87 Ų8739.2 Ų39.241%0.40721%0.214SC..G310 helixtrans-97.70.9174-69.6163.9-5100112.8M176 T177 Q178M176-Q180 HydrophobicContact CG-CB 4.24Å; T177-Q180 PolarHBondContact O-N 3.31Å; T177-Q180 VanDerWaalsContact OG1-CD 3.32Å; T177-Q180 WeakPolarHBondContact OG1-CG 3.46Å; T177-Q180 PolarHBondContact OG1-OE1 3.3Å; Q178-Q180 PolarHBondContact O-N 3.22Å
181T93.9Very high94Very high1 Ų133.7 Ų33.71%0.00619%0.185CC..SBendtrans-74.8144.4178.160.10000111.7K172 M176 Q178 W186 Y270K172-T181 HydrophobicContact CD-CG2 3.54Å; M176-T181 HydrophobicContact CG-CG2 4.36Å; M176-T181 HydrophobicContact SD-CG2 3.85Å; Q178-T181 PolarHBondContact NE2-OG1 3.25Å; Q178-T181 PolarHBondContact O-N 2.88Å; Q178-T181 PolarHBondContact O-OG1 3.27Å; T181-W186 VanDerWaalsContact OG1-CD1 3.32Å; T181-W186 PolarHBondContact OG1-NE1 3.25Å; T181-W186 VanDerWaalsContact OG1-NE1 3.16Å; T181-Y270 PolarHBondContact O-OH 2.9Å
182P95Very high94.2Very high34 Ų3431.1 Ų31.122%0.22117%0.173CC..  trans-61.6155-178.7-24.835.2000113.9M86 F184 V185 W186 H256M86-P182 HydrophobicContact CB-CG 4.19Å; P182-F184 PolarHBondContact O-N 3.47Å; P182-V185 HydrophobicContact CB-CG2 4.45Å; P182-V185 HydrophobicContact CG-CG2 4.49Å; P182-V185 WeakPolarHBondContact O-CA 3.23Å; P182-V185 WeakPolarHBondContact O-CB 3.28Å; P182-V185 PolarHBondContact O-N 3.48Å; P182-W186 PolarHBondContact O-N 3.3Å; P182-W186 VanDerWaalsContact O-N 3.1Å; P182-H256 WeakPolarHBondContact CB-CE1 3.27Å; P182-H256 VanDerWaalsContact CB-NE2 3.29Å; P182-H256 WeakPolarHBondContact CB-NE2 3.4Å
183L96.9Very high94.5Very high5 Ų532.3 Ų32.33%0.02618%0.183CC..Hα-helixtrans-62-29-176.3-69.6178.4000113.3W186 S187 P267 Y270 M273 V274 M277L183-W186 PolarHBondContact O-N 2.84Å; L183-S187 WeakPolarHBondContact O-CB 3.17Å; L183-S187 PolarHBondContact O-N 3.16Å; L183-P267 HydrophobicContact CD1-CB 4.4Å; L183-P267 HydrophobicContact CD1-CG 3.48Å; L183-P267 VanDerWaalsContact CD1-CG 3.48Å; L183-P267 HydrophobicContact CG-CG 4.41Å; L183-Y270 HydrophobicContact CD1-CD2 4.31Å; L183-Y270 HydrophobicContact CD2-CD2 3.65Å; L183-Y270 HydrophobicContact CD2-CE2 3.49Å; L183-Y270 VanDerWaalsContact CD2-CE2 3.49Å; L183-Y270 HydrophobicContact CG-CD2 3.78Å; L183-Y270 HydrophobicContact CG-CE2 3.76Å; L183-M273 HydrophobicContact CD1-CB 4.05Å; L183-M273 HydrophobicContact CD1-CE 3.71Å; L183-M273 HydrophobicContact CD1-CG 4.37Å; L183-M273 HydrophobicContact CD1-SD 3.34Å; L183-M273 WeakPolarHBondContact CD1-SD 3.38Å; L183-M273 HydrophobicContact CD2-CB 4.01Å; L183-V274 HydrophobicContact CD2-CG2 3.64Å; L183-M277 HydrophobicContact CB-CE 4.4Å; L183-M277 HydrophobicContact CD2-CE 3.7Å
184F97.8Very high94.9Very high0 Ų032.1 Ų32.10%018%0.182CC..Hα-helixtrans-62.6-44.5171.6-178.2-102.5000111.6F78 L82 V83 M86 P182 W186 S187 V188 P249 M253 H256F78-F184 HydrophobicContact CB-CE2 4.35Å; F78-F184 HydrophobicContact CB-CZ 3.77Å; L82-F184 HydrophobicContact CB-CD1 4.04Å; L82-F184 HydrophobicContact CB-CE1 3.72Å; L82-F184 HydrophobicContact CD1-CD1 4.31Å; L82-F184 HydrophobicContact CD1-CE1 4.03Å; L82-F184 HydrophobicContact CD1-CZ 4.29Å; L82-F184 HydrophobicContact CG-CE1 4.45Å; V83-F184 HydrophobicContact CG2-CE1 4.2Å; M86-F184 HydrophobicContact CE-CD1 4.46Å; M86-F184 HydrophobicContact SD-CB 3.96Å; M86-F184 HydrophobicContact SD-CD1 3.76Å; M86-F184 HydrophobicContact SD-CG 4.25Å; P182-F184 PolarHBondContact O-N 3.47Å; F184-W186 PolarHBondContact O-N 2.83Å; F184-S187 PolarHBondContact O-N 3.08Å; F184-S187 VanDerWaalsContact O-N 3.13Å; F184-S187 PolarHBondContact O-OG 3.05Å; F184-V188 HydrophobicContact CD1-CG2 4.29Å; F184-V188 HydrophobicContact CE1-CG2 3.79Å; F184-V188 HydrophobicContact CE2-CG2 4.13Å; F184-V188 HydrophobicContact CZ-CG2 3.7Å; F184-V188 WeakPolarHBondContact O-CG2 3.48Å; F184-V188 PolarHBondContact O-N 3.4Å; F184-P249 HydrophobicContact CE2-CB 4.12Å; F184-M253 HydrophobicContact CD2-CG 3.75Å; F184-M253 HydrophobicContact CE2-CG 3.65Å; F184-M253 HydrophobicContact CE2-SD 4.49Å; F184-H256 WeakPolarHBondContact CB-NE2 3.44Å; F184-H256 PolarHBondContact N-NE2 2.92Å
185V98.1Very high95.5Very high0 Ų025.9 Ų25.90%014%0.141CC..Hα-helixtrans-61.8-44.6177.1-179.90000111.1M86 I87 I168 P182 S187 V188 L189M86-V185 HydrophobicContact CB-CG2 3.74Å; M86-V185 HydrophobicContact SD-CG2 4.37Å; I87-V185 HydrophobicContact CG2-CB 4.41Å; I87-V185 HydrophobicContact CG2-CG1 3.74Å; I87-V185 HydrophobicContact CG2-CG2 3.85Å; I168-V185 HydrophobicContact CB-CG1 4.4Å; I168-V185 HydrophobicContact CD1-CG1 3.94Å; I168-V185 HydrophobicContact CG1-CG1 3.89Å; I168-V185 HydrophobicContact CG2-CG1 3.66Å; P182-V185 HydrophobicContact CB-CG2 4.45Å; P182-V185 HydrophobicContact CG-CG2 4.49Å; P182-V185 WeakPolarHBondContact O-CA 3.23Å; P182-V185 WeakPolarHBondContact O-CB 3.28Å; P182-V185 PolarHBondContact O-N 3.48Å; V185-S187 VanDerWaalsContact C-N 3.32Å; V185-S187 PolarHBondContact O-N 3.41Å; V185-V188 PolarHBondContact O-N 3.19Å; V185-L189 WeakPolarHBondContact O-CB 3.34Å; V185-L189 PolarHBondContact O-N 3Å
186W98.1Very high96Very high15 Ų1526.2 Ų26.26%0.05713%0.134CC..Hα-helixtrans-57.7-44.5172.4-87.7110.3000112.7Q178 Y179 T181 P182 L183 F184 V188 L189 I190 Y270 V274 M277 M278Q178-W186 HydrophobicContact CB-CZ2 4.43Å; Q178-W186 HydrophobicContact CG-CH2 3.45Å; Q178-W186 VanDerWaalsContact CG-CH2 3.45Å; Q178-W186 HydrophobicContact CG-CZ2 3.5Å; Q178-W186 HydrophobicContact CG-CZ3 4.21Å; Q178-W186 WeakPolarHBondContact O-CZ2 3.47Å; Q178-W186 PolarHBondContact O-NE1 2.91Å; Y179-W186 AromaticContact CD1-CZ2 3.89Å; Y179-W186 HydrophobicContact CD1-CZ2 3.89Å; Y179-W186 HydrophobicContact CE1-CH2 4.42Å; Y179-W186 HydrophobicContact CE1-CZ2 4.19Å; T181-W186 VanDerWaalsContact OG1-CD1 3.32Å; T181-W186 PolarHBondContact OG1-NE1 3.25Å; T181-W186 VanDerWaalsContact OG1-NE1 3.16Å; P182-W186 PolarHBondContact O-N 3.3Å; P182-W186 VanDerWaalsContact O-N 3.1Å; L183-W186 PolarHBondContact O-N 2.84Å; F184-W186 PolarHBondContact O-N 2.83Å; W186-V188 VanDerWaalsContact C-N 3.33Å; W186-V188 PolarHBondContact O-N 3.31Å; W186-L189 HydrophobicContact CE3-CD2 4.21Å; W186-L189 HydrophobicContact CZ3-CD2 4.2Å; W186-L189 PolarHBondContact O-N 3.23Å; W186-I190 VanDerWaalsContact O-CG1 3.31Å; W186-I190 WeakPolarHBondContact O-CG1 3.12Å; W186-I190 PolarHBondContact O-N 2.94Å; W186-Y270 PolarHBondContact NE1-OH 3.32Å; W186-Y270 VanDerWaalsContact NE1-OH 3.07Å; W186-V274 HydrophobicContact CD2-CG1 3.88Å; W186-V274 HydrophobicContact CD2-CG2 4.43Å; W186-V274 HydrophobicContact CE3-CG1 4.2Å; W186-V274 HydrophobicContact CG-CG1 4.39Å; W186-V274 HydrophobicContact CG-CG2 4.16Å; W186-V274 HydrophobicContact CH2-CG1 4.1Å; W186-V274 HydrophobicContact CZ2-CG1 3.78Å; W186-V274 HydrophobicContact CZ3-CG1 4.32Å; W186-M277 HydrophobicContact CB-CE 3.81Å; W186-M278 HydrophobicContact CZ3-SD 4.11Å
187S97.9Very high96.4Very high0 Ų030.4 Ų30.40%016%0.156CC..Hα-helixtrans-63.2-40-179.677.70000111.9L183 F184 V185 T191 R248 P249L183-S187 WeakPolarHBondContact O-CB 3.17Å; L183-S187 PolarHBondContact O-N 3.16Å; F184-S187 PolarHBondContact O-N 3.08Å; F184-S187 VanDerWaalsContact O-N 3.13Å; F184-S187 PolarHBondContact O-OG 3.05Å; V185-S187 VanDerWaalsContact C-N 3.32Å; V185-S187 PolarHBondContact O-N 3.41Å; S187-T191 VanDerWaalsContact O-CB 3.27Å; S187-T191 WeakPolarHBondContact O-CB 3.16Å; S187-T191 PolarHBondContact O-N 3.43Å; S187-T191 VanDerWaalsContact O-N 3.07Å; S187-T191 PolarHBondContact O-OG1 3.4Å; S187-R248 VanDerWaalsContact CB-O 3.28Å; S187-R248 WeakPolarHBondContact CB-O 3.41Å; S187-P249 WeakPolarHBondContact OG-CA 3.45Å
188V98.6Very high96.6Very high1 Ų126.7 Ų26.71%0.00613%0.133CC..Hα-helixtrans-69.4-42175.7175.80000111V83 F164 I168 F184 V185 W186 I190 T191 A192V83-V188 HydrophobicContact CG2-CB 4.11Å; V83-V188 HydrophobicContact CG2-CG1 4Å; V83-V188 HydrophobicContact CG2-CG2 4.12Å; F164-V188 HydrophobicContact CB-CG1 4.29Å; F164-V188 HydrophobicContact CD1-CG1 3.75Å; F164-V188 HydrophobicContact CD2-CG1 4.33Å; F164-V188 HydrophobicContact CE1-CG1 4.19Å; F164-V188 HydrophobicContact CG-CG1 3.87Å; I168-V188 HydrophobicContact CD1-CB 4.47Å; I168-V188 HydrophobicContact CD1-CG1 4.29Å; F184-V188 HydrophobicContact CD1-CG2 4.29Å; F184-V188 HydrophobicContact CE1-CG2 3.79Å; F184-V188 HydrophobicContact CE2-CG2 4.13Å; F184-V188 HydrophobicContact CZ-CG2 3.7Å; F184-V188 WeakPolarHBondContact O-CG2 3.48Å; F184-V188 PolarHBondContact O-N 3.4Å; V185-V188 PolarHBondContact O-N 3.19Å; W186-V188 VanDerWaalsContact C-N 3.33Å; W186-V188 PolarHBondContact O-N 3.31Å; V188-I190 PolarHBondContact O-N 2.88Å; V188-T191 WeakPolarHBondContact O-CB 3.3Å; V188-T191 PolarHBondContact O-N 3.12Å; V188-A192 WeakPolarHBondContact O-CB 3.22Å; V188-A192 PolarHBondContact O-N 3.44Å
189L98.6Very high96.8Very high17 Ų1725 Ų259%0.08913%0.125CC..Hα-helixtrans-58.1-50.2177.2178.161.1000111.8I165 I168 I169 V185 W186 T191 A192 V193I165-L189 HydrophobicContact CG1-CD1 4.25Å; I168-L189 HydrophobicContact CB-CD1 4.36Å; I168-L189 HydrophobicContact CD1-CB 3.88Å; I168-L189 HydrophobicContact CD1-CD1 4.47Å; I168-L189 HydrophobicContact CG2-CB 4.27Å; I168-L189 HydrophobicContact CG2-CD1 4.25Å; I168-L189 HydrophobicContact CG2-CD2 4.06Å; I168-L189 HydrophobicContact CG2-CG 4.43Å; I169-L189 HydrophobicContact CG1-CD1 4.44Å; V185-L189 WeakPolarHBondContact O-CB 3.34Å; V185-L189 PolarHBondContact O-N 3Å; W186-L189 HydrophobicContact CE3-CD2 4.21Å; W186-L189 HydrophobicContact CZ3-CD2 4.2Å; W186-L189 PolarHBondContact O-N 3.23Å; L189-T191 VanDerWaalsContact C-N 3.3Å; L189-T191 PolarHBondContact O-N 2.66Å; L189-A192 PolarHBondContact O-N 3.49Å; L189-V193 WeakPolarHBondContact O-CG2 3.29Å; L189-V193 PolarHBondContact O-N 3.01Å
190I98.4Very high97.1Very high19 Ų1922.9 Ų22.910%0.09713%0.125CC..Hα-helixtrans-63.4-42.5179.6-62.8162.1000109.9W186 V188 A192 V193 L194 R248 M277 M278W186-I190 VanDerWaalsContact O-CG1 3.31Å; W186-I190 WeakPolarHBondContact O-CG1 3.12Å; W186-I190 PolarHBondContact O-N 2.94Å; V188-I190 PolarHBondContact O-N 2.88Å; I190-A192 VanDerWaalsContact C-N 3.35Å; I190-A192 PolarHBondContact O-N 3.42Å; I190-V193 PolarHBondContact O-N 3.11Å; I190-L194 HydrophobicContact CG2-CD1 4.48Å; I190-L194 WeakPolarHBondContact O-CG 3.33Å; I190-L194 PolarHBondContact O-N 2.98Å; I190-R248 VanDerWaalsContact CG2-NH1 3.3Å; I190-M277 HydrophobicContact CD1-CB 3.59Å; I190-M278 HydrophobicContact CD1-CG 3.78Å; I190-M278 HydrophobicContact CG1-CG 4.33Å
191T98.2Very high97.5Very high0 Ų020.3 Ų20.30%012%0.115CC..Hα-helixtrans-60-43.4177.3-59.70000112.1I75 S187 V188 L189 V193 L194 L195 I245 R248 P249I75-T191 HydrophobicContact CD1-CG2 3.31Å; I75-T191 HydrophobicContact CG1-CG2 4.05Å; S187-T191 VanDerWaalsContact O-CB 3.27Å; S187-T191 WeakPolarHBondContact O-CB 3.16Å; S187-T191 PolarHBondContact O-N 3.43Å; S187-T191 VanDerWaalsContact O-N 3.07Å; S187-T191 PolarHBondContact O-OG1 3.4Å; V188-T191 WeakPolarHBondContact O-CB 3.3Å; V188-T191 PolarHBondContact O-N 3.12Å; L189-T191 VanDerWaalsContact C-N 3.3Å; L189-T191 PolarHBondContact O-N 2.66Å; T191-V193 PolarHBondContact O-N 3.25Å; T191-L194 PolarHBondContact O-N 2.89Å; T191-L195 HydrophobicContact CG2-CD1 4.37Å; T191-L195 WeakPolarHBondContact O-CG 3.2Å; T191-L195 PolarHBondContact O-N 3.02Å; T191-I245 HydrophobicContact CG2-CB 4Å; T191-I245 HydrophobicContact CG2-CG1 4.08Å; T191-I245 HydrophobicContact CG2-CG2 3.63Å; T191-R248 WeakPolarHBondContact OG1-CB 3.25Å; T191-P249 HydrophobicContact CG2-CG 4.42Å
192A98.4Very high97.7Very high2 Ų220.7 Ų20.72%0.01712%0.117CC..Hα-helixtrans-63.1-40.6176.900000112A161 F164 I165 V188 L189 I190 L195 L196A161-A192 HydrophobicContact CB-CB 4.03Å; A161-A192 WeakPolarHBondContact CB-O 3.39Å; F164-A192 HydrophobicContact CB-CB 4.04Å; I165-A192 HydrophobicContact CD1-CB 4.17Å; I165-A192 HydrophobicContact CG1-CB 3.75Å; V188-A192 WeakPolarHBondContact O-CB 3.22Å; V188-A192 PolarHBondContact O-N 3.44Å; L189-A192 PolarHBondContact O-N 3.49Å; I190-A192 VanDerWaalsContact C-N 3.35Å; I190-A192 PolarHBondContact O-N 3.42Å; A192-L195 PolarHBondContact O-N 2.94Å; A192-L196 WeakPolarHBondContact O-CB 3.31Å; A192-L196 PolarHBondContact O-N 3.47Å
193V98.6Very high97.8Very high60 Ų6020.7 Ų20.736%0.36412%0.12SC..Hα-helixtrans-62.2-43.3174.2172.10000111.2I165 L189 I190 T191 L196 L197I165-V193 HydrophobicContact CD1-CG2 4.03Å; I165-V193 HydrophobicContact CG1-CG2 4.25Å; L189-V193 WeakPolarHBondContact O-CG2 3.29Å; L189-V193 PolarHBondContact O-N 3.01Å; I190-V193 PolarHBondContact O-N 3.11Å; T191-V193 PolarHBondContact O-N 3.25Å; V193-L196 PolarHBondContact O-N 3.5Å; V193-L197 HydrophobicContact CG1-CD1 3.93Å; V193-L197 WeakPolarHBondContact O-CG 3.34Å; V193-L197 PolarHBondContact O-N 3.42Å; V193-L197 VanDerWaalsContact O-N 3.16Å
194L97.5Very high97.9Very high4 Ų422.6 Ų22.62%0.02114%0.136CC..Hα-helixtrans-63.2-44.1176.9-65.4179000112.2I190 T191 L196 L197 S198 I245 R248 F285I190-L194 HydrophobicContact CG2-CD1 4.48Å; I190-L194 WeakPolarHBondContact O-CG 3.33Å; I190-L194 PolarHBondContact O-N 2.98Å; T191-L194 PolarHBondContact O-N 2.89Å; L194-L196 VanDerWaalsContact C-N 3.32Å; L194-L196 PolarHBondContact O-N 2.87Å; L194-L197 PolarHBondContact O-N 3.17Å; L194-S198 VanDerWaalsContact O-CB 3.26Å; L194-S198 WeakPolarHBondContact O-CB 3.37Å; L194-S198 PolarHBondContact O-N 2.7Å; L194-S198 PolarHBondContact O-OG 2.9Å; L194-I245 HydrophobicContact CB-CD1 3.73Å; L194-I245 HydrophobicContact CB-CG1 3.66Å; L194-I245 HydrophobicContact CD1-CG1 4.11Å; L194-R248 VanDerWaalsContact CD1-NH2 3.28Å; L194-F285 HydrophobicContact CD2-CD2 4.01Å; L194-F285 HydrophobicContact CD2-CE2 3.22Å; L194-F285 HydrophobicContact CD2-CZ 3.73Å
195L97.1Very high97.9Very high2 Ų222.7 Ų22.71%0.0114%0.138CC..Hα-helixtrans-57.7-47.2177.4-80.2169.4000111M71 I75 A161 T191 A192 L197 L199 I245M71-L195 HydrophobicContact SD-CD2 4.26Å; I75-L195 HydrophobicContact CD1-CD1 3.75Å; A161-L195 HydrophobicContact CB-CB 4.04Å; T191-L195 HydrophobicContact CG2-CD1 4.37Å; T191-L195 WeakPolarHBondContact O-CG 3.2Å; T191-L195 PolarHBondContact O-N 3.02Å; A192-L195 PolarHBondContact O-N 2.94Å; L195-L197 VanDerWaalsContact C-N 3.28Å; L195-L197 PolarHBondContact O-N 2.91Å; L195-L199 HydrophobicContact CB-CD1 4.28Å; L195-L199 HydrophobicContact CD2-CD1 3.68Å; L195-L199 HydrophobicContact CD2-CG 4.16Å; L195-L199 WeakPolarHBondContact O-CB 3.21Å; L195-L199 WeakPolarHBondContact O-CG 3.2Å; L195-L199 PolarHBondContact O-N 3Å; L195-L199 VanDerWaalsContact O-N 3.15Å; L195-I245 HydrophobicContact CB-CD1 4.5Å; L195-I245 HydrophobicContact CD1-CG2 4.3Å; L195-I245 HydrophobicContact CD2-CD1 3.78Å; L195-I245 HydrophobicContact CD2-CG1 4.47Å; L195-I245 HydrophobicContact CD2-CG2 3.81Å; L195-I245 HydrophobicContact CG-CD1 3.83Å; L195-I245 HydrophobicContact CG-CG1 4.21Å; L195-I245 HydrophobicContact CG-CG2 3.92Å
196L97.3Very high98Very high66 Ų6622.8 Ų22.835%0.34614%0.138SC..Hα-helixtrans-60.9-36.7-179.9-176.363.1000112.6I158 I162 I165 A192 V193 L194 P200I158-L196 HydrophobicContact CG2-CD1 4.18Å; I162-L196 HydrophobicContact CD1-CD1 4.46Å; I162-L196 HydrophobicContact CG1-CD1 4.09Å; I165-L196 HydrophobicContact CD1-CD2 4.05Å; A192-L196 WeakPolarHBondContact O-CB 3.31Å; A192-L196 PolarHBondContact O-N 3.47Å; V193-L196 PolarHBondContact O-N 3.5Å; L194-L196 VanDerWaalsContact C-N 3.32Å; L194-L196 PolarHBondContact O-N 2.87Å; L196-P200 WeakPolarHBondContact O-CD 3.32Å; L196-P200 WeakPolarHBondContact O-CG 3.33Å
197L97.3Very high98Very high99 Ų9924.8 Ų24.852%0.51815%0.152SC..Hα-helixtrans-88.1-31.5-176.6-66.3177.1000113.9V193 L194 L195 F285V193-L197 HydrophobicContact CG1-CD1 3.93Å; V193-L197 WeakPolarHBondContact O-CG 3.34Å; V193-L197 PolarHBondContact O-N 3.42Å; V193-L197 VanDerWaalsContact O-N 3.16Å; L194-L197 PolarHBondContact O-N 3.17Å; L195-L197 VanDerWaalsContact C-N 3.28Å; L195-L197 PolarHBondContact O-N 2.91Å; L197-F285 HydrophobicContact CB-CE1 4.36Å; L197-F285 HydrophobicContact CB-CE2 4.35Å; L197-F285 HydrophobicContact CB-CZ 3.67Å; L197-F285 HydrophobicContact CD1-CE2 4.16Å; L197-F285 HydrophobicContact CD1-CZ 4.31Å
198S96.8Very high98Very high0 Ų026.6 Ų26.60%016%0.161CC..Hα-helixtrans-92.6-39.1-17361.30000113.9L194 P200 V201L194-S198 VanDerWaalsContact O-CB 3.26Å; L194-S198 WeakPolarHBondContact O-CB 3.37Å; L194-S198 PolarHBondContact O-N 2.7Å; L194-S198 PolarHBondContact O-OG 2.9Å; S198-P200 VanDerWaalsContact C-CD 3.48Å; S198-V201 PolarHBondContact O-N 2.9Å; S198-V201 VanDerWaalsContact O-N 3.13Å
199L96.5Very high98Very high5 Ų526.6 Ų26.63%0.02616%0.161CC..Hα-helixtrans-61.3-36.1-176.7-75.9172.9000114.8I158 L195 V201 L202 A203 F238I158-L199 HydrophobicContact CD1-CB 4.09Å; I158-L199 HydrophobicContact CG1-CB 4.12Å; I158-L199 HydrophobicContact CG1-CD1 3.86Å; L195-L199 HydrophobicContact CB-CD1 4.28Å; L195-L199 HydrophobicContact CD2-CD1 3.68Å; L195-L199 HydrophobicContact CD2-CG 4.16Å; L195-L199 WeakPolarHBondContact O-CB 3.21Å; L195-L199 WeakPolarHBondContact O-CG 3.2Å; L195-L199 PolarHBondContact O-N 3Å; L195-L199 VanDerWaalsContact O-N 3.15Å; L199-V201 PolarHBondContact O-N 3.45Å; L199-L202 PolarHBondContact O-N 3.28Å; L199-A203 PolarHBondContact O-N 3.42Å; L199-F238 HydrophobicContact CD2-CD2 4.08Å; L199-F238 HydrophobicContact CD2-CE2 3.48Å; L199-F238 VanDerWaalsContact CD2-CE2 3.48Å; L199-F238 HydrophobicContact CD2-CZ 4.25Å; L199-F238 HydrophobicContact CG-CE2 4.33Å
200P98.2Very high98Very high63 Ų6327.1 Ų27.141%0.40916%0.164SC..Hα-helixtrans-58.2-31.3175.6-27.436.7000113.5L196 S198 A203 A204L196-P200 WeakPolarHBondContact O-CD 3.32Å; L196-P200 WeakPolarHBondContact O-CG 3.33Å; S198-P200 VanDerWaalsContact C-CD 3.48Å; P200-A203 PolarHBondContact O-N 3.22Å; P200-A204 WeakPolarHBondContact O-CB 3.44Å; P200-A204 PolarHBondContact O-N 3.46Å
201V98.3Very high98Very high34 Ų3427.5 Ų27.521%0.20617%0.167CC..Hα-helixtrans-72.2-41.9179-175.60000111.2S198 L199 A204 G205 L234 F237S198-V201 PolarHBondContact O-N 2.9Å; S198-V201 VanDerWaalsContact O-N 3.13Å; L199-V201 PolarHBondContact O-N 3.45Å; V201-A204 PolarHBondContact O-N 3.45Å; V201-G205 PolarHBondContact O-N 3.34Å; V201-L234 HydrophobicContact CG1-CB 4.34Å; V201-L234 HydrophobicContact CG1-CD2 3.86Å; V201-F237 HydrophobicContact CB-CD1 3.89Å; V201-F237 HydrophobicContact CB-CE1 4.44Å; V201-F237 HydrophobicContact CG1-CB 4.28Å; V201-F237 HydrophobicContact CG1-CD1 3.79Å; V201-F237 HydrophobicContact CG1-CG 4.34Å; V201-F237 HydrophobicContact CG2-CD1 3.64Å; V201-F237 HydrophobicContact CG2-CE1 3.7Å
202L97.6Very high98Very high9 Ų928.8 Ų28.85%0.04717%0.174CC..Hα-helixtrans-58.4-52170.9177.167.8000110.3L199 A204 G205 I206 F235 F238L199-L202 PolarHBondContact O-N 3.28Å; L202-A204 VanDerWaalsContact C-N 3.26Å; L202-A204 PolarHBondContact O-N 2.97Å; L202-G205 WeakPolarHBondContact O-CA 2.84Å; L202-G205 PolarHBondContact O-N 3.36Å; L202-I206 HydrophobicContact CD1-CG2 3.91Å; L202-I206 HydrophobicContact CG-CD1 4.46Å; L202-I206 HydrophobicContact CG-CG2 4.42Å; L202-I206 WeakPolarHBondContact O-CG1 3.49Å; L202-I206 PolarHBondContact O-N 3.17Å; L202-F235 HydrophobicContact CD1-CD2 3.94Å; L202-F235 HydrophobicContact CD1-CE2 4.18Å; L202-F238 HydrophobicContact CB-CB 3.87Å; L202-F238 HydrophobicContact CB-CD1 3.84Å; L202-F238 HydrophobicContact CB-CD2 4Å; L202-F238 HydrophobicContact CB-CE1 4.43Å; L202-F238 HydrophobicContact CB-CG 3.6Å; L202-F238 HydrophobicContact CD1-CD1 3.8Å; L202-F238 HydrophobicContact CD1-CE1 4.15Å; L202-F238 HydrophobicContact CD1-CG 4.43Å; L202-F238 HydrophobicContact CD2-CD1 3.88Å; L202-F238 HydrophobicContact CD2-CD2 4.42Å; L202-F238 HydrophobicContact CD2-CE1 3.62Å; L202-F238 HydrophobicContact CD2-CE2 4.18Å; L202-F238 HydrophobicContact CD2-CG 4.28Å; L202-F238 HydrophobicContact CD2-CZ 3.77Å; L202-F238 HydrophobicContact CG-CD1 4.04Å; L202-F238 HydrophobicContact CG-CE1 4.27Å; L202-F238 HydrophobicContact CG-CG 4.3Å
203A98.4Very high97.9Very high33 Ų3329 Ų2927%0.27317%0.174SC..Hα-helixtrans-55.6-42.4-177.900000111.7L199 P200 T207L199-A203 PolarHBondContact O-N 3.42Å; P200-A203 PolarHBondContact O-N 3.22Å; A203-T207 WeakPolarHBondContact O-CB 3.28Å; A203-T207 PolarHBondContact O-N 2.82Å; A203-T207 PolarHBondContact O-OG1 2.92Å
204A98.5Very high97.9Very high45 Ų4530.4 Ų30.437%0.37218%0.179SC..Hα-helixtrans-61.4-48.8173.100000111.8P200 V201 L202 T207 M208P200-A204 WeakPolarHBondContact O-CB 3.44Å; P200-A204 PolarHBondContact O-N 3.46Å; V201-A204 PolarHBondContact O-N 3.45Å; L202-A204 VanDerWaalsContact C-N 3.26Å; L202-A204 PolarHBondContact O-N 2.97Å; A204-T207 PolarHBondContact O-N 3.12Å; A204-M208 HydrophobicContact CB-CE 4.27Å; A204-M208 WeakPolarHBondContact O-CE 3.41Å; A204-M208 WeakPolarHBondContact O-CG 3.13Å; A204-M208 PolarHBondContact O-N 3.21Å
205G98.5Very high97.9Very high3 Ų336 Ų363%0.03121%0.209CC..Hα-helixtrans-56.4-50.6178.200000113.6V201 L202 M208 L209V201-G205 PolarHBondContact O-N 3.34Å; L202-G205 WeakPolarHBondContact O-CA 2.84Å; L202-G205 PolarHBondContact O-N 3.36Å; G205-M208 PolarHBondContact O-N 3.16Å; G205-L209 PolarHBondContact O-N 2.65Å
206I98.5Very high97.8Very high2 Ų243.2 Ų43.21%0.0125%0.247CC..Hα-helixtrans-74.9-25.4-179.664.2173.9000112.7I147 L150 H151 L202 L210I147-I206 HydrophobicContact CG1-CB 4.4Å; I147-I206 HydrophobicContact CG2-CB 4.11Å; I147-I206 HydrophobicContact CG2-CD1 4.25Å; I147-I206 HydrophobicContact CG2-CG1 4.24Å; L150-I206 HydrophobicContact CB-CD1 3.84Å; H151-I206 VanDerWaalsContact CE1-CD1 3.45Å; H151-I206 WeakPolarHBondContact CE1-CD1 3.47Å; H151-I206 VanDerWaalsContact CE1-CG1 3.4Å; H151-I206 WeakPolarHBondContact CE1-CG1 3.31Å; L202-I206 HydrophobicContact CD1-CG2 3.91Å; L202-I206 HydrophobicContact CG-CD1 4.46Å; L202-I206 HydrophobicContact CG-CG2 4.42Å; L202-I206 WeakPolarHBondContact O-CG1 3.49Å; L202-I206 PolarHBondContact O-N 3.17Å; I206-L210 WeakPolarHBondContact O-CB 3.29Å; I206-L210 PolarHBondContact O-N 3.1Å
207T98.6Very high97.9Very high57 Ų5742.2 Ų42.235%0.3524%0.244SC..Hα-helixtrans-68.5-45.8169.9-64.30000110.9H151 A203 A204 L209 L210 T211H151-T207 PolarHBondContact NE2-OG1 3.14Å; A203-T207 WeakPolarHBondContact O-CB 3.28Å; A203-T207 PolarHBondContact O-N 2.82Å; A203-T207 PolarHBondContact O-OG1 2.92Å; A204-T207 PolarHBondContact O-N 3.12Å; T207-L209 PolarHBondContact O-N 3.21Å; T207-L210 WeakPolarHBondContact O-CB 3.33Å; T207-L210 PolarHBondContact O-N 2.96Å; T207-L210 VanDerWaalsContact O-N 3.08Å; T207-T211 WeakPolarHBondContact O-CG2 3.34Å; T207-T211 PolarHBondContact O-N 3.28Å
208M98.6Very high97.9Very high37 Ų3740.4 Ų40.418%0.18224%0.237CC..Hα-helixtrans-58.6-39.2174.4-74.8-177.4-77.700111.3A204 G205 T211 D212 F219 F220 L234A204-M208 HydrophobicContact CB-CE 4.27Å; A204-M208 WeakPolarHBondContact O-CE 3.41Å; A204-M208 WeakPolarHBondContact O-CG 3.13Å; A204-M208 PolarHBondContact O-N 3.21Å; G205-M208 PolarHBondContact O-N 3.16Å; M208-T211 PolarHBondContact O-N 3.11Å; M208-T211 PolarHBondContact O-OG1 2.88Å; M208-D212 PolarHBondContact O-N 3.38Å; M208-F219 HydrophobicContact CB-CB 4.19Å; M208-F219 HydrophobicContact CB-CD2 3.67Å; M208-F219 HydrophobicContact CB-CE2 4.16Å; M208-F219 HydrophobicContact CB-CG 3.89Å; M208-F219 HydrophobicContact CG-CD1 4.08Å; M208-F219 HydrophobicContact CG-CD2 3.75Å; M208-F219 HydrophobicContact CG-CE1 4.12Å; M208-F219 HydrophobicContact CG-CE2 3.81Å; M208-F219 HydrophobicContact CG-CG 3.9Å; M208-F219 HydrophobicContact CG-CZ 4Å; M208-F219 HydrophobicContact SD-CD1 3.6Å; M208-F219 HydrophobicContact SD-CD2 4.36Å; M208-F219 HydrophobicContact SD-CE1 3.79Å; M208-F219 HydrophobicContact SD-CG 3.92Å; M208-F219 HydrophobicContact SD-CZ 4.26Å; M208-F220 HydrophobicContact CB-CE2 3.64Å; M208-F220 HydrophobicContact CB-CZ 3.73Å; M208-F220 HydrophobicContact CE-CZ 4.32Å; M208-F220 HydrophobicContact SD-CZ 4.47Å; M208-L234 HydrophobicContact CE-CD1 3.31Å
209L98.5Very high97.9Very high1 Ų144.7 Ų44.71%0.00526%0.256CS..Hα-helixtrans-66-40.3175.1179.362.4000111.4V128 P130 A133 I147 G205 T207 T211 D212 R213 F220 Y231V128-L209 HydrophobicContact CG1-CD2 3.82Å; P130-L209 HydrophobicContact CB-CD1 4.13Å; P130-L209 HydrophobicContact CG-CD1 4.43Å; A133-L209 HydrophobicContact CB-CD1 4.39Å; A133-L209 HydrophobicContact CB-CD2 3.9Å; I147-L209 HydrophobicContact CD1-CD2 4.15Å; I147-L209 HydrophobicContact CD1-CG 4.21Å; G205-L209 PolarHBondContact O-N 2.65Å; T207-L209 PolarHBondContact O-N 3.21Å; L209-T211 VanDerWaalsContact C-N 3.32Å; L209-T211 PolarHBondContact O-N 2.85Å; L209-D212 PolarHBondContact O-N 3.49Å; L209-R213 VanDerWaalsContact O-CG 3.27Å; L209-R213 WeakPolarHBondContact O-CG 3.32Å; L209-R213 PolarHBondContact O-N 3.4Å; L209-F220 HydrophobicContact CB-CD2 4.32Å; L209-F220 HydrophobicContact CB-CE2 4.03Å; L209-F220 HydrophobicContact CD1-CD2 4.35Å; L209-Y231 HydrophobicContact CB-CE2 4.19Å; L209-Y231 HydrophobicContact CD2-CE2 3.98Å
210L98.4Very high98Very high29 Ų2944.5 Ų44.515%0.15226%0.255CS..Hα-helixtrans-62.3-39.6176.2-171.668.6000111.7D144 I147 F148 I206 T207 R213 N214D144-L210 HydrophobicContact CB-CD1 4Å; D144-L210 VanDerWaalsContact OD1-CD1 3.3Å; D144-L210 WeakPolarHBondContact OD1-CD1 3.13Å; I147-L210 HydrophobicContact CD1-CB 4.18Å; I147-L210 HydrophobicContact CD1-CD1 4.14Å; I147-L210 HydrophobicContact CG2-CB 4.23Å; I147-L210 HydrophobicContact CG2-CD1 4.33Å; I147-L210 HydrophobicContact CG2-CD2 4.35Å; F148-L210 HydrophobicContact CE1-CD2 3.9Å; F148-L210 HydrophobicContact CZ-CD1 4.45Å; F148-L210 HydrophobicContact CZ-CD2 3.98Å; I206-L210 WeakPolarHBondContact O-CB 3.29Å; I206-L210 PolarHBondContact O-N 3.1Å; T207-L210 WeakPolarHBondContact O-CB 3.33Å; T207-L210 PolarHBondContact O-N 2.96Å; T207-L210 VanDerWaalsContact O-N 3.08Å; L210-R213 PolarHBondContact O-N 2.72Å; L210-N214 WeakPolarHBondContact CD1-ND2 3.38Å; L210-N214 WeakPolarHBondContact O-CB 3.25Å; L210-N214 PolarHBondContact O-N 3.49Å; L210-N214 PolarHBondContact O-ND2 3.47Å
211T98.3Very high97.9Very high27 Ų2745.2 Ų45.217%0.16626%0.256CS..Hα-helixtrans-73.1-34.5176.762.60000112.2T207 M208 L209 R213 N214 L215 N216 T217T207-T211 WeakPolarHBondContact O-CG2 3.34Å; T207-T211 PolarHBondContact O-N 3.28Å; M208-T211 PolarHBondContact O-N 3.11Å; M208-T211 PolarHBondContact O-OG1 2.88Å; L209-T211 VanDerWaalsContact C-N 3.32Å; L209-T211 PolarHBondContact O-N 2.85Å; T211-R213 PolarHBondContact O-N 2.79Å; T211-N214 PolarHBondContact O-N 3.05Å; T211-L215 HydrophobicContact CG2-CD1 3.87Å; T211-L215 CarbonylContact O-C 3.38Å; T211-L215 WeakPolarHBondContact O-CA 3.4Å; T211-L215 PolarHBondContact O-N 2.94Å; T211-N216 PolarHBondContact O-N 3.4Å; T211-T217 VanDerWaalsContact CB-OG1 3.3Å; T211-T217 WeakPolarHBondContact CB-OG1 3.16Å; T211-T217 PolarHBondContact O-N 2.93Å; T211-T217 PolarHBondContact O-OG1 3.32Å; T211-T217 PolarHBondContact OG1-OG1 3.21Å
212D97.9Very high97.7Very high27 Ų2747.5 Ų47.514%0.14427%0.271CS..Hα-helixtrans-63.3-37173.3-8312.7000110.7M208 L209 T217 T218 F219 F220M208-D212 PolarHBondContact O-N 3.38Å; L209-D212 PolarHBondContact O-N 3.49Å; D212-T217 WeakPolarHBondContact CA-O 3.37Å; D212-T217 WeakPolarHBondContact CA-OG1 3.48Å; D212-T217 PolarHBondContact N-OG1 2.94Å; D212-T217 WeakPolarHBondContact OD1-CB 3.45Å; D212-T217 VanDerWaalsContact OD1-O 3.11Å; D212-T217 PolarHBondContact OD1-OG1 3.45Å; D212-T218 PolarHBondContact OD1-N 2.91Å; D212-T218 VanDerWaalsContact OD1-N 3.13Å; D212-F219 VanDerWaalsContact CG-N 3.33Å; D212-F219 WeakPolarHBondContact OD1-CD2 3.37Å; D212-F219 PolarHBondContact OD1-N 3.48Å; D212-F219 PolarHBondContact OD2-N 3.41Å; D212-F220 PolarHBondContact OD2-N 3.39Å
213R97.4Very high97.6Very high6 Ų651.7 Ų51.72%0.02331%0.307CS..Hα-helixtrans-72.8-41.6175.3-69.2170.858.268.414.8113.1A133 N135 H138 G140 D144 L209 L210 T211A133-R213 WeakPolarHBondContact O-CD 3.24Å; A133-R213 PolarHBondContact O-NH1 3.4Å; N135-R213 PolarHBondContact ND2-O 3.32Å; N135-R213 PolarHBondContact OD1-NH1 2.72Å; H138-R213 PolarHBondContact O-NH1 3.14Å; H138-R213 PolarHBondContact O-NH2 2.98Å; G140-R213 PolarHBondContact O-NH2 3.31Å; D144-R213 IonicContact OD1-CZ 3.78Å; D144-R213 IonicContact OD1-NE 3.47Å; D144-R213 PolarHBondContact OD1-NE 3.36Å; D144-R213 IonicContact OD1-NH2 2.91Å; D144-R213 PolarHBondContact OD1-NH2 3.4Å; D144-R213 IonicContact OD2-CZ 3.69Å; D144-R213 IonicContact OD2-NE 2.79Å; D144-R213 IonicContact OD2-NH2 3.58Å; D144-R213 PolarHBondContact OD2-NH2 2.87Å; L209-R213 VanDerWaalsContact O-CG 3.27Å; L209-R213 WeakPolarHBondContact O-CG 3.32Å; L209-R213 PolarHBondContact O-N 3.4Å; L210-R213 PolarHBondContact O-N 2.72Å; T211-R213 PolarHBondContact O-N 2.79Å
214N97.9Very high97.4Very high89 Ų8952 Ų5248%0.47631%0.313SS..Hα-helixtrans-114.5-19.7-164.5-66-82.5000115.1D144 L210 T211D144-N214 PolarHBondContact OD1-ND2 3.47Å; L210-N214 WeakPolarHBondContact CD1-ND2 3.38Å; L210-N214 WeakPolarHBondContact O-CB 3.25Å; L210-N214 PolarHBondContact O-N 3.49Å; L210-N214 PolarHBondContact O-ND2 3.47Å; T211-N214 PolarHBondContact O-N 3.05Å
215L97.5Very high97.2Very high122 Ų12253.3 Ų53.364%0.63933%0.331SS*.SBendtrans-122.815-171.6-57.9-177.9000113.3T211 T217T211-L215 HydrophobicContact CG2-CD1 3.87Å; T211-L215 CarbonylContact O-C 3.38Å; T211-L215 WeakPolarHBondContact O-CA 3.4Å; T211-L215 PolarHBondContact O-N 2.94Å; L215-T217 PolarHBondContact O-N 2.94Å
216N95.4Very high97.2Very high153 Ų15353.9 Ų53.982%0.81834%0.337SS*.  trans54.331.5179.8-56.3-51.2000113.8T211T211-N216 PolarHBondContact O-N 3.4Å
217T97.8Very high97.1Very high46 Ų4657.3 Ų57.328%0.28236%0.355SS..  trans-77.1166.2164.7640000109.9T211 D212 L215 F219T211-T217 VanDerWaalsContact CB-OG1 3.3Å; T211-T217 WeakPolarHBondContact CB-OG1 3.16Å; T211-T217 PolarHBondContact O-N 2.93Å; T211-T217 PolarHBondContact O-OG1 3.32Å; T211-T217 PolarHBondContact OG1-OG1 3.21Å; D212-T217 WeakPolarHBondContact CA-O 3.37Å; D212-T217 WeakPolarHBondContact CA-OG1 3.48Å; D212-T217 PolarHBondContact N-OG1 2.94Å; D212-T217 WeakPolarHBondContact OD1-CB 3.45Å; D212-T217 VanDerWaalsContact OD1-O 3.11Å; D212-T217 PolarHBondContact OD1-OG1 3.45Å; L215-T217 PolarHBondContact O-N 2.94Å; T217-F219 HydrophobicContact CG2-CE2 4.27Å
218T97.3Very high97.1Very high61 Ų6155.9 Ų55.937%0.37435%0.347SS..  trans-138.349.2-175.758.30000111.4D212 G224 G226D212-T218 PolarHBondContact OD1-N 2.91Å; D212-T218 VanDerWaalsContact OD1-N 3.13Å; T218-G224 PolarHBondContact OG1-O 2.91Å; T218-G226 WeakPolarHBondContact O-CA 3.43Å; T218-G226 PolarHBondContact O-N 2.9Å
219F98.2Very high97Very high89 Ų8956.8 Ų56.839%0.3935%0.352SS..SBendtrans-64-40.7177-72.2-75.8000112.1M208 D212 T217 G226 D227M208-F219 HydrophobicContact CB-CB 4.19Å; M208-F219 HydrophobicContact CB-CD2 3.67Å; M208-F219 HydrophobicContact CB-CE2 4.16Å; M208-F219 HydrophobicContact CB-CG 3.89Å; M208-F219 HydrophobicContact CG-CD1 4.08Å; M208-F219 HydrophobicContact CG-CD2 3.75Å; M208-F219 HydrophobicContact CG-CE1 4.12Å; M208-F219 HydrophobicContact CG-CE2 3.81Å; M208-F219 HydrophobicContact CG-CG 3.9Å; M208-F219 HydrophobicContact CG-CZ 4Å; M208-F219 HydrophobicContact SD-CD1 3.6Å; M208-F219 HydrophobicContact SD-CD2 4.36Å; M208-F219 HydrophobicContact SD-CE1 3.79Å; M208-F219 HydrophobicContact SD-CG 3.92Å; M208-F219 HydrophobicContact SD-CZ 4.26Å; D212-F219 VanDerWaalsContact CG-N 3.33Å; D212-F219 WeakPolarHBondContact OD1-CD2 3.37Å; D212-F219 PolarHBondContact OD1-N 3.48Å; D212-F219 PolarHBondContact OD2-N 3.41Å; T217-F219 HydrophobicContact CG2-CE2 4.27Å; F219-G226 CarbonylContact O-C 3.59Å; F219-G226 WeakPolarHBondContact O-CA 3.02Å; F219-D227 PolarHBondContact O-N 3.32Å
220F98.1Very high97Very high2 Ų260.1 Ų60.11%0.00937%0.37CS..SBendtrans-117.9-3.8-173.6-49.2-55.8000113.7P130 M208 L209 D212 P222 P228 L230 Y231 L234P130-F220 HydrophobicContact CB-CB 3.84Å; P130-F220 HydrophobicContact CG-CB 3.54Å; P130-F220 HydrophobicContact CG-CD2 4.01Å; P130-F220 HydrophobicContact CG-CG 3.79Å; M208-F220 HydrophobicContact CB-CE2 3.64Å; M208-F220 HydrophobicContact CB-CZ 3.73Å; M208-F220 HydrophobicContact CE-CZ 4.32Å; M208-F220 HydrophobicContact SD-CZ 4.47Å; L209-F220 HydrophobicContact CB-CD2 4.32Å; L209-F220 HydrophobicContact CB-CE2 4.03Å; L209-F220 HydrophobicContact CD1-CD2 4.35Å; D212-F220 PolarHBondContact OD2-N 3.39Å; F220-P222 WeakPolarHBondContact O-CD 3.17Å; F220-P228 VanDerWaalsContact O-CD 3.27Å; F220-P228 WeakPolarHBondContact O-CD 3.38Å; F220-P228 VanDerWaalsContact O-CG 3.3Å; F220-P228 WeakPolarHBondContact O-CG 3.48Å; F220-L230 HydrophobicContact CD1-CB 4.4Å; F220-L230 HydrophobicContact CE1-CB 4.29Å; F220-L230 HydrophobicContact CE1-CD2 4.15Å; F220-L230 HydrophobicContact CE1-CG 4.08Å; F220-Y231 HydrophobicContact CD2-CD2 4.08Å; F220-Y231 HydrophobicContact CE1-CD2 4.2Å; F220-Y231 HydrophobicContact CE1-CG 4.43Å; F220-Y231 AromaticContact CE2-CD2 3.62Å; F220-Y231 HydrophobicContact CE2-CD2 3.62Å; F220-Y231 HydrophobicContact CE2-CE2 4.46Å; F220-Y231 AromaticContact CZ-CD2 3.68Å; F220-Y231 HydrophobicContact CZ-CD2 3.68Å; F220-Y231 HydrophobicContact CZ-CG 4.35Å; F220-L234 HydrophobicContact CE1-CD1 4.24Å; F220-L234 HydrophobicContact CZ-CD1 4.21Å
221D95.9Very high97Very high78 Ų7858.9 Ų58.942%0.41736%0.363SS..  trans-88.6112.7177.9-176.40.3000111.5A223 G224 G225 G226D221-A223 PolarHBondContact O-N 3.48Å; D221-A223 WeakPolarHBondContact OD1-CB 3.2Å; D221-A223 PolarHBondContact OD1-N 2.97Å; D221-G224 PolarHBondContact O-N 3.44Å; D221-G225 PolarHBondContact O-N 2.94Å; D221-G226 WeakPolarHBondContact O-CA 3.48Å; D221-G226 PolarHBondContact O-N 3.26Å
222P95.3Very high97Very high81 Ų8159.3 Ų59.353%0.52636%0.363SS..G310 helixtrans-58.5-27.6177.1-2435.3000114.4F220 G224 G225 G226 P228F220-P222 WeakPolarHBondContact O-CD 3.17Å; P222-G224 PolarHBondContact O-N 2.97Å; P222-G225 PolarHBondContact O-N 3.39Å; P222-G225 VanDerWaalsContact O-N 3.07Å; P222-G226 WeakPolarHBondContact CA-O 3.4Å; P222-P228 HydrophobicContact CG-CG 4.01Å
223A94.1Very high97Very high97 Ų9761.2 Ų61.280%0.80237%0.371SS*.G310 helixtrans-65.2-27.9178.300000112.4D221D221-A223 PolarHBondContact O-N 3.48Å; D221-A223 WeakPolarHBondContact OD1-CB 3.2Å; D221-A223 PolarHBondContact OD1-N 2.97Å
224G94.2Very high97.1Very high40 Ų4062.6 Ų62.641%0.41238%0.379SS..G310 helixtrans-99.610.3172.800000114.5T218 D221 P222T218-G224 PolarHBondContact OG1-O 2.91Å; D221-G224 PolarHBondContact O-N 3.44Å; P222-G224 PolarHBondContact O-N 2.97Å
225G95.8Very high97.1Very high72 Ų7258.8 Ų58.874%0.74236%0.358SS*.THydrogen-bonded Turntrans84.89.1-178.300000115.5D221 P222D221-G225 PolarHBondContact O-N 2.94Å; P222-G225 PolarHBondContact O-N 3.39Å; P222-G225 VanDerWaalsContact O-N 3.07Å
226G97.3Very high97.1Very high15 Ų1553.6 Ų53.616%0.15533%0.33CS..  trans-76.7170.6173.500000113.6T218 F219 D221 P222T218-G226 WeakPolarHBondContact O-CA 3.43Å; T218-G226 PolarHBondContact O-N 2.9Å; F219-G226 CarbonylContact O-C 3.59Å; F219-G226 WeakPolarHBondContact O-CA 3.02Å; D221-G226 WeakPolarHBondContact O-CA 3.48Å; D221-G226 PolarHBondContact O-N 3.26Å; P222-G226 WeakPolarHBondContact CA-O 3.4Å
227D97.5Very high97.2Very high74 Ų7449 Ų4940%0.39630%0.303SS..  trans-132.2113.4-178.7-178.89.7000112F219 I229 L230F219-D227 PolarHBondContact O-N 3.32Å; D227-I229 PolarHBondContact O-N 2.99Å; D227-I229 WeakPolarHBondContact OD1-CB 3.49Å; D227-I229 PolarHBondContact OD1-N 2.72Å; D227-L230 HydrophobicContact CB-CB 4.31Å; D227-L230 VanDerWaalsContact O-CB 3.25Å; D227-L230 WeakPolarHBondContact O-CB 3.34Å; D227-L230 PolarHBondContact O-N 2.89Å; D227-L230 VanDerWaalsContact O-N 3.09Å
228P96.9Very high97.2Very high28 Ų2846.9 Ų46.918%0.18229%0.289CS..Hα-helixtrans-58-26.5173.1-23.431.7000114.3F220 P222 L230 Y231 Q232F220-P228 VanDerWaalsContact O-CD 3.27Å; F220-P228 WeakPolarHBondContact O-CD 3.38Å; F220-P228 VanDerWaalsContact O-CG 3.3Å; F220-P228 WeakPolarHBondContact O-CG 3.48Å; P222-P228 HydrophobicContact CG-CG 4.01Å; P228-L230 VanDerWaalsContact C-N 3.3Å; P228-Y231 WeakPolarHBondContact O-CB 3.32Å; P228-Y231 PolarHBondContact O-N 3.25Å; P228-Q232 PolarHBondContact O-N 3.25Å
229I97.9Very high97.1Very high56 Ų5644 Ų4429%0.28727%0.272SS..Hα-helixtrans-70.2-30.3178.1-59.2175.9000110.6D227 Y231 Q232 H233 M292 V295D227-I229 PolarHBondContact O-N 2.99Å; D227-I229 WeakPolarHBondContact OD1-CB 3.49Å; D227-I229 PolarHBondContact OD1-N 2.72Å; I229-Y231 VanDerWaalsContact C-N 3.27Å; I229-Y231 PolarHBondContact O-N 3.39Å; I229-Q232 WeakPolarHBondContact O-CB 3.11Å; I229-Q232 PolarHBondContact O-N 2.91Å; I229-H233 PolarHBondContact O-CD2 2.88Å; I229-H233 PolarHBondContact O-N 3.33Å; I229-M292 HydrophobicContact CG2-CE 3.73Å; I229-V295 HydrophobicContact CD1-CB 4.4Å; I229-V295 HydrophobicContact CG2-CG2 4.24Å
230L98.1Very high97Very high71 Ų7140.1 Ų40.137%0.37226%0.255SS..Hα-helixtrans-56.7-43.4170.9177.762.1000111.1F220 D227 P228 Q232 H233 L234F220-L230 HydrophobicContact CD1-CB 4.4Å; F220-L230 HydrophobicContact CE1-CB 4.29Å; F220-L230 HydrophobicContact CE1-CD2 4.15Å; F220-L230 HydrophobicContact CE1-CG 4.08Å; D227-L230 HydrophobicContact CB-CB 4.31Å; D227-L230 VanDerWaalsContact O-CB 3.25Å; D227-L230 WeakPolarHBondContact O-CB 3.34Å; D227-L230 PolarHBondContact O-N 2.89Å; D227-L230 VanDerWaalsContact O-N 3.09Å; P228-L230 VanDerWaalsContact C-N 3.3Å; L230-Q232 VanDerWaalsContact C-N 3.3Å; L230-Q232 PolarHBondContact O-N 3.44Å; L230-H233 PolarHBondContact O-N 3.37Å; L230-L234 HydrophobicContact CD1-CD1 4.38Å; L230-L234 HydrophobicContact CD1-CG 4.38Å; L230-L234 HydrophobicContact CG-CD1 4.13Å; L230-L234 WeakPolarHBondContact O-CG 3.33Å; L230-L234 PolarHBondContact O-N 3.15Å
231Y98.4Very high96.9Very high2 Ų240 Ų401%0.00825%0.254CS..Hα-helixtrans-59.8-43175.8-175.5-81.7000111.1T127 V128 Y129 P130 L209 F220 P228 I229 H233 L234 F235T127-Y231 WeakPolarHBondContact O-CE1 3.22Å; T127-Y231 PolarHBondContact O-OH 3.36Å; V128-Y231 PolarHBondContact O-OH 3.26Å; Y129-Y231 AromaticContact CD1-CD1 3.59Å; Y129-Y231 HydrophobicContact CD1-CD1 3.59Å; Y129-Y231 AromaticContact CD1-CE1 3.61Å; Y129-Y231 HydrophobicContact CD1-CE1 3.61Å; Y129-Y231 HydrophobicContact CE1-CD1 4.11Å; Y129-Y231 HydrophobicContact CE1-CE1 4.12Å; P130-Y231 HydrophobicContact CG-CD1 4.42Å; P130-Y231 HydrophobicContact CG-CD2 4.08Å; P130-Y231 HydrophobicContact CG-CG 3.8Å; L209-Y231 HydrophobicContact CB-CE2 4.19Å; L209-Y231 HydrophobicContact CD2-CE2 3.98Å; F220-Y231 HydrophobicContact CD2-CD2 4.08Å; F220-Y231 HydrophobicContact CE1-CD2 4.2Å; F220-Y231 HydrophobicContact CE1-CG 4.43Å; F220-Y231 AromaticContact CE2-CD2 3.62Å; F220-Y231 HydrophobicContact CE2-CD2 3.62Å; F220-Y231 HydrophobicContact CE2-CE2 4.46Å; F220-Y231 AromaticContact CZ-CD2 3.68Å; F220-Y231 HydrophobicContact CZ-CD2 3.68Å; F220-Y231 HydrophobicContact CZ-CG 4.35Å; P228-Y231 WeakPolarHBondContact O-CB 3.32Å; P228-Y231 PolarHBondContact O-N 3.25Å; I229-Y231 VanDerWaalsContact C-N 3.27Å; I229-Y231 PolarHBondContact O-N 3.39Å; Y231-H233 VanDerWaalsContact C-N 3.33Å; Y231-H233 PolarHBondContact O-N 3.22Å; Y231-L234 PolarHBondContact O-N 3.49Å; Y231-F235 HydrophobicContact CD1-CB 4.16Å; Y231-F235 HydrophobicContact CE1-CB 3.84Å; Y231-F235 HydrophobicContact CE1-CD2 4.08Å; Y231-F235 HydrophobicContact CE1-CG 4.19Å; Y231-F235 VanDerWaalsContact O-CB 3.25Å; Y231-F235 WeakPolarHBondContact O-CB 3.48Å; Y231-F235 PolarHBondContact O-N 3.37Å
232Q98.1Very high96.9Very high37 Ų3736.4 Ų36.417%0.17324%0.235CC..Hα-helixtrans-61.2-41.6178-63.8-167.841.200112.1Y129 P228 I229 L230 W236 M292Y129-Q232 HydrophobicContact CD1-CG 4.23Å; Y129-Q232 HydrophobicContact CE1-CG 3.87Å; Y129-Q232 HydrophobicContact CE2-CG 4.44Å; P228-Q232 PolarHBondContact O-N 3.25Å; I229-Q232 WeakPolarHBondContact O-CB 3.11Å; I229-Q232 PolarHBondContact O-N 2.91Å; L230-Q232 VanDerWaalsContact C-N 3.3Å; L230-Q232 PolarHBondContact O-N 3.44Å; Q232-W236 WeakPolarHBondContact O-CB 3.15Å; Q232-W236 PolarHBondContact O-N 2.88Å; Q232-M292 HydrophobicContact CB-CE 3.55Å; Q232-M292 HydrophobicContact CB-CG 4.38Å; Q232-M292 HydrophobicContact CB-SD 3.99Å
233H98.2Very high96.8Very high67 Ų6733.7 Ų33.731%0.3122%0.217SC..Hα-helixtrans-61.6-47.6175.3-76.9-60.6000112I229 L230 Y231 W236 F237 W288 M292I229-H233 PolarHBondContact O-CD2 2.88Å; I229-H233 PolarHBondContact O-N 3.33Å; L230-H233 PolarHBondContact O-N 3.37Å; Y231-H233 VanDerWaalsContact C-N 3.33Å; Y231-H233 PolarHBondContact O-N 3.22Å; H233-W236 PolarHBondContact O-N 3.26Å; H233-F237 WeakPolarHBondContact O-CB 3.27Å; H233-F237 PolarHBondContact O-N 3.39Å; H233-W288 AromaticContact ND1-NE1 3.58Å; H233-M292 WeakPolarHBondContact CE1-CE 3.36Å; H233-M292 WeakPolarHBondContact ND1-CE 3.38Å; H233-M292 PolarHBondContact ND1-SD 3.4Å
234L98.3Very high96.7Very high35 Ų3530.6 Ų30.618%0.18319%0.185CC..Hα-helixtrans-62.8-46178.8-66.3169.4000111.6V201 M208 F220 L230 Y231 F238V201-L234 HydrophobicContact CG1-CB 4.34Å; V201-L234 HydrophobicContact CG1-CD2 3.86Å; M208-L234 HydrophobicContact CE-CD1 3.31Å; F220-L234 HydrophobicContact CE1-CD1 4.24Å; F220-L234 HydrophobicContact CZ-CD1 4.21Å; L230-L234 HydrophobicContact CD1-CD1 4.38Å; L230-L234 HydrophobicContact CD1-CG 4.38Å; L230-L234 HydrophobicContact CG-CD1 4.13Å; L230-L234 WeakPolarHBondContact O-CG 3.33Å; L230-L234 PolarHBondContact O-N 3.15Å; Y231-L234 PolarHBondContact O-N 3.49Å; L234-F238 PolarHBondContact O-N 2.88Å
235F98.4Very high96.7Very high9 Ų928.8 Ų28.84%0.03917%0.165CC..Hα-helixtrans-62.2-48.2179.4-177.1-88.2000111.1W126 T127 Y129 L202 Y231 F238 G239W126-F235 HydrophobicContact CD2-CZ 4.31Å; W126-F235 AromaticContact CE3-CZ 3.71Å; W126-F235 HydrophobicContact CE3-CZ 3.71Å; W126-F235 AromaticContact CH2-CE1 3.89Å; W126-F235 HydrophobicContact CH2-CE1 3.89Å; W126-F235 AromaticContact CH2-CZ 3.85Å; W126-F235 HydrophobicContact CH2-CZ 3.85Å; W126-F235 HydrophobicContact CZ2-CE1 4.33Å; W126-F235 HydrophobicContact CZ2-CZ 4.43Å; W126-F235 HydrophobicContact CZ3-CE1 4Å; W126-F235 AromaticContact CZ3-CZ 3.46Å; W126-F235 HydrophobicContact CZ3-CZ 3.46Å; W126-F235 VanDerWaalsContact CZ3-CZ 3.46Å; T127-F235 HydrophobicContact CG2-CD1 4.35Å; T127-F235 HydrophobicContact CG2-CE1 3.67Å; T127-F235 HydrophobicContact CG2-CZ 3.93Å; Y129-F235 HydrophobicContact CE1-CD1 4.36Å; Y129-F235 HydrophobicContact CE1-CG 4.44Å; L202-F235 HydrophobicContact CD1-CD2 3.94Å; L202-F235 HydrophobicContact CD1-CE2 4.18Å; Y231-F235 HydrophobicContact CD1-CB 4.16Å; Y231-F235 HydrophobicContact CE1-CB 3.84Å; Y231-F235 HydrophobicContact CE1-CD2 4.08Å; Y231-F235 HydrophobicContact CE1-CG 4.19Å; Y231-F235 VanDerWaalsContact O-CB 3.25Å; Y231-F235 WeakPolarHBondContact O-CB 3.48Å; Y231-F235 PolarHBondContact O-N 3.37Å; F235-F238 WeakPolarHBondContact O-CB 3.24Å; F235-F238 PolarHBondContact O-N 3.46Å; F235-G239 WeakPolarHBondContact O-CA 3.36Å; F235-G239 PolarHBondContact O-N 2.93Å
236W98.3Very high96.5Very high12 Ų1225.4 Ų25.45%0.04513%0.131CC..Hα-helixtrans-77.1-28-177.1-72.9125.7000113.8W126 T127 Y129 Q232 H233 F238 G239 H240 W288 H291W126-W236 HydrophobicContact CH2-CH2 4.27Å; W126-W236 HydrophobicContact CH2-CZ3 4.06Å; W126-W236 AromaticContact CZ2-CH2 3.79Å; W126-W236 HydrophobicContact CZ2-CH2 3.79Å; W126-W236 HydrophobicContact CZ2-CZ3 4.02Å; T127-W236 HydrophobicContact CG2-CH2 4.38Å; T127-W236 HydrophobicContact CG2-CZ2 4.14Å; Y129-W236 AromaticContact CZ-NE1 3.97Å; Y129-W236 WeakPolarHBondContact OH-CZ2 3.47Å; Y129-W236 PolarHBondContact OH-NE1 3.37Å; Q232-W236 WeakPolarHBondContact O-CB 3.15Å; Q232-W236 PolarHBondContact O-N 2.88Å; H233-W236 PolarHBondContact O-N 3.26Å; W236-F238 PolarHBondContact O-N 3.5Å; W236-G239 PolarHBondContact O-N 2.87Å; W236-G239 VanDerWaalsContact O-N 3.12Å; W236-H240 PolarHBondContact O-N 3.22Å; W236-W288 HydrophobicContact CB-CB 4.19Å; W236-W288 VanDerWaalsContact O-CB 3.25Å; W236-W288 WeakPolarHBondContact O-CB 3.41Å; W236-H291 HydrophobicContact CD2-CB 3.4Å; W236-H291 AromaticContact CD2-CD2 3.54Å; W236-H291 AromaticContact CD2-CG 3.55Å; W236-H291 AromaticContact CE2-CG 3.75Å; W236-H291 HydrophobicContact CE3-CB 3.96Å; W236-H291 AromaticContact CE3-CD2 3.21Å; W236-H291 AromaticContact CE3-CG 3.53Å; W236-H291 AromaticContact CE3-NE2 3.6Å; W236-H291 HydrophobicContact CG-CB 3.67Å; W236-H291 HydrophobicContact CH2-CB 4.29Å; W236-H291 AromaticContact CH2-CG 3.95Å; W236-H291 AromaticContact CH2-ND1 3.82Å; W236-H291 HydrophobicContact CZ2-CB 3.78Å; W236-H291 AromaticContact CZ2-CG 3.96Å; W236-H291 HydrophobicContact CZ3-CB 4.36Å; W236-H291 AromaticContact CZ3-CD2 3.66Å; W236-H291 AromaticContact CZ3-CE1 3.74Å; W236-H291 AromaticContact CZ3-CG 3.74Å; W236-H291 AromaticContact CZ3-ND1 3.81Å; W236-H291 AromaticContact CZ3-NE2 3.63Å
237F97.8Very high96.5Very high58 Ų5824.9 Ų24.925%0.25412%0.124SC..Hα-helixtrans-56.8-35.7169.4-175.7-85.3000111.1V201 H233 P241 F285 W288V201-F237 HydrophobicContact CB-CD1 3.89Å; V201-F237 HydrophobicContact CB-CE1 4.44Å; V201-F237 HydrophobicContact CG1-CB 4.28Å; V201-F237 HydrophobicContact CG1-CD1 3.79Å; V201-F237 HydrophobicContact CG1-CG 4.34Å; V201-F237 HydrophobicContact CG2-CD1 3.64Å; V201-F237 HydrophobicContact CG2-CE1 3.7Å; H233-F237 WeakPolarHBondContact O-CB 3.27Å; H233-F237 PolarHBondContact O-N 3.39Å; F237-P241 WeakPolarHBondContact O-CD 3.33Å; F237-P241 WeakPolarHBondContact O-CG 3.35Å; F237-F285 HydrophobicContact CE1-CD1 4.02Å; F237-F285 HydrophobicContact CE1-CE1 4.14Å; F237-F285 HydrophobicContact CE2-CD1 4.38Å; F237-F285 AromaticContact CZ-CD1 3.79Å; F237-F285 HydrophobicContact CZ-CD1 3.79Å; F237-F285 HydrophobicContact CZ-CE1 4.32Å; F237-W288 HydrophobicContact CB-CG 4.43Å; F237-W288 HydrophobicContact CD2-CD2 4.16Å; F237-W288 HydrophobicContact CD2-CE3 4.12Å; F237-W288 HydrophobicContact CD2-CZ3 4.35Å
238F97.3Very high96.3Very high0 Ų021.4 Ų21.40%011%0.105CC..Hα-helixtrans-77.3-50.1166.4154.3-101.8000112.5F67 L199 L202 L234 F235 W236 H240 P241 E242F67-F238 HydrophobicContact CE1-CZ 4.08Å; F67-F238 HydrophobicContact CZ-CE1 4.29Å; F67-F238 HydrophobicContact CZ-CZ 4.02Å; L199-F238 HydrophobicContact CD2-CD2 4.08Å; L199-F238 HydrophobicContact CD2-CE2 3.48Å; L199-F238 VanDerWaalsContact CD2-CE2 3.48Å; L199-F238 HydrophobicContact CD2-CZ 4.25Å; L199-F238 HydrophobicContact CG-CE2 4.33Å; L202-F238 HydrophobicContact CB-CB 3.87Å; L202-F238 HydrophobicContact CB-CD1 3.84Å; L202-F238 HydrophobicContact CB-CD2 4Å; L202-F238 HydrophobicContact CB-CE1 4.43Å; L202-F238 HydrophobicContact CB-CG 3.6Å; L202-F238 HydrophobicContact CD1-CD1 3.8Å; L202-F238 HydrophobicContact CD1-CE1 4.15Å; L202-F238 HydrophobicContact CD1-CG 4.43Å; L202-F238 HydrophobicContact CD2-CD1 3.88Å; L202-F238 HydrophobicContact CD2-CD2 4.42Å; L202-F238 HydrophobicContact CD2-CE1 3.62Å; L202-F238 HydrophobicContact CD2-CE2 4.18Å; L202-F238 HydrophobicContact CD2-CG 4.28Å; L202-F238 HydrophobicContact CD2-CZ 3.77Å; L202-F238 HydrophobicContact CG-CD1 4.04Å; L202-F238 HydrophobicContact CG-CE1 4.27Å; L202-F238 HydrophobicContact CG-CG 4.3Å; L234-F238 PolarHBondContact O-N 2.88Å; F235-F238 WeakPolarHBondContact O-CB 3.24Å; F235-F238 PolarHBondContact O-N 3.46Å; W236-F238 PolarHBondContact O-N 3.5Å; F238-H240 VanDerWaalsContact C-N 3.33Å; F238-H240 PolarHBondContact O-N 2.9Å; F238-P241 VanDerWaalsContact O-CD 3.23Å; F238-P241 WeakPolarHBondContact O-CD 3.43Å; F238-E242 HydrophobicContact CD2-CB 4.32Å; F238-E242 HydrophobicContact CE1-CB 4.14Å; F238-E242 HydrophobicContact CE1-CG 4.21Å; F238-E242 HydrophobicContact CE2-CB 3.74Å; F238-E242 HydrophobicContact CE2-CG 3.93Å; F238-E242 WeakPolarHBondContact CE2-OE2 3.49Å; F238-E242 HydrophobicContact CZ-CB 3.65Å; F238-E242 HydrophobicContact CZ-CG 3.51Å; F238-E242 WeakPolarHBondContact O-CB 3.17Å; F238-E242 PolarHBondContact O-N 3.2Å
239G95.3Very high96.4Very high0 Ų020.1 Ų20.10%010%0.097CC..Hα-helixtrans-65.8-32.3-164.300000113.4F235 W236 E242 V243F235-G239 WeakPolarHBondContact O-CA 3.36Å; F235-G239 PolarHBondContact O-N 2.93Å; W236-G239 PolarHBondContact O-N 2.87Å; W236-G239 VanDerWaalsContact O-N 3.12Å; G239-E242 WeakPolarHBondContact O-CB 3.22Å; G239-E242 PolarHBondContact O-N 3.31Å; G239-V243 WeakPolarHBondContact O-CG1 3.12Å; G239-V243 PolarHBondContact O-N 3.43Å
240H95.8Very high96.3Very high8 Ų817.4 Ų17.44%0.0378%0.083CC..Hα-helixtrans-74.3-46.5176.6-165.878000113.2W236 F238 E242 V243 Y244 G284 V287 W288 H290 H291W236-H240 PolarHBondContact O-N 3.22Å; F238-H240 VanDerWaalsContact C-N 3.33Å; F238-H240 PolarHBondContact O-N 2.9Å; H240-E242 PolarHBondContact O-N 3.43Å; H240-V243 WeakPolarHBondContact O-CG2 3.28Å; H240-V243 PolarHBondContact O-N 2.93Å; H240-Y244 AromaticContact CD2-CE2 3.49Å; H240-Y244 VanDerWaalsContact CD2-CE2 3.49Å; H240-Y244 WeakPolarHBondContact CD2-CE2 3.21Å; H240-Y244 AromaticContact CE1-CE2 3.99Å; H240-Y244 AromaticContact CE1-CZ 3.81Å; H240-Y244 PolarHBondContact CE1-OH 3.41Å; H240-Y244 AromaticContact NE2-CE2 3Å; H240-Y244 WeakPolarHBondContact NE2-CE2 3.41Å; H240-Y244 AromaticContact NE2-CZ 3.15Å; H240-Y244 PolarHBondContact NE2-OH 3.39Å; H240-G284 PolarHBondContact CD2-O 2.84Å; H240-V287 WeakPolarHBondContact CD2-CG2 3.48Å; H240-V287 WeakPolarHBondContact NE2-CG2 3.39Å; H240-W288 HydrophobicContact CB-CB 4.09Å; H240-H290 AromaticContact CE1-CE1 3.04Å; H240-H290 PolarHBondContact CE1-CE1 3.34Å; H240-H290 AromaticContact CE1-NE2 3.32Å; H240-H290 PolarHBondContact CE1-NE2 3.2Å; H240-H290 VanDerWaalsContact CE1-NE2 3.32Å; H240-H290 AromaticContact CG-CE1 3.76Å; H240-H290 AromaticContact ND1-CE1 3Å; H240-H290 PolarHBondContact ND1-CE1 3.5Å; H240-H290 AromaticContact ND1-NE2 2.99Å; H240-H290 PolarHBondContact ND1-NE2 3.24Å; H240-H290 AromaticContact NE2-CE1 3.71Å; H240-H291 AromaticContact ND1-NE2 3.3Å; H240-H291 PolarHBondContact ND1-NE2 3.48Å
241P96.5Very high96.3Very high0 Ų014.2 Ų14.20%07%0.066CC..Hα-helixtrans-53.5-39.2165.1-30.436.3000113.8F237 F238 V243 Y244 I245 G284 F285F237-P241 WeakPolarHBondContact O-CD 3.33Å; F237-P241 WeakPolarHBondContact O-CG 3.35Å; F238-P241 VanDerWaalsContact O-CD 3.23Å; F238-P241 WeakPolarHBondContact O-CD 3.43Å; P241-V243 PolarHBondContact O-N 3.2Å; P241-Y244 WeakPolarHBondContact O-CA 3.37Å; P241-Y244 WeakPolarHBondContact O-CB 3.24Å; P241-Y244 PolarHBondContact O-N 3.39Å; P241-I245 WeakPolarHBondContact O-CG1 3.43Å; P241-I245 PolarHBondContact O-N 2.95Å; P241-G284 WeakPolarHBondContact CD-O 3.05Å; P241-F285 HydrophobicContact CB-CE1 4.16Å; P241-F285 HydrophobicContact CB-CZ 4.44Å; P241-F285 HydrophobicContact CG-CD1 3.68Å; P241-F285 HydrophobicContact CG-CE1 3.67Å; P241-F285 HydrophobicContact CG-CG 4.35Å; P241-F285 HydrophobicContact CG-CZ 4.36Å
242E94.8Very high96.3Very high2 Ų214.1 Ų14.11%0.0097%0.066CC..Hα-helixtrans-58.9-45.1179.5-177.359.5-156.500112.2M71 F238 G239 H240 Y244 I245 L246M71-E242 WeakPolarHBondContact CE-OE1 3.38Å; F238-E242 HydrophobicContact CD2-CB 4.32Å; F238-E242 HydrophobicContact CE1-CB 4.14Å; F238-E242 HydrophobicContact CE1-CG 4.21Å; F238-E242 HydrophobicContact CE2-CB 3.74Å; F238-E242 HydrophobicContact CE2-CG 3.93Å; F238-E242 WeakPolarHBondContact CE2-OE2 3.49Å; F238-E242 HydrophobicContact CZ-CB 3.65Å; F238-E242 HydrophobicContact CZ-CG 3.51Å; F238-E242 WeakPolarHBondContact O-CB 3.17Å; F238-E242 PolarHBondContact O-N 3.2Å; G239-E242 WeakPolarHBondContact O-CB 3.22Å; G239-E242 PolarHBondContact O-N 3.31Å; H240-E242 PolarHBondContact O-N 3.43Å; E242-Y244 PolarHBondContact O-N 3.45Å; E242-Y244 VanDerWaalsContact O-N 3.1Å; E242-I245 WeakPolarHBondContact O-CA 3.2Å; E242-I245 VanDerWaalsContact O-CB 3.31Å; E242-I245 WeakPolarHBondContact O-CB 3.43Å; E242-I245 PolarHBondContact O-N 3.45Å; E242-I245 WeakPolarHBondContact OE2-CD1 3.11Å; E242-L246 HydrophobicContact CG-CD1 4.33Å; E242-L246 HydrophobicContact CG-CG 4.49Å; E242-L246 VanDerWaalsContact O-CG 3.3Å; E242-L246 WeakPolarHBondContact O-CG 3.28Å; E242-L246 PolarHBondContact O-N 2.81Å
243V93Very high96.3Very high24 Ų2412.4 Ų12.415%0.1456%0.058CC..Hα-helixtrans-62.3-25.2177.8-590000112.5G239 H240 P241 F377G239-V243 WeakPolarHBondContact O-CG1 3.12Å; G239-V243 PolarHBondContact O-N 3.43Å; H240-V243 WeakPolarHBondContact O-CG2 3.28Å; H240-V243 PolarHBondContact O-N 2.93Å; P241-V243 PolarHBondContact O-N 3.2Å; V243-F377 HydrophobicContact CB-CE2 4.11Å; V243-F377 HydrophobicContact CG1-CE2 3.43Å; V243-F377 VanDerWaalsContact CG1-CE2 3.43Å; V243-F377 HydrophobicContact CG1-CZ 3.82Å
244Y92.8Very high96.3Very high33 Ų339.2 Ų9.213%0.1294%0.043CC..Hα-helixtrans-80.6-35.8171-63.5-44.6000113.9H240 P241 E242 L246 I247 R248 I280 I312H240-Y244 AromaticContact CD2-CE2 3.49Å; H240-Y244 VanDerWaalsContact CD2-CE2 3.49Å; H240-Y244 WeakPolarHBondContact CD2-CE2 3.21Å; H240-Y244 AromaticContact CE1-CE2 3.99Å; H240-Y244 AromaticContact CE1-CZ 3.81Å; H240-Y244 PolarHBondContact CE1-OH 3.41Å; H240-Y244 AromaticContact NE2-CE2 3Å; H240-Y244 WeakPolarHBondContact NE2-CE2 3.41Å; H240-Y244 AromaticContact NE2-CZ 3.15Å; H240-Y244 PolarHBondContact NE2-OH 3.39Å; P241-Y244 WeakPolarHBondContact O-CA 3.37Å; P241-Y244 WeakPolarHBondContact O-CB 3.24Å; P241-Y244 PolarHBondContact O-N 3.39Å; E242-Y244 PolarHBondContact O-N 3.45Å; E242-Y244 VanDerWaalsContact O-N 3.1Å; Y244-L246 PolarHBondContact O-N 3.01Å; Y244-I247 HydrophobicContact CD1-CG2 4.4Å; Y244-I247 PolarHBondContact O-N 3.19Å; Y244-I247 VanDerWaalsContact O-N 3.17Å; Y244-R248 WeakPolarHBondContact O-CB 3.29Å; Y244-R248 WeakPolarHBondContact O-CG 3.28Å; Y244-R248 PolarHBondContact O-N 3.43Å; Y244-I280 HydrophobicContact CD1-CG2 3.82Å; Y244-I280 HydrophobicContact CD2-CG2 4.1Å; Y244-I280 HydrophobicContact CE1-CG2 3.94Å; Y244-I280 HydrophobicContact CE2-CG2 4.18Å; Y244-I280 HydrophobicContact CG-CG2 3.94Å; Y244-I312 HydrophobicContact CE2-CD1 4.18Å; Y244-I312 WeakPolarHBondContact OH-CD1 3.26Å
245I93.9Very high96.2Very high1 Ų17.6 Ų7.61%0.0054%0.035CC..Hα-helixtrans-54.1-42170.6-73.6159.2000109.4M71 I75 T191 L194 L195 P241 E242 I247 P249M71-I245 HydrophobicContact SD-CG2 4.48Å; I75-I245 HydrophobicContact CD1-CG2 3.82Å; T191-I245 HydrophobicContact CG2-CB 4Å; T191-I245 HydrophobicContact CG2-CG1 4.08Å; T191-I245 HydrophobicContact CG2-CG2 3.63Å; L194-I245 HydrophobicContact CB-CD1 3.73Å; L194-I245 HydrophobicContact CB-CG1 3.66Å; L194-I245 HydrophobicContact CD1-CG1 4.11Å; L195-I245 HydrophobicContact CB-CD1 4.5Å; L195-I245 HydrophobicContact CD1-CG2 4.3Å; L195-I245 HydrophobicContact CD2-CD1 3.78Å; L195-I245 HydrophobicContact CD2-CG1 4.47Å; L195-I245 HydrophobicContact CD2-CG2 3.81Å; L195-I245 HydrophobicContact CG-CD1 3.83Å; L195-I245 HydrophobicContact CG-CG1 4.21Å; L195-I245 HydrophobicContact CG-CG2 3.92Å; P241-I245 WeakPolarHBondContact O-CG1 3.43Å; P241-I245 PolarHBondContact O-N 2.95Å; E242-I245 WeakPolarHBondContact O-CA 3.2Å; E242-I245 VanDerWaalsContact O-CB 3.31Å; E242-I245 WeakPolarHBondContact O-CB 3.43Å; E242-I245 PolarHBondContact O-N 3.45Å; E242-I245 WeakPolarHBondContact OE2-CD1 3.11Å; I245-I247 VanDerWaalsContact C-N 3.29Å; I245-I247 PolarHBondContact O-N 2.9Å; I245-P249 VanDerWaalsContact O-CD 3.25Å; I245-P249 WeakPolarHBondContact O-CD 3.35Å
246L93Very high96Very high2 Ų28 Ų81%0.014%0.037CC..THydrogen-bonded Turntrans-72-6.4179.7-63.5172.1000115.8I66 V70 M71 M74 E242 Y244 L381 A385I66-L246 HydrophobicContact CG1-CD1 4.35Å; I66-L246 HydrophobicContact CG2-CD1 3.77Å; I66-L246 HydrophobicContact CG2-CD2 4.12Å; V70-L246 HydrophobicContact CB-CD2 4.13Å; V70-L246 HydrophobicContact CG1-CB 4.3Å; V70-L246 HydrophobicContact CG1-CD2 3.72Å; M71-L246 HydrophobicContact CG-CD2 3.63Å; M74-L246 WeakPolarHBondContact CE-O 3.44Å; E242-L246 HydrophobicContact CG-CD1 4.33Å; E242-L246 HydrophobicContact CG-CG 4.49Å; E242-L246 VanDerWaalsContact O-CG 3.3Å; E242-L246 WeakPolarHBondContact O-CG 3.28Å; E242-L246 PolarHBondContact O-N 2.81Å; Y244-L246 PolarHBondContact O-N 3.01Å; L246-L381 HydrophobicContact CB-CD1 3.66Å; L246-L381 HydrophobicContact CD1-CD1 3.64Å; L246-L381 HydrophobicContact CG-CD1 4.22Å; L246-A385 VanDerWaalsContact O-CB 3.29Å; L246-A385 WeakPolarHBondContact O-CB 3.36Å
247I95.4Very high95.9Very high4 Ų47.5 Ų7.52%0.0214%0.035CC..THydrogen-bonded Turntrans-127.1-23.6-177.8-16561.4000113.8Y244 I245 G250 F251 F344 F348 G384 A385Y244-I247 HydrophobicContact CD1-CG2 4.4Å; Y244-I247 PolarHBondContact O-N 3.19Å; Y244-I247 VanDerWaalsContact O-N 3.17Å; I245-I247 VanDerWaalsContact C-N 3.29Å; I245-I247 PolarHBondContact O-N 2.9Å; I247-G250 CarbonylContact O-C 3.59Å; I247-G250 VanDerWaalsContact O-CA 3.27Å; I247-G250 WeakPolarHBondContact O-CA 3.3Å; I247-G250 PolarHBondContact O-N 2.86Å; I247-F251 HydrophobicContact CB-CZ 4.36Å; I247-F251 HydrophobicContact CD1-CE1 4.47Å; I247-F251 HydrophobicContact CG1-CD1 4.25Å; I247-F251 HydrophobicContact CG1-CE1 3.59Å; I247-F251 HydrophobicContact CG1-CE2 4.47Å; I247-F251 HydrophobicContact CG1-CZ 3.71Å; I247-F251 HydrophobicContact CG2-CE1 4.46Å; I247-F251 HydrophobicContact CG2-CE2 3.91Å; I247-F251 HydrophobicContact CG2-CZ 3.75Å; I247-F251 PolarHBondContact O-N 3.17Å; I247-F344 HydrophobicContact CD1-CE2 3.88Å; I247-F344 HydrophobicContact CD1-CZ 4.28Å; I247-F348 HydrophobicContact CD1-CD2 4.42Å; I247-F348 HydrophobicContact CD1-CE2 4.41Å; I247-F348 HydrophobicContact CG1-CD2 4.36Å; I247-F348 HydrophobicContact CG1-CE2 3.87Å; I247-G384 VanDerWaalsContact CD1-C 3.47Å; I247-A385 HydrophobicContact CD1-CB 4.36Å
248R95.2Very high95.8Very high1 Ų14.9 Ų4.90%0.0042%0.024CC..Hα-helixtrans-59.1-49.6-177.9-79.7169.4-150.4-94.4-4.5113.8S187 I190 T191 L194 Y244 G250 F251 G252 M277 I280 G281S187-R248 VanDerWaalsContact CB-O 3.28Å; S187-R248 WeakPolarHBondContact CB-O 3.41Å; I190-R248 VanDerWaalsContact CG2-NH1 3.3Å; T191-R248 WeakPolarHBondContact OG1-CB 3.25Å; L194-R248 VanDerWaalsContact CD1-NH2 3.28Å; Y244-R248 WeakPolarHBondContact O-CB 3.29Å; Y244-R248 WeakPolarHBondContact O-CG 3.28Å; Y244-R248 PolarHBondContact O-N 3.43Å; R248-G250 PolarHBondContact O-N 3.37Å; R248-F251 HydrophobicContact CG-CD2 4.35Å; R248-F251 WeakPolarHBondContact O-CA 3.45Å; R248-F251 VanDerWaalsContact O-CB 3.26Å; R248-F251 WeakPolarHBondContact O-CB 3.22Å; R248-F251 PolarHBondContact O-N 3.09Å; R248-G252 PolarHBondContact O-N 2.92Å; R248-G252 VanDerWaalsContact O-N 3.09Å; R248-M277 PolarHBondContact NH1-O 3.46Å; R248-I280 PolarHBondContact NH2-O 3.19Å; R248-G281 VanDerWaalsContact CZ-CA 3.48Å
249P97.4Very high95.6Very high0 Ų05.6 Ų5.60%03%0.028CC..Hα-helixtrans-56.1-34.1174.1-24.934.8000111.9M74 I75 F184 S187 T191 I245 F251 G252 M253M74-P249 HydrophobicContact CB-CB 4.05Å; M74-P249 HydrophobicContact CB-CG 4.29Å; M74-P249 HydrophobicContact CE-CB 4.06Å; M74-P249 HydrophobicContact CE-CG 4.07Å; M74-P249 HydrophobicContact SD-CB 4.08Å; I75-P249 HydrophobicContact CG1-CG 3.99Å; F184-P249 HydrophobicContact CE2-CB 4.12Å; S187-P249 WeakPolarHBondContact OG-CA 3.45Å; T191-P249 HydrophobicContact CG2-CG 4.42Å; I245-P249 VanDerWaalsContact O-CD 3.25Å; I245-P249 WeakPolarHBondContact O-CD 3.35Å; P249-F251 PolarHBondContact O-N 2.62Å; P249-G252 WeakPolarHBondContact O-CA 3.35Å; P249-G252 PolarHBondContact O-N 3.05Å; P249-G252 VanDerWaalsContact O-N 3.17Å; P249-M253 WeakPolarHBondContact O-CG 3.19Å; P249-M253 PolarHBondContact O-N 3.3Å
250G97.3Very high95.5Very high0 Ų07.6 Ų7.60%04%0.036CC..Hα-helixtrans-57.5-46.6171.300000112.7I247 R248 G252 M253 I254 A388I247-G250 CarbonylContact O-C 3.59Å; I247-G250 VanDerWaalsContact O-CA 3.27Å; I247-G250 WeakPolarHBondContact O-CA 3.3Å; I247-G250 PolarHBondContact O-N 2.86Å; R248-G250 PolarHBondContact O-N 3.37Å; G250-G252 VanDerWaalsContact C-N 3.29Å; G250-G252 PolarHBondContact O-N 2.69Å; G250-M253 PolarHBondContact O-N 3.4Å; G250-I254 VanDerWaalsContact O-CG1 3.28Å; G250-I254 WeakPolarHBondContact O-CG1 3.29Å; G250-I254 PolarHBondContact O-N 2.76Å; G250-A388 VanDerWaalsContact CA-CB 3.43Å
251F97.6Very high95.3Very high4 Ų49.5 Ų9.52%0.0184%0.043CC..Hα-helixtrans-58.5-41.6173.6-56.2-31.2000112.8I247 R248 P249 S255 K319 W323 F344 F348I247-F251 HydrophobicContact CB-CZ 4.36Å; I247-F251 HydrophobicContact CD1-CE1 4.47Å; I247-F251 HydrophobicContact CG1-CD1 4.25Å; I247-F251 HydrophobicContact CG1-CE1 3.59Å; I247-F251 HydrophobicContact CG1-CE2 4.47Å; I247-F251 HydrophobicContact CG1-CZ 3.71Å; I247-F251 HydrophobicContact CG2-CE1 4.46Å; I247-F251 HydrophobicContact CG2-CE2 3.91Å; I247-F251 HydrophobicContact CG2-CZ 3.75Å; I247-F251 PolarHBondContact O-N 3.17Å; R248-F251 HydrophobicContact CG-CD2 4.35Å; R248-F251 WeakPolarHBondContact O-CA 3.45Å; R248-F251 VanDerWaalsContact O-CB 3.26Å; R248-F251 WeakPolarHBondContact O-CB 3.22Å; R248-F251 PolarHBondContact O-N 3.09Å; P249-F251 PolarHBondContact O-N 2.62Å; F251-S255 WeakPolarHBondContact O-CB 3.4Å; F251-S255 PolarHBondContact O-N 3.04Å; F251-S255 PolarHBondContact O-OG 3.5Å; F251-K319 VanDerWaalsContact CE2-NZ 3.29Å; F251-K319 VanDerWaalsContact CG-CE 3.49Å; F251-W323 HydrophobicContact CB-CH2 4.32Å; F251-W323 HydrophobicContact CB-CZ2 4.01Å; F251-W323 AromaticContact CD1-CH2 3.57Å; F251-W323 HydrophobicContact CD1-CH2 3.57Å; F251-W323 HydrophobicContact CD1-CZ2 4.12Å; F251-W323 HydrophobicContact CE1-CH2 4.14Å; F251-W323 HydrophobicContact CG-CH2 4.21Å; F251-W323 HydrophobicContact CG-CZ2 4.39Å; F251-F344 HydrophobicContact CD1-CE1 4.24Å; F251-F344 AromaticContact CD1-CZ 3.7Å; F251-F344 HydrophobicContact CD1-CZ 3.7Å; F251-F344 HydrophobicContact CE1-CE1 4.48Å; F251-F344 AromaticContact CE1-CZ 3.81Å; F251-F344 HydrophobicContact CE1-CZ 3.81Å; F251-F348 HydrophobicContact CE1-CD1 4.45Å; F251-F348 HydrophobicContact CE1-CD2 4.36Å; F251-F348 AromaticContact CE1-CE1 3.87Å; F251-F348 HydrophobicContact CE1-CE1 3.87Å; F251-F348 AromaticContact CE1-CE2 3.76Å; F251-F348 HydrophobicContact CE1-CE2 3.76Å; F251-F348 AromaticContact CE1-CZ 3.5Å; F251-F348 HydrophobicContact CE1-CZ 3.5Å; F251-F348 HydrophobicContact CZ-CE1 4.1Å; F251-F348 AromaticContact CZ-CE2 3.88Å; F251-F348 HydrophobicContact CZ-CE2 3.88Å; F251-F348 AromaticContact CZ-CZ 3.44Å; F251-F348 HydrophobicContact CZ-CZ 3.44Å; F251-F348 VanDerWaalsContact CZ-CZ 3.44Å
252G97.4Very high95Very high0 Ų010.1 Ų10.10%05%0.047CC..Hα-helixtrans-57.8-53.3173.100000111.5R248 P249 G250 I254 S255 H256R248-G252 PolarHBondContact O-N 2.92Å; R248-G252 VanDerWaalsContact O-N 3.09Å; P249-G252 WeakPolarHBondContact O-CA 3.35Å; P249-G252 PolarHBondContact O-N 3.05Å; P249-G252 VanDerWaalsContact O-N 3.17Å; G250-G252 VanDerWaalsContact C-N 3.29Å; G250-G252 PolarHBondContact O-N 2.69Å; G252-I254 PolarHBondContact O-N 3.05Å; G252-S255 WeakPolarHBondContact O-CB 3.44Å; G252-S255 PolarHBondContact O-N 3.13Å; G252-S255 VanDerWaalsContact O-N 3.17Å; G252-H256 PolarHBondContact O-CD2 3.17Å; G252-H256 VanDerWaalsContact O-CD2 3.3Å; G252-H256 PolarHBondContact O-N 3.48Å; G252-H256 VanDerWaalsContact O-N 3.08Å
253M98.1Very high94.7Very high0 Ų012.9 Ų12.90%08%0.076CC..Hα-helixtrans-59.1-47.8-178.7-71.4-170.6-82.700112.4M74 F78 F184 P249 G250 S255 H256 I257 A388 W396M74-M253 HydrophobicContact CG-CE 4.09Å; M74-M253 HydrophobicContact SD-CE 3.52Å; M74-M253 VanDerWaalsContact SD-CE 3.52Å; F78-M253 HydrophobicContact CB-SD 4.41Å; F78-M253 HydrophobicContact CD1-SD 4.06Å; F78-M253 HydrophobicContact CD2-CE 4.17Å; F78-M253 HydrophobicContact CD2-SD 3.68Å; F78-M253 HydrophobicContact CE1-SD 4.23Å; F78-M253 HydrophobicContact CE2-CE 4.44Å; F78-M253 HydrophobicContact CE2-SD 3.86Å; F78-M253 HydrophobicContact CG-SD 3.79Å; F78-M253 HydrophobicContact CZ-SD 4.14Å; F184-M253 HydrophobicContact CD2-CG 3.75Å; F184-M253 HydrophobicContact CE2-CG 3.65Å; F184-M253 HydrophobicContact CE2-SD 4.49Å; P249-M253 WeakPolarHBondContact O-CG 3.19Å; P249-M253 PolarHBondContact O-N 3.3Å; G250-M253 PolarHBondContact O-N 3.4Å; M253-S255 VanDerWaalsContact C-N 3.29Å; M253-S255 PolarHBondContact O-N 3.06Å; M253-H256 PolarHBondContact O-N 3.41Å; M253-I257 VanDerWaalsContact O-CG1 3.32Å; M253-I257 WeakPolarHBondContact O-CG1 3.18Å; M253-I257 PolarHBondContact O-N 3Å; M253-A388 HydrophobicContact CE-CB 4.24Å; M253-W396 HydrophobicContact CB-CH2 4.02Å; M253-W396 HydrophobicContact CB-CZ3 3.88Å; M253-W396 HydrophobicContact CG-CH2 3.94Å; M253-W396 HydrophobicContact CG-CZ3 3.61Å; M253-W396 HydrophobicContact SD-CZ3 3.96Å
254I98.1Very high94.5Very high0 Ų015 Ų150%08%0.084CC..Hα-helixtrans-62.1-38.7178.3-64.8-53.4000111.4G250 G252 H256 I257 V258 W323 A341 F344 I345 A388G250-I254 VanDerWaalsContact O-CG1 3.28Å; G250-I254 WeakPolarHBondContact O-CG1 3.29Å; G250-I254 PolarHBondContact O-N 2.76Å; G252-I254 PolarHBondContact O-N 3.05Å; I254-H256 VanDerWaalsContact C-N 3.34Å; I254-H256 PolarHBondContact O-N 2.87Å; I254-I257 HydrophobicContact CD1-CD1 4.34Å; I254-I257 PolarHBondContact O-N 3.35Å; I254-V258 HydrophobicContact CG2-CG2 4.08Å; I254-V258 VanDerWaalsContact O-CB 3.29Å; I254-V258 WeakPolarHBondContact O-CB 3.46Å; I254-V258 VanDerWaalsContact O-CG2 3.25Å; I254-V258 WeakPolarHBondContact O-CG2 3.34Å; I254-V258 PolarHBondContact O-N 2.66Å; I254-W323 HydrophobicContact CB-CZ2 4.45Å; I254-W323 HydrophobicContact CG2-CD2 4.17Å; I254-W323 HydrophobicContact CG2-CG 4.48Å; I254-W323 HydrophobicContact CG2-CZ2 4.29Å; I254-A341 HydrophobicContact CD1-CB 4.08Å; I254-A341 HydrophobicContact CG2-CB 4.43Å; I254-F344 HydrophobicContact CB-CD1 4.24Å; I254-F344 HydrophobicContact CB-CE1 4.37Å; I254-F344 HydrophobicContact CD1-CB 3.97Å; I254-F344 HydrophobicContact CD1-CD1 4.22Å; I254-F344 HydrophobicContact CD1-CD2 4.45Å; I254-F344 HydrophobicContact CD1-CG 3.96Å; I254-F344 HydrophobicContact CG1-CB 4.26Å; I254-F344 HydrophobicContact CG1-CD1 3.57Å; I254-F344 HydrophobicContact CG1-CD2 4.09Å; I254-F344 HydrophobicContact CG1-CE1 3.88Å; I254-F344 HydrophobicContact CG1-CE2 4.34Å; I254-F344 HydrophobicContact CG1-CG 3.7Å; I254-F344 HydrophobicContact CG1-CZ 4.27Å; I254-F344 HydrophobicContact CG2-CD1 3.96Å; I254-F344 HydrophobicContact CG2-CE1 4.32Å; I254-I345 HydrophobicContact CG2-CG1 4.33Å; I254-A388 HydrophobicContact CD1-CB 4.21Å; I254-A388 HydrophobicContact CG1-CB 4.11Å
255S97.1Very high94.2Very high2 Ų221.8 Ų21.81%0.01411%0.114CC..Hα-helixtrans-63.4-40.4177-52.50000112.1F251 G252 M253 T259 M273 W323F251-S255 WeakPolarHBondContact O-CB 3.4Å; F251-S255 PolarHBondContact O-N 3.04Å; F251-S255 PolarHBondContact O-OG 3.5Å; G252-S255 WeakPolarHBondContact O-CB 3.44Å; G252-S255 PolarHBondContact O-N 3.13Å; G252-S255 VanDerWaalsContact O-N 3.17Å; M253-S255 VanDerWaalsContact C-N 3.29Å; M253-S255 PolarHBondContact O-N 3.06Å; S255-T259 VanDerWaalsContact O-CB 3.29Å; S255-T259 WeakPolarHBondContact O-CB 3.3Å; S255-T259 PolarHBondContact O-N 3.42Å; S255-T259 PolarHBondContact O-OG1 3.48Å; S255-M273 WeakPolarHBondContact OG-CE 2.8Å; S255-W323 PolarHBondContact OG-NE1 3.33Å
256H95Very high93.9Very high18 Ų1827.7 Ų27.78%0.08314%0.141CC..Hα-helixtrans-64.6-48.9174.5-84.6-103.4000111.8P182 F184 G252 M253 I254 V258 T259 Y260 W396P182-H256 WeakPolarHBondContact CB-CE1 3.27Å; P182-H256 VanDerWaalsContact CB-NE2 3.29Å; P182-H256 WeakPolarHBondContact CB-NE2 3.4Å; F184-H256 WeakPolarHBondContact CB-NE2 3.44Å; F184-H256 PolarHBondContact N-NE2 2.92Å; G252-H256 PolarHBondContact O-CD2 3.17Å; G252-H256 VanDerWaalsContact O-CD2 3.3Å; G252-H256 PolarHBondContact O-N 3.48Å; G252-H256 VanDerWaalsContact O-N 3.08Å; M253-H256 PolarHBondContact O-N 3.41Å; I254-H256 VanDerWaalsContact C-N 3.34Å; I254-H256 PolarHBondContact O-N 2.87Å; H256-V258 PolarHBondContact O-N 3.13Å; H256-T259 PolarHBondContact O-N 2.93Å; H256-Y260 VanDerWaalsContact O-CB 3.24Å; H256-Y260 WeakPolarHBondContact O-CB 3.44Å; H256-Y260 PolarHBondContact O-N 3.46Å; H256-W396 HydrophobicContact CB-CH2 4.02Å; H256-W396 HydrophobicContact CB-CZ2 3.91Å
257I95.4Very high93.9Very high0 Ų028.1 Ų28.10%014%0.144CC..Hα-helixtrans-59.9-49.3179.9-64.9164.1000110.6M253 I254 T259 Y260 Y261 A337 A341 H395M253-I257 VanDerWaalsContact O-CG1 3.32Å; M253-I257 WeakPolarHBondContact O-CG1 3.18Å; M253-I257 PolarHBondContact O-N 3Å; I254-I257 HydrophobicContact CD1-CD1 4.34Å; I254-I257 PolarHBondContact O-N 3.35Å; I257-T259 VanDerWaalsContact C-N 3.31Å; I257-T259 PolarHBondContact O-N 3.48Å; I257-Y260 PolarHBondContact O-N 3.03Å; I257-Y261 HydrophobicContact CG2-CD2 3.78Å; I257-Y261 HydrophobicContact CG2-CE2 4.05Å; I257-Y261 VanDerWaalsContact O-CD2 3.31Å; I257-Y261 WeakPolarHBondContact O-CD2 3.29Å; I257-Y261 PolarHBondContact O-N 3.2Å; I257-A337 HydrophobicContact CG2-CB 4.1Å; I257-A341 HydrophobicContact CG2-CB 3.91Å; I257-H395 HydrophobicContact CD1-CB 4.38Å; I257-H395 HydrophobicContact CG1-CB 4.03Å
258V95.6Very high94Very high4 Ų433.2 Ų33.22%0.02417%0.167CC..Hα-helixtrans-59.6-42.9179.7164.30000111.2I254 H256 S262 T326 L327 A341 I345I254-V258 HydrophobicContact CG2-CG2 4.08Å; I254-V258 VanDerWaalsContact O-CB 3.29Å; I254-V258 WeakPolarHBondContact O-CB 3.46Å; I254-V258 VanDerWaalsContact O-CG2 3.25Å; I254-V258 WeakPolarHBondContact O-CG2 3.34Å; I254-V258 PolarHBondContact O-N 2.66Å; H256-V258 PolarHBondContact O-N 3.13Å; V258-S262 WeakPolarHBondContact O-CB 3.48Å; V258-S262 PolarHBondContact O-N 3.29Å; V258-S262 VanDerWaalsContact O-N 3.15Å; V258-S262 PolarHBondContact O-OG 3.07Å; V258-T326 HydrophobicContact CG1-CG2 3.7Å; V258-L327 HydrophobicContact CB-CD2 4.45Å; V258-L327 HydrophobicContact CG1-CD1 4.45Å; V258-L327 HydrophobicContact CG1-CD2 3.79Å; V258-L327 HydrophobicContact CG1-CG 3.76Å; V258-L327 HydrophobicContact CG2-CD2 4.33Å; V258-A341 HydrophobicContact CG2-CB 4.16Å; V258-I345 HydrophobicContact CG2-CD1 4.28Å
259T93.2Very high94Very high15 Ų1535.1 Ų35.19%0.09219%0.187CC..Hα-helixtrans-68.6-48.3-179.9-560000111.2S255 H256 I257 Y261 S262 G263 K264S255-T259 VanDerWaalsContact O-CB 3.29Å; S255-T259 WeakPolarHBondContact O-CB 3.3Å; S255-T259 PolarHBondContact O-N 3.42Å; S255-T259 PolarHBondContact O-OG1 3.48Å; H256-T259 PolarHBondContact O-N 2.93Å; I257-T259 VanDerWaalsContact C-N 3.31Å; I257-T259 PolarHBondContact O-N 3.48Å; T259-Y261 PolarHBondContact O-N 2.96Å; T259-S262 PolarHBondContact O-N 3.38Å; T259-G263 PolarHBondContact O-N 3.48Å; T259-K264 WeakPolarHBondContact CG2-O 3.35Å; T259-K264 PolarHBondContact O-N 2.96Å
260Y92.1Very high93.9Very high42 Ų4236.6 Ų36.617%0.16519%0.192CC..Hα-helixtrans-56.4-53.9-179.8-175.6-91.5000111.7H256 I257 S262 G263 H395 E486H256-Y260 VanDerWaalsContact O-CB 3.24Å; H256-Y260 WeakPolarHBondContact O-CB 3.44Å; H256-Y260 PolarHBondContact O-N 3.46Å; I257-Y260 PolarHBondContact O-N 3.03Å; Y260-S262 VanDerWaalsContact C-N 3.3Å; Y260-S262 PolarHBondContact O-N 3.19Å; Y260-G263 PolarHBondContact O-N 3.49Å; Y260-H395 AromaticContact CD1-CE1 3.64Å; Y260-H395 AromaticContact CE1-CE1 3.98Å; Y260-H395 AromaticContact CG-CE1 3.66Å; Y260-E486 WeakPolarHBondContact CE2-O 3.29Å; Y260-E486 PolarHBondContact OH-O 3.1Å
261Y92.1Very high93.9Very high48 Ų4840.3 Ų40.319%0.18821%0.211CC..Hα-helixtrans-77.7-12.9-177.4-72.6-78000114.2I257 T259 G263 S335 A337 V338 H395I257-Y261 HydrophobicContact CG2-CD2 3.78Å; I257-Y261 HydrophobicContact CG2-CE2 4.05Å; I257-Y261 VanDerWaalsContact O-CD2 3.31Å; I257-Y261 WeakPolarHBondContact O-CD2 3.29Å; I257-Y261 PolarHBondContact O-N 3.2Å; T259-Y261 PolarHBondContact O-N 2.96Å; Y261-G263 VanDerWaalsContact C-N 3.33Å; Y261-S335 WeakPolarHBondContact CD1-OG 3.33Å; Y261-S335 WeakPolarHBondContact CE1-OG 3.42Å; Y261-A337 HydrophobicContact CD2-CB 4.39Å; Y261-A337 HydrophobicContact CE2-CB 3.53Å; Y261-V338 HydrophobicContact CD1-CG2 3.94Å; Y261-V338 HydrophobicContact CD2-CG2 3.76Å; Y261-V338 HydrophobicContact CG-CG2 3.39Å; Y261-H395 AromaticContact CE2-ND1 3.76Å
262S91.4Very high93.8Very high12 Ų1241.7 Ų41.78%0.08423%0.226CC..Hα-helixtrans-83.3-10.2170.2-62.90000113V258 T259 Y260 K264 S330V258-S262 WeakPolarHBondContact O-CB 3.48Å; V258-S262 PolarHBondContact O-N 3.29Å; V258-S262 VanDerWaalsContact O-N 3.15Å; V258-S262 PolarHBondContact O-OG 3.07Å; T259-S262 PolarHBondContact O-N 3.38Å; Y260-S262 VanDerWaalsContact C-N 3.3Å; Y260-S262 PolarHBondContact O-N 3.19Å; S262-K264 PolarHBondContact O-N 3.18Å; S262-S330 WeakPolarHBondContact O-CB 3.3Å
263G88Confident93.8Very high60 Ų6041.8 Ų41.862%0.61923%0.226SC*.THydrogen-bonded Turntrans6518.1-175.100000113.8T259 Y260 Y261T259-G263 PolarHBondContact O-N 3.48Å; Y260-G263 PolarHBondContact O-N 3.49Å; Y261-G263 VanDerWaalsContact C-N 3.33Å
264K88.1Confident93.8Very high69 Ų6941.8 Ų41.830%0.323%0.226SC..  trans-89.7147177.7-68.6-176.1178.8172.90109T259 S262 E266 A325 T326 H328T259-K264 WeakPolarHBondContact CG2-O 3.35Å; T259-K264 PolarHBondContact O-N 2.96Å; S262-K264 PolarHBondContact O-N 3.18Å; K264-E266 VanDerWaalsContact C-N 3.33Å; K264-A325 PolarHBondContact NZ-O 2.82Å; K264-T326 HydrophobicContact CD-CG2 4.09Å; K264-T326 WeakPolarHBondContact CD-O 3.35Å; K264-T326 WeakPolarHBondContact CE-O 3.46Å; K264-T326 PolarHBondContact NZ-O 2.87Å; K264-H328 PolarHBondContact NZ-O 3.26Å
265K86Confident93.8Very high176 Ų17648.1 Ų48.177%0.76525%0.25SS*.SBendtrans-68.8-34.7178.4-65.4-175.3177.3-176.20112.6M490K265-M490 HydrophobicContact CB-SD 4.3Å; K265-M490 HydrophobicContact CG-CE 3.85Å; K265-M490 HydrophobicContact CG-SD 3.79Å
266E89.3Confident93.8Very high124 Ų12448.3 Ų48.358%0.57925%0.252SS*.SBendtrans-144.3154.9-178.462.5178.917100110K264K264-E266 VanDerWaalsContact C-N 3.33Å
267P93.1Very high93.9Very high11 Ų1147.6 Ų47.67%0.07125%0.249CC..  trans-68.5149.917127.3-31.8000110.8L183 G269 Y270 M273 T326L183-P267 HydrophobicContact CD1-CB 4.4Å; L183-P267 HydrophobicContact CD1-CG 3.48Å; L183-P267 VanDerWaalsContact CD1-CG 3.48Å; L183-P267 HydrophobicContact CG-CG 4.41Å; P267-G269 PolarHBondContact O-N 2.55Å; P267-Y270 HydrophobicContact CG-CD2 4.4Å; P267-Y270 PolarHBondContact O-N 3.15Å; P267-M273 HydrophobicContact CB-SD 3.7Å; P267-M273 HydrophobicContact CG-SD 3.84Å; P267-T326 HydrophobicContact CB-CG2 4.42Å
268F96.2Very high94Very high112 Ų11250 Ų5049%0.49126%0.261SS..THydrogen-bonded Turntrans-56.7122.3177.5175.7-90.5000110.8F321 S322 A325 T326F268-F321 HydrophobicContact CD1-CE1 4.38Å; F268-F321 HydrophobicContact CE1-CD1 4.32Å; F268-F321 AromaticContact CE1-CE1 3.72Å; F268-F321 HydrophobicContact CE1-CE1 3.72Å; F268-F321 HydrophobicContact CZ-CE1 4.4Å; F268-S322 WeakPolarHBondContact O-CB 3.44Å; F268-S322 PolarHBondContact O-OG 3.4Å; F268-A325 HydrophobicContact CB-CB 3.84Å; F268-A325 HydrophobicContact CD1-CB 3.58Å; F268-A325 HydrophobicContact CD2-CB 4.16Å; F268-A325 HydrophobicContact CE1-CB 4.18Å; F268-A325 HydrophobicContact CG-CB 3.56Å; F268-T326 PolarHBondContact N-OG1 2.87Å
269G95.4Very high94.1Very high41 Ų4152.3 Ų52.342%0.42328%0.277SS..THydrogen-bonded Turntrans65.644.617800000112.9P267 M271 G272 M273P267-G269 PolarHBondContact O-N 2.55Å; G269-M271 VanDerWaalsContact C-N 3.26Å; G269-M271 PolarHBondContact O-N 3.48Å; G269-M271 VanDerWaalsContact O-N 3.16Å; G269-G272 VanDerWaalsContact O-CA 3.32Å; G269-G272 WeakPolarHBondContact O-CA 3.25Å; G269-G272 PolarHBondContact O-N 3.47Å; G269-M273 PolarHBondContact O-N 3.31Å
270Y95.6Very high94.2Very high31 Ų3151.6 Ų51.612%0.12227%0.272CS..Hα-helixtrans-41.8-49.5177166.6-90.7000113.3Y179 T181 L183 W186 P267 G272 M273 V274Y179-Y270 WeakPolarHBondContact O-CE1 3.41Å; Y179-Y270 PolarHBondContact O-OH 3.48Å; T181-Y270 PolarHBondContact O-OH 2.9Å; L183-Y270 HydrophobicContact CD1-CD2 4.31Å; L183-Y270 HydrophobicContact CD2-CD2 3.65Å; L183-Y270 HydrophobicContact CD2-CE2 3.49Å; L183-Y270 VanDerWaalsContact CD2-CE2 3.49Å; L183-Y270 HydrophobicContact CG-CD2 3.78Å; L183-Y270 HydrophobicContact CG-CE2 3.76Å; W186-Y270 PolarHBondContact NE1-OH 3.32Å; W186-Y270 VanDerWaalsContact NE1-OH 3.07Å; P267-Y270 HydrophobicContact CG-CD2 4.4Å; P267-Y270 PolarHBondContact O-N 3.15Å; Y270-G272 VanDerWaalsContact C-N 3.33Å; Y270-G272 PolarHBondContact O-N 2.83Å; Y270-M273 WeakPolarHBondContact O-CB 3.46Å; Y270-M273 PolarHBondContact O-N 3.45Å; Y270-M273 VanDerWaalsContact O-N 3.08Å; Y270-V274 HydrophobicContact CD1-CG2 4.49Å; Y270-V274 HydrophobicContact CE1-CG2 3.92Å; Y270-V274 HydrophobicContact CE2-CG2 4.13Å; Y270-V274 PolarHBondContact O-N 3.41Å
271M96.4Very high94.4Very high78 Ų7849.9 Ų49.938%0.38427%0.268SS..Hα-helixtrans-61.7-40177.2-73-59.2-74.600112.7Y179 G269 M273 V274 W275Y179-M271 HydrophobicContact CD1-CE 3.48Å; Y179-M271 VanDerWaalsContact CD1-CE 3.48Å; Y179-M271 HydrophobicContact CD1-SD 3.75Å; Y179-M271 HydrophobicContact CE1-CE 3.65Å; Y179-M271 HydrophobicContact CE1-SD 4.45Å; Y179-M271 HydrophobicContact CG-CE 4.08Å; Y179-M271 HydrophobicContact CG-SD 4.26Å; G269-M271 VanDerWaalsContact C-N 3.26Å; G269-M271 PolarHBondContact O-N 3.48Å; G269-M271 VanDerWaalsContact O-N 3.16Å; M271-M273 VanDerWaalsContact C-N 3.27Å; M271-M273 PolarHBondContact O-N 3.16Å; M271-V274 PolarHBondContact O-N 2.77Å; M271-W275 PolarHBondContact O-N 3.4Å
272G96.9Very high94.6Very high33 Ų3354.4 Ų54.434%0.3429%0.289SS..Hα-helixtrans-60.7-36.5174.200000112.4G269 Y270 A276G269-G272 VanDerWaalsContact O-CA 3.32Å; G269-G272 WeakPolarHBondContact O-CA 3.25Å; G269-G272 PolarHBondContact O-N 3.47Å; Y270-G272 VanDerWaalsContact C-N 3.33Å; Y270-G272 PolarHBondContact O-N 2.83Å; G272-A276 WeakPolarHBondContact O-CB 3.28Å; G272-A276 PolarHBondContact O-N 3.26Å
273M97.3Very high94.8Very high2 Ų255 Ų551%0.0129%0.291CS..Hα-helixtrans-68.4-41.6174.5-59.6-175.680.500112.4L183 S255 P267 G269 Y270 M271 A276 M277 S322 W323L183-M273 HydrophobicContact CD1-CB 4.05Å; L183-M273 HydrophobicContact CD1-CE 3.71Å; L183-M273 HydrophobicContact CD1-CG 4.37Å; L183-M273 HydrophobicContact CD1-SD 3.34Å; L183-M273 WeakPolarHBondContact CD1-SD 3.38Å; L183-M273 HydrophobicContact CD2-CB 4.01Å; S255-M273 WeakPolarHBondContact OG-CE 2.8Å; P267-M273 HydrophobicContact CB-SD 3.7Å; P267-M273 HydrophobicContact CG-SD 3.84Å; G269-M273 PolarHBondContact O-N 3.31Å; Y270-M273 WeakPolarHBondContact O-CB 3.46Å; Y270-M273 PolarHBondContact O-N 3.45Å; Y270-M273 VanDerWaalsContact O-N 3.08Å; M271-M273 VanDerWaalsContact C-N 3.27Å; M271-M273 PolarHBondContact O-N 3.16Å; M273-A276 PolarHBondContact O-N 3.24Å; M273-M277 WeakPolarHBondContact O-CG 3.38Å; M273-M277 PolarHBondContact O-N 2.98Å; M273-S322 WeakPolarHBondContact CG-OG 3.01Å; M273-S322 PolarHBondContact SD-OG 2.74Å; M273-W323 VanDerWaalsContact CE-NE1 3.33Å
274V97.8Very high95Very high0 Ų052.2 Ų52.20%026%0.261CS..Hα-helixtrans-59.9-51175.7173.60000110.4L183 W186 Y270 M271 A276 M277 M278L183-V274 HydrophobicContact CD2-CG2 3.64Å; W186-V274 HydrophobicContact CD2-CG1 3.88Å; W186-V274 HydrophobicContact CD2-CG2 4.43Å; W186-V274 HydrophobicContact CE3-CG1 4.2Å; W186-V274 HydrophobicContact CG-CG1 4.39Å; W186-V274 HydrophobicContact CG-CG2 4.16Å; W186-V274 HydrophobicContact CH2-CG1 4.1Å; W186-V274 HydrophobicContact CZ2-CG1 3.78Å; W186-V274 HydrophobicContact CZ3-CG1 4.32Å; Y270-V274 HydrophobicContact CD1-CG2 4.49Å; Y270-V274 HydrophobicContact CE1-CG2 3.92Å; Y270-V274 HydrophobicContact CE2-CG2 4.13Å; Y270-V274 PolarHBondContact O-N 3.41Å; M271-V274 PolarHBondContact O-N 2.77Å; V274-A276 PolarHBondContact O-N 3.02Å; V274-M277 PolarHBondContact O-N 3.46Å; V274-M278 HydrophobicContact CG1-CE 3.97Å; V274-M278 PolarHBondContact O-N 3.17Å
275W97.8Very high95.4Very high133 Ų13350.6 Ų50.650%0.50426%0.255SS..Hα-helixtrans-62.5-41.3177.2-73111.6000112.3Y179 M271 M277 M278 S279Y179-W275 HydrophobicContact CE1-CZ2 4.49Å; M271-W275 PolarHBondContact O-N 3.4Å; W275-M277 VanDerWaalsContact C-N 3.35Å; W275-M277 PolarHBondContact O-N 3.15Å; W275-M278 HydrophobicContact CD2-CE 3.52Å; W275-M278 HydrophobicContact CE3-CE 3.14Å; W275-M278 HydrophobicContact CG-CE 4.24Å; W275-M278 HydrophobicContact CH2-CE 3.79Å; W275-M278 HydrophobicContact CZ2-CE 4.15Å; W275-M278 HydrophobicContact CZ3-CE 3.28Å; W275-M278 PolarHBondContact O-N 2.89Å; W275-S279 WeakPolarHBondContact O-CB 3.49Å; W275-S279 PolarHBondContact O-N 3.19Å; W275-S279 PolarHBondContact O-OG 2.76Å; W275-S279 VanDerWaalsContact O-OG 3.05Å
276A97.6Very high95.9Very high6 Ų644.4 Ų44.45%0.0523%0.229CC..Hα-helixtrans-59.5-43.4175.300000112.4G272 M273 V274 S279 I280 P315 V318 K319G272-A276 WeakPolarHBondContact O-CB 3.28Å; G272-A276 PolarHBondContact O-N 3.26Å; M273-A276 PolarHBondContact O-N 3.24Å; V274-A276 PolarHBondContact O-N 3.02Å; A276-S279 PolarHBondContact O-N 2.95Å; A276-I280 WeakPolarHBondContact O-CD1 3.5Å; A276-I280 VanDerWaalsContact O-CG1 3.26Å; A276-I280 WeakPolarHBondContact O-CG1 3.38Å; A276-I280 PolarHBondContact O-N 3.22Å; A276-P315 HydrophobicContact CB-CB 3.85Å; A276-P315 WeakPolarHBondContact CB-O 3.25Å; A276-V318 HydrophobicContact CB-CB 4.43Å; A276-V318 HydrophobicContact CB-CG1 4.32Å; A276-K319 HydrophobicContact CB-CD 3.99Å; A276-K319 HydrophobicContact CB-CG 3.8Å
277M97.3Very high96.3Very high3 Ų338.5 Ų38.52%0.01520%0.202CC..Hα-helixtrans-64.5-41.2176-71.1-172.4-67.100112.1L183 W186 I190 R248 M273 V274 W275 G281 K319L183-M277 HydrophobicContact CB-CE 4.4Å; L183-M277 HydrophobicContact CD2-CE 3.7Å; W186-M277 HydrophobicContact CB-CE 3.81Å; I190-M277 HydrophobicContact CD1-CB 3.59Å; R248-M277 PolarHBondContact NH1-O 3.46Å; M273-M277 WeakPolarHBondContact O-CG 3.38Å; M273-M277 PolarHBondContact O-N 2.98Å; V274-M277 PolarHBondContact O-N 3.46Å; W275-M277 VanDerWaalsContact C-N 3.35Å; W275-M277 PolarHBondContact O-N 3.15Å; M277-G281 PolarHBondContact O-N 2.92Å; M277-K319 HydrophobicContact CG-CD 4.05Å
278M97.4Very high96.5Very high51 Ų5140.9 Ų40.925%0.25121%0.209SC..Hα-helixtrans-66.1-41.8176.3-70-170.2-59.900111.9W186 I190 V274 W275 G281 F282W186-M278 HydrophobicContact CZ3-SD 4.11Å; I190-M278 HydrophobicContact CD1-CG 3.78Å; I190-M278 HydrophobicContact CG1-CG 4.33Å; V274-M278 HydrophobicContact CG1-CE 3.97Å; V274-M278 PolarHBondContact O-N 3.17Å; W275-M278 HydrophobicContact CD2-CE 3.52Å; W275-M278 HydrophobicContact CE3-CE 3.14Å; W275-M278 HydrophobicContact CG-CE 4.24Å; W275-M278 HydrophobicContact CH2-CE 3.79Å; W275-M278 HydrophobicContact CZ2-CE 4.15Å; W275-M278 HydrophobicContact CZ3-CE 3.28Å; W275-M278 PolarHBondContact O-N 2.89Å; M278-G281 CarbonylContact O-C 3.56Å; M278-G281 VanDerWaalsContact O-CA 3.23Å; M278-G281 WeakPolarHBondContact O-CA 2.89Å; M278-G281 PolarHBondContact O-N 3.08Å; M278-F282 PolarHBondContact O-N 3.49Å
279S97.4Very high96.5Very high51 Ų5135.6 Ų35.636%0.35719%0.186SC..Hα-helixtrans-60.4-46.6175.5-63.70000111.8W275 A276 G281 F282 L283W275-S279 WeakPolarHBondContact O-CB 3.49Å; W275-S279 PolarHBondContact O-N 3.19Å; W275-S279 PolarHBondContact O-OG 2.76Å; W275-S279 VanDerWaalsContact O-OG 3.05Å; A276-S279 PolarHBondContact O-N 2.95Å; S279-G281 PolarHBondContact O-N 3.36Å; S279-F282 PolarHBondContact O-N 3.49Å; S279-L283 VanDerWaalsContact O-CB 3.3Å; S279-L283 WeakPolarHBondContact O-CB 3.4Å; S279-L283 WeakPolarHBondContact O-CG 3.46Å; S279-L283 PolarHBondContact O-N 3.27Å
280I96Very high96.6Very high1 Ų134.8 Ų34.81%0.00517%0.171CC..Hα-helixtrans-61.8-31.2173.5-61.1162.6000110.1Y244 R248 A276 G284 I312 P315 K319Y244-I280 HydrophobicContact CD1-CG2 3.82Å; Y244-I280 HydrophobicContact CD2-CG2 4.1Å; Y244-I280 HydrophobicContact CE1-CG2 3.94Å; Y244-I280 HydrophobicContact CE2-CG2 4.18Å; Y244-I280 HydrophobicContact CG-CG2 3.94Å; R248-I280 PolarHBondContact NH2-O 3.19Å; A276-I280 WeakPolarHBondContact O-CD1 3.5Å; A276-I280 VanDerWaalsContact O-CG1 3.26Å; A276-I280 WeakPolarHBondContact O-CG1 3.38Å; A276-I280 PolarHBondContact O-N 3.22Å; I280-G284 PolarHBondContact O-N 2.8Å; I280-G284 VanDerWaalsContact O-N 3.13Å; I280-I312 HydrophobicContact CG1-CG2 4.41Å; I280-I312 HydrophobicContact CG2-CG2 4.47Å; I280-P315 HydrophobicContact CD1-CB 4.21Å; I280-P315 HydrophobicContact CD1-CG 4.38Å; I280-P315 HydrophobicContact CG1-CB 3.88Å; I280-P315 HydrophobicContact CG1-CG 3.67Å; I280-K319 HydrophobicContact CD1-CD 4.16Å
281G95.1Very high96.7Very high6 Ų635.3 Ų35.36%0.06218%0.175CC..Hα-helixtrans-56.4-60.4173.700000111.9R248 M277 M278 S279 G284R248-G281 VanDerWaalsContact CZ-CA 3.48Å; M277-G281 PolarHBondContact O-N 2.92Å; M278-G281 CarbonylContact O-C 3.56Å; M278-G281 VanDerWaalsContact O-CA 3.23Å; M278-G281 WeakPolarHBondContact O-CA 2.89Å; M278-G281 PolarHBondContact O-N 3.08Å; S279-G281 PolarHBondContact O-N 3.36Å; G281-G284 PolarHBondContact O-N 3Å
282F96.6Very high96.7Very high143 Ų14331.6 Ų31.663%0.62716%0.157SC*.Hα-helixtrans-64.3-48.7-179.7177.9-100.1000112.4M278 S279 G284 F285 I286M278-F282 PolarHBondContact O-N 3.49Å; S279-F282 PolarHBondContact O-N 3.49Å; F282-G284 PolarHBondContact O-N 3.28Å; F282-G284 VanDerWaalsContact O-N 3.17Å; F282-F285 PolarHBondContact O-N 2.97Å; F282-F285 VanDerWaalsContact O-N 3.13Å; F282-I286 HydrophobicContact CE1-CD1 4.2Å
283L94.8Very high96.7Very high25 Ų2530.2 Ų30.213%0.13114%0.141CC..Hα-helixtrans-60.5-29.5-177.9-69174.1000112.1S279 F285 I286 V287 I311 I312 P315S279-L283 VanDerWaalsContact O-CB 3.3Å; S279-L283 WeakPolarHBondContact O-CB 3.4Å; S279-L283 WeakPolarHBondContact O-CG 3.46Å; S279-L283 PolarHBondContact O-N 3.27Å; L283-F285 PolarHBondContact O-N 3.48Å; L283-I286 HydrophobicContact CD2-CD1 3.77Å; L283-I286 HydrophobicContact CD2-CG1 4.26Å; L283-I286 WeakPolarHBondContact O-CG1 3.35Å; L283-I286 PolarHBondContact O-N 3.46Å; L283-V287 WeakPolarHBondContact O-CG1 3.4Å; L283-V287 WeakPolarHBondContact O-CG2 3.46Å; L283-I311 HydrophobicContact CD1-CG2 4Å; L283-I312 HydrophobicContact CB-CD1 3.97Å; L283-I312 HydrophobicContact CB-CG1 3.8Å; L283-I312 HydrophobicContact CD1-CG1 3.87Å; L283-I312 HydrophobicContact CG-CG1 4.43Å; L283-P315 HydrophobicContact CD1-CG 4.42Å
284G93.3Very high96.7Very high0 Ų033.1 Ų33.10%016%0.159CC..THydrogen-bonded Turntrans-59.6-25.8177.900000115H240 P241 I280 G281 F282H240-G284 PolarHBondContact CD2-O 2.84Å; P241-G284 WeakPolarHBondContact CD-O 3.05Å; I280-G284 PolarHBondContact O-N 2.8Å; I280-G284 VanDerWaalsContact O-N 3.13Å; G281-G284 PolarHBondContact O-N 3Å; F282-G284 PolarHBondContact O-N 3.28Å; F282-G284 VanDerWaalsContact O-N 3.17Å
285F96.1Very high96.6Very high36 Ų3634.9 Ų34.916%0.15817%0.17CC..THydrogen-bonded Turntrans-85.4-7.1176.4-75.5-66.3000114.6L194 L197 F237 P241 F282 L283 W288L194-F285 HydrophobicContact CD2-CD2 4.01Å; L194-F285 HydrophobicContact CD2-CE2 3.22Å; L194-F285 HydrophobicContact CD2-CZ 3.73Å; L197-F285 HydrophobicContact CB-CE1 4.36Å; L197-F285 HydrophobicContact CB-CE2 4.35Å; L197-F285 HydrophobicContact CB-CZ 3.67Å; L197-F285 HydrophobicContact CD1-CE2 4.16Å; L197-F285 HydrophobicContact CD1-CZ 4.31Å; F237-F285 HydrophobicContact CE1-CD1 4.02Å; F237-F285 HydrophobicContact CE1-CE1 4.14Å; F237-F285 HydrophobicContact CE2-CD1 4.38Å; F237-F285 AromaticContact CZ-CD1 3.79Å; F237-F285 HydrophobicContact CZ-CD1 3.79Å; F237-F285 HydrophobicContact CZ-CE1 4.32Å; P241-F285 HydrophobicContact CB-CE1 4.16Å; P241-F285 HydrophobicContact CB-CZ 4.44Å; P241-F285 HydrophobicContact CG-CD1 3.68Å; P241-F285 HydrophobicContact CG-CE1 3.67Å; P241-F285 HydrophobicContact CG-CG 4.35Å; P241-F285 HydrophobicContact CG-CZ 4.36Å; F282-F285 PolarHBondContact O-N 2.97Å; F282-F285 VanDerWaalsContact O-N 3.13Å; L283-F285 PolarHBondContact O-N 3.48Å; F285-W288 WeakPolarHBondContact O-CZ3 3.31Å
286I96.6Very high96.4Very high46 Ų4631.9 Ų31.924%0.23618%0.18CC..SBendtrans-119.312.4-174.667.6168.5000113.6F282 L283 F305F282-I286 HydrophobicContact CE1-CD1 4.2Å; L283-I286 HydrophobicContact CD2-CD1 3.77Å; L283-I286 HydrophobicContact CD2-CG1 4.26Å; L283-I286 WeakPolarHBondContact O-CG1 3.35Å; L283-I286 PolarHBondContact O-N 3.46Å; I286-F305 WeakPolarHBondContact O-CE1 3.38Å
287V97.6Very high96.3Very high0 Ų032.7 Ų32.70%018%0.183CC..  trans-124.5-0.2-177.3-59.70000114.4H240 L283 A289 H290 A308 I312H240-V287 WeakPolarHBondContact CD2-CG2 3.48Å; H240-V287 WeakPolarHBondContact NE2-CG2 3.39Å; L283-V287 WeakPolarHBondContact O-CG1 3.4Å; L283-V287 WeakPolarHBondContact O-CG2 3.46Å; V287-A289 PolarHBondContact O-N 3Å; V287-H290 PolarHBondContact O-CE1 2.94Å; V287-H290 PolarHBondContact O-N 3.48Å; V287-H290 PolarHBondContact O-ND1 2.85Å; V287-A308 HydrophobicContact CG1-CB 3.83Å; V287-I312 HydrophobicContact CB-CD1 4.29Å; V287-I312 HydrophobicContact CG1-CD1 3.83Å; V287-I312 HydrophobicContact CG2-CD1 3.69Å
288W97.6Very high96.2Very high60 Ų6036.6 Ų36.623%0.22720%0.204CC..G310 helixtrans-54.4-32.3-167.371.797000115.3H233 W236 F237 H240 F285 H290 H291 F305H233-W288 AromaticContact ND1-NE1 3.58Å; W236-W288 HydrophobicContact CB-CB 4.19Å; W236-W288 VanDerWaalsContact O-CB 3.25Å; W236-W288 WeakPolarHBondContact O-CB 3.41Å; F237-W288 HydrophobicContact CB-CG 4.43Å; F237-W288 HydrophobicContact CD2-CD2 4.16Å; F237-W288 HydrophobicContact CD2-CE3 4.12Å; F237-W288 HydrophobicContact CD2-CZ3 4.35Å; H240-W288 HydrophobicContact CB-CB 4.09Å; F285-W288 WeakPolarHBondContact O-CZ3 3.31Å; W288-H290 PolarHBondContact O-N 3.23Å; W288-H291 PolarHBondContact O-CD2 3.35Å; W288-H291 PolarHBondContact O-N 3.33Å; W288-F305 HydrophobicContact CD2-CE1 4.28Å; W288-F305 HydrophobicContact CD2-CZ 4.41Å; W288-F305 HydrophobicContact CE3-CE1 4.15Å; W288-F305 HydrophobicContact CE3-CZ 4.42Å; W288-F305 HydrophobicContact CH2-CZ 4.14Å; W288-F305 HydrophobicContact CZ2-CZ 4.13Å; W288-F305 HydrophobicContact CZ3-CE1 4.33Å; W288-F305 HydrophobicContact CZ3-CZ 4.29Å
289A96.7Very high96.1Very high1 Ų138.9 Ų38.91%0.00822%0.221CC..G310 helixtrans-75.1-1.8-173.500000114.2V287 H291 M292 M297 F305V287-A289 PolarHBondContact O-N 3Å; A289-H291 PolarHBondContact O-N 3.02Å; A289-M292 WeakPolarHBondContact O-CA 3.11Å; A289-M292 WeakPolarHBondContact O-CB 3.49Å; A289-M292 PolarHBondContact O-N 2.87Å; A289-M297 HydrophobicContact CB-CE 4.06Å; A289-M297 HydrophobicContact CB-SD 3.94Å; A289-M297 VanDerWaalsContact O-CE 3.25Å; A289-M297 WeakPolarHBondContact O-CE 3.4Å; A289-F305 HydrophobicContact CB-CD1 3.82Å; A289-F305 HydrophobicContact CB-CD2 3.64Å; A289-F305 HydrophobicContact CB-CE1 3.64Å; A289-F305 HydrophobicContact CB-CE2 3.45Å; A289-F305 VanDerWaalsContact CB-CE2 3.45Å; A289-F305 HydrophobicContact CB-CG 3.83Å; A289-F305 HydrophobicContact CB-CZ 3.45Å; A289-F305 VanDerWaalsContact CB-CZ 3.45Å
290H97.3Very high96.1Very high24 Ų2442.6 Ų42.611%0.11124%0.237CC..G310 helixtrans-63-21168.462.4-116.4000113H240 V287 W288 M292 F293 T309H240-H290 AromaticContact CE1-CE1 3.04Å; H240-H290 PolarHBondContact CE1-CE1 3.34Å; H240-H290 AromaticContact CE1-NE2 3.32Å; H240-H290 PolarHBondContact CE1-NE2 3.2Å; H240-H290 VanDerWaalsContact CE1-NE2 3.32Å; H240-H290 AromaticContact CG-CE1 3.76Å; H240-H290 AromaticContact ND1-CE1 3Å; H240-H290 PolarHBondContact ND1-CE1 3.5Å; H240-H290 AromaticContact ND1-NE2 2.99Å; H240-H290 PolarHBondContact ND1-NE2 3.24Å; H240-H290 AromaticContact NE2-CE1 3.71Å; V287-H290 PolarHBondContact O-CE1 2.94Å; V287-H290 PolarHBondContact O-N 3.48Å; V287-H290 PolarHBondContact O-ND1 2.85Å; W288-H290 PolarHBondContact O-N 3.23Å; H290-M292 PolarHBondContact O-N 3.41Å; H290-F293 HydrophobicContact CB-CD2 4.2Å; H290-F293 HydrophobicContact CB-CE1 4.21Å; H290-F293 HydrophobicContact CB-CE2 3.47Å; H290-F293 VanDerWaalsContact CB-CE2 3.47Å; H290-F293 HydrophobicContact CB-CZ 3.48Å; H290-F293 VanDerWaalsContact CB-CZ 3.48Å; H290-F293 WeakPolarHBondContact O-CD2 3.29Å; H290-T309 WeakPolarHBondContact ND1-CG2 3.28Å; H290-T309 PolarHBondContact ND1-OG1 2.6Å
291H97.3Very high96.2Very high43 Ų4344.7 Ų44.720%0.19925%0.249CC..G310 helixtrans-74.71171.9-63.4-70.1000113.5W236 H240 W288 A289 H368W236-H291 HydrophobicContact CD2-CB 3.4Å; W236-H291 AromaticContact CD2-CD2 3.54Å; W236-H291 AromaticContact CD2-CG 3.55Å; W236-H291 AromaticContact CE2-CG 3.75Å; W236-H291 HydrophobicContact CE3-CB 3.96Å; W236-H291 AromaticContact CE3-CD2 3.21Å; W236-H291 AromaticContact CE3-CG 3.53Å; W236-H291 AromaticContact CE3-NE2 3.6Å; W236-H291 HydrophobicContact CG-CB 3.67Å; W236-H291 HydrophobicContact CH2-CB 4.29Å; W236-H291 AromaticContact CH2-CG 3.95Å; W236-H291 AromaticContact CH2-ND1 3.82Å; W236-H291 HydrophobicContact CZ2-CB 3.78Å; W236-H291 AromaticContact CZ2-CG 3.96Å; W236-H291 HydrophobicContact CZ3-CB 4.36Å; W236-H291 AromaticContact CZ3-CD2 3.66Å; W236-H291 AromaticContact CZ3-CE1 3.74Å; W236-H291 AromaticContact CZ3-CG 3.74Å; W236-H291 AromaticContact CZ3-ND1 3.81Å; W236-H291 AromaticContact CZ3-NE2 3.63Å; H240-H291 AromaticContact ND1-NE2 3.3Å; H240-H291 PolarHBondContact ND1-NE2 3.48Å; W288-H291 PolarHBondContact O-CD2 3.35Å; W288-H291 PolarHBondContact O-N 3.33Å; A289-H291 PolarHBondContact O-N 3.02Å; H291-H368 PolarHBondContact O-CE1 2.81Å
292M97Very high96.2Very high0 Ų047.3 Ų47.30%026%0.257CS..G310 helixtrans-127.415.5-171.6-56.8174.460.800111.9I229 Q232 H233 A289 H290 T294 V295 M297I229-M292 HydrophobicContact CG2-CE 3.73Å; Q232-M292 HydrophobicContact CB-CE 3.55Å; Q232-M292 HydrophobicContact CB-CG 4.38Å; Q232-M292 HydrophobicContact CB-SD 3.99Å; H233-M292 WeakPolarHBondContact CE1-CE 3.36Å; H233-M292 WeakPolarHBondContact ND1-CE 3.38Å; H233-M292 PolarHBondContact ND1-SD 3.4Å; A289-M292 WeakPolarHBondContact O-CA 3.11Å; A289-M292 WeakPolarHBondContact O-CB 3.49Å; A289-M292 PolarHBondContact O-N 2.87Å; H290-M292 PolarHBondContact O-N 3.41Å; M292-T294 PolarHBondContact O-N 3.31Å; M292-V295 HydrophobicContact CB-CG1 3.96Å; M292-V295 HydrophobicContact CB-CG2 4.05Å; M292-V295 HydrophobicContact CE-CG2 4.16Å; M292-V295 VanDerWaalsContact O-CG2 3.24Å; M292-V295 WeakPolarHBondContact O-CG2 3.27Å; M292-V295 PolarHBondContact O-N 3.23Å; M292-M297 HydrophobicContact CB-CE 4.17Å; M292-M297 WeakPolarHBondContact O-CE 3.35Å
293F96.9Very high96.2Very high3 Ų342.8 Ų42.81%0.01325%0.247CC..THydrogen-bonded Turntrans-58.8-21.4-174.1-72.3-40.2000114.6H290 M297 R302 F305 D364H290-F293 HydrophobicContact CB-CD2 4.2Å; H290-F293 HydrophobicContact CB-CE1 4.21Å; H290-F293 HydrophobicContact CB-CE2 3.47Å; H290-F293 VanDerWaalsContact CB-CE2 3.47Å; H290-F293 HydrophobicContact CB-CZ 3.48Å; H290-F293 VanDerWaalsContact CB-CZ 3.48Å; H290-F293 WeakPolarHBondContact O-CD2 3.29Å; F293-M297 HydrophobicContact CD1-CE 3.79Å; F293-M297 HydrophobicContact CE1-CE 4.42Å; F293-R302 HydrophobicContact CD1-CB 4.46Å; F293-R302 HydrophobicContact CD1-CG 4.05Å; F293-F305 HydrophobicContact CE1-CB 3.76Å; F293-F305 HydrophobicContact CZ-CB 4.15Å; F293-D364 HydrophobicContact CB-CB 4.45Å; F293-D364 HydrophobicContact CD2-CB 3.76Å
294T95.9Very high96.4Very high64 Ų6447.4 Ų47.439%0.39326%0.263SS..THydrogen-bonded Turntrans-90.9-3.7179.454.10000114.5M292 G296 H368M292-T294 PolarHBondContact O-N 3.31Å; T294-G296 PolarHBondContact O-N 2.88Å; T294-H368 HydrophobicContact CG2-CB 3.5Å; T294-H368 VanDerWaalsContact CG2-CG 3.45Å; T294-H368 PolarHBondContact OG1-CD2 3.36Å; T294-H368 VanDerWaalsContact OG1-CD2 3.3Å; T294-H368 PolarHBondContact OG1-NE2 2.95Å
295V95.9Very high96.6Very high37 Ų3748 Ų4822%0.22427%0.266CS..SBendtrans-80.41.5-178.1-48.20000114I229 M292 M297I229-V295 HydrophobicContact CD1-CB 4.4Å; I229-V295 HydrophobicContact CG2-CG2 4.24Å; M292-V295 HydrophobicContact CB-CG1 3.96Å; M292-V295 HydrophobicContact CB-CG2 4.05Å; M292-V295 HydrophobicContact CE-CG2 4.16Å; M292-V295 VanDerWaalsContact O-CG2 3.24Å; M292-V295 WeakPolarHBondContact O-CG2 3.27Å; M292-V295 PolarHBondContact O-N 3.23Å; V295-M297 HydrophobicContact CG2-CG 3.88Å
296G94.6Very high96.7Very high70 Ų7047 Ų4772%0.72226%0.263SS*.  trans88.526.4179.300000115.1T294T294-G296 PolarHBondContact O-N 2.88Å
297M95Very high96.7Very high23 Ų2348.2 Ų48.211%0.11328%0.275CS..  trans-58.7148.6171.4-66.5-170.3-68.900111.9A289 M292 F293 V295 T301 R302A289-M297 HydrophobicContact CB-CE 4.06Å; A289-M297 HydrophobicContact CB-SD 3.94Å; A289-M297 VanDerWaalsContact O-CE 3.25Å; A289-M297 WeakPolarHBondContact O-CE 3.4Å; M292-M297 HydrophobicContact CB-CE 4.17Å; M292-M297 WeakPolarHBondContact O-CE 3.35Å; F293-M297 HydrophobicContact CD1-CE 3.79Å; F293-M297 HydrophobicContact CE1-CE 4.42Å; V295-M297 HydrophobicContact CG2-CG 3.88Å; M297-T301 HydrophobicContact CB-CG2 4.27Å; M297-T301 HydrophobicContact CG-CG2 4.44Å; M297-T301 HydrophobicContact SD-CG2 3.7Å; M297-R302 HydrophobicContact CB-CG 3.96Å; M297-R302 HydrophobicContact CE-CG 4.3Å; M297-R302 PolarHBondContact O-NE 3.06Å; M297-R302 VanDerWaalsContact O-NE 3.15Å
298D95.8Very high96.7Very high85 Ų8548.6 Ų48.646%0.45528%0.279SS..  trans-61.6163.6176.969.9-87.9000112.2D300 T301 R302D298-D300 VanDerWaalsContact C-N 3.33Å; D298-D300 PolarHBondContact O-N 3.2Å; D298-D300 WeakPolarHBondContact OD2-CB 3.4Å; D298-D300 PolarHBondContact OD2-N 3.5Å; D298-T301 VanDerWaalsContact CG-OG1 3.28Å; D298-T301 VanDerWaalsContact OD1-CB 3.25Å; D298-T301 WeakPolarHBondContact OD1-CB 3.24Å; D298-T301 PolarHBondContact OD1-OG1 2.88Å; D298-T301 PolarHBondContact OD2-N 2.9Å; D298-T301 PolarHBondContact OD2-OG1 3.03Å; D298-R302 WeakPolarHBondContact O-CG 3.4Å; D298-R302 PolarHBondContact O-N 3Å; D298-R302 VanDerWaalsContact O-N 3.08Å
299V95.5Very high96.7Very high98 Ų9846.6 Ų46.659%0.59427%0.273SS*.Hα-helixtrans-63.9-39.5-174.1178.20000111.7R302 A303V299-R302 PolarHBondContact O-N 3.44Å; V299-A303 WeakPolarHBondContact O-CB 3.49Å; V299-A303 PolarHBondContact O-N 3.33Å
300D97.4Very high96.7Very high130 Ų13049.6 Ų49.670%0.69529%0.288SS*.Hα-helixtrans-71.4-42.1-175.7-65.5-22.6000110.6D298 R302 A303 Y304D298-D300 VanDerWaalsContact C-N 3.33Å; D298-D300 PolarHBondContact O-N 3.2Å; D298-D300 WeakPolarHBondContact OD2-CB 3.4Å; D298-D300 PolarHBondContact OD2-N 3.5Å; D300-R302 PolarHBondContact O-N 2.74Å; D300-A303 PolarHBondContact O-N 3.04Å; D300-Y304 WeakPolarHBondContact O-CB 3.07Å; D300-Y304 PolarHBondContact O-N 3.31Å
301T96.5Very high96.7Very high44 Ų4452.5 Ų52.527%0.2730%0.303SS..Hα-helixtrans-59.8-45.6173.1-64.60000111M297 D298 A303 Y304 F305M297-T301 HydrophobicContact CB-CG2 4.27Å; M297-T301 HydrophobicContact CG-CG2 4.44Å; M297-T301 HydrophobicContact SD-CG2 3.7Å; D298-T301 VanDerWaalsContact CG-OG1 3.28Å; D298-T301 VanDerWaalsContact OD1-CB 3.25Å; D298-T301 WeakPolarHBondContact OD1-CB 3.24Å; D298-T301 PolarHBondContact OD1-OG1 2.88Å; D298-T301 PolarHBondContact OD2-N 2.9Å; D298-T301 PolarHBondContact OD2-OG1 3.03Å; T301-A303 PolarHBondContact O-N 3.01Å; T301-Y304 PolarHBondContact O-N 3.47Å; T301-F305 HydrophobicContact CG2-CD2 3.7Å; T301-F305 HydrophobicContact CG2-CE2 3.78Å; T301-F305 VanDerWaalsContact O-CD2 3.29Å; T301-F305 WeakPolarHBondContact O-CD2 3.36Å; T301-F305 PolarHBondContact O-N 2.7Å
302R96.4Very high96.7Very high61 Ų6150.9 Ų50.923%0.2330%0.296CS..Hα-helixtrans-63.5-40176.1-72.6-171.8-69.3159.41.2112.5F293 M297 D298 V299 D300 T306F293-R302 HydrophobicContact CD1-CB 4.46Å; F293-R302 HydrophobicContact CD1-CG 4.05Å; M297-R302 HydrophobicContact CB-CG 3.96Å; M297-R302 HydrophobicContact CE-CG 4.3Å; M297-R302 PolarHBondContact O-NE 3.06Å; M297-R302 VanDerWaalsContact O-NE 3.15Å; D298-R302 WeakPolarHBondContact O-CG 3.4Å; D298-R302 PolarHBondContact O-N 3Å; D298-R302 VanDerWaalsContact O-N 3.08Å; V299-R302 PolarHBondContact O-N 3.44Å; D300-R302 PolarHBondContact O-N 2.74Å; R302-T306 VanDerWaalsContact O-CB 3.27Å; R302-T306 WeakPolarHBondContact O-CB 3.37Å; R302-T306 PolarHBondContact O-N 3.1Å; R302-T306 PolarHBondContact O-OG1 3.43Å
303A96.8Very high96.6Very high49 Ų4952.7 Ų52.741%0.40531%0.311SS..Hα-helixtrans-65-41176.700000112V299 D300 T301 S307V299-A303 WeakPolarHBondContact O-CB 3.49Å; V299-A303 PolarHBondContact O-N 3.33Å; D300-A303 PolarHBondContact O-N 3.04Å; T301-A303 PolarHBondContact O-N 3.01Å; A303-S307 WeakPolarHBondContact O-CB 3.41Å; A303-S307 PolarHBondContact O-N 3.36Å; A303-S307 PolarHBondContact O-OG 2.87Å
304Y97.9Very high96.7Very high121 Ų12158 Ų5848%0.47534%0.338SS..Hα-helixtrans-59.3-56.4173.4171.8-95.2000111.2D300 T301 T306 S307 A308D300-Y304 WeakPolarHBondContact O-CB 3.07Å; D300-Y304 PolarHBondContact O-N 3.31Å; T301-Y304 PolarHBondContact O-N 3.47Å; Y304-T306 VanDerWaalsContact C-N 3.28Å; Y304-T306 PolarHBondContact O-N 3.31Å; Y304-S307 PolarHBondContact O-N 3.17Å; Y304-S307 VanDerWaalsContact O-N 3.14Å; Y304-A308 HydrophobicContact CE1-CB 4.36Å; Y304-A308 WeakPolarHBondContact O-CB 3.13Å; Y304-A308 PolarHBondContact O-N 2.77Å
305F97.8Very high96.7Very high14 Ų1455.5 Ų55.56%0.06132%0.323CS..Hα-helixtrans-66-31.5-176.8-82.3-72.4000112.6I286 W288 A289 F293 T301 T309I286-F305 WeakPolarHBondContact O-CE1 3.38Å; W288-F305 HydrophobicContact CD2-CE1 4.28Å; W288-F305 HydrophobicContact CD2-CZ 4.41Å; W288-F305 HydrophobicContact CE3-CE1 4.15Å; W288-F305 HydrophobicContact CE3-CZ 4.42Å; W288-F305 HydrophobicContact CH2-CZ 4.14Å; W288-F305 HydrophobicContact CZ2-CZ 4.13Å; W288-F305 HydrophobicContact CZ3-CE1 4.33Å; W288-F305 HydrophobicContact CZ3-CZ 4.29Å; A289-F305 HydrophobicContact CB-CD1 3.82Å; A289-F305 HydrophobicContact CB-CD2 3.64Å; A289-F305 HydrophobicContact CB-CE1 3.64Å; A289-F305 HydrophobicContact CB-CE2 3.45Å; A289-F305 VanDerWaalsContact CB-CE2 3.45Å; A289-F305 HydrophobicContact CB-CG 3.83Å; A289-F305 HydrophobicContact CB-CZ 3.45Å; A289-F305 VanDerWaalsContact CB-CZ 3.45Å; F293-F305 HydrophobicContact CE1-CB 3.76Å; F293-F305 HydrophobicContact CZ-CB 4.15Å; T301-F305 HydrophobicContact CG2-CD2 3.7Å; T301-F305 HydrophobicContact CG2-CE2 3.78Å; T301-F305 VanDerWaalsContact O-CD2 3.29Å; T301-F305 WeakPolarHBondContact O-CD2 3.36Å; T301-F305 PolarHBondContact O-N 2.7Å; F305-T309 WeakPolarHBondContact O-CB 3.42Å; F305-T309 PolarHBondContact O-N 3.27Å; F305-T309 PolarHBondContact O-OG1 3.03Å
306T97.8Very high96.8Very high15 Ų1555 Ų559%0.09232%0.32CS..Hα-helixtrans-60.1-54.2170.3-63.70000110.6R302 Y304 T309 M310 A359 S361R302-T306 VanDerWaalsContact O-CB 3.27Å; R302-T306 WeakPolarHBondContact O-CB 3.37Å; R302-T306 PolarHBondContact O-N 3.1Å; R302-T306 PolarHBondContact O-OG1 3.43Å; Y304-T306 VanDerWaalsContact C-N 3.28Å; Y304-T306 PolarHBondContact O-N 3.31Å; T306-T309 PolarHBondContact O-N 3.45Å; T306-M310 HydrophobicContact CG2-CE 3.79Å; T306-M310 HydrophobicContact CG2-SD 4.12Å; T306-M310 WeakPolarHBondContact O-CG 3.37Å; T306-M310 PolarHBondContact O-N 3.16Å; T306-A359 WeakPolarHBondContact CA-O 2.99Å; T306-A359 WeakPolarHBondContact CG2-O 3.4Å; T306-S361 VanDerWaalsContact OG1-CB 3.31Å; T306-S361 WeakPolarHBondContact OG1-CB 3.44Å; T306-S361 PolarHBondContact OG1-N 2.9Å; T306-S361 PolarHBondContact OG1-OG 3.14Å
307S97.1Very high96.9Very high71 Ų7153.3 Ų53.350%0.49730%0.302SS..Hα-helixtrans-63.9-46.9-177-55.80000111.8A303 Y304 T309 M310 I311A303-S307 WeakPolarHBondContact O-CB 3.41Å; A303-S307 PolarHBondContact O-N 3.36Å; A303-S307 PolarHBondContact O-OG 2.87Å; Y304-S307 PolarHBondContact O-N 3.17Å; Y304-S307 VanDerWaalsContact O-N 3.14Å; S307-T309 VanDerWaalsContact C-N 3.35Å; S307-T309 PolarHBondContact O-N 3.17Å; S307-M310 PolarHBondContact O-N 3.21Å; S307-I311 WeakPolarHBondContact O-CG1 3.31Å; S307-I311 PolarHBondContact O-N 2.79Å; S307-I311 VanDerWaalsContact O-N 3.11Å
308A97.4Very high97Very high8 Ų855.1 Ų55.17%0.06632%0.315CS..Hα-helixtrans-62.6-40.6179.800000112V287 Y304 I311V287-A308 HydrophobicContact CG1-CB 3.83Å; Y304-A308 HydrophobicContact CE1-CB 4.36Å; Y304-A308 WeakPolarHBondContact O-CB 3.13Å; Y304-A308 PolarHBondContact O-N 2.77Å; A308-I311 PolarHBondContact O-N 3.23Å
309T97.3Very high97.1Very high18 Ų1851.1 Ų51.111%0.1129%0.294CS..Hα-helixtrans-67.3-42.7177.3-54.90000111.4H290 F305 T306 S307 I311 I312 A359H290-T309 WeakPolarHBondContact ND1-CG2 3.28Å; H290-T309 PolarHBondContact ND1-OG1 2.6Å; F305-T309 WeakPolarHBondContact O-CB 3.42Å; F305-T309 PolarHBondContact O-N 3.27Å; F305-T309 PolarHBondContact O-OG1 3.03Å; T306-T309 PolarHBondContact O-N 3.45Å; S307-T309 VanDerWaalsContact C-N 3.35Å; S307-T309 PolarHBondContact O-N 3.17Å; T309-I311 VanDerWaalsContact C-N 3.28Å; T309-I311 PolarHBondContact O-N 3.36Å; T309-I312 WeakPolarHBondContact O-CB 3.19Å; T309-I312 PolarHBondContact O-N 2.91Å; T309-I312 VanDerWaalsContact O-N 3.16Å; T309-A359 HydrophobicContact CG2-CB 3.59Å
310M97.1Very high97.2Very high64 Ų6447.5 Ų47.532%0.31527%0.272SS..Hα-helixtrans-62.9-32.6177.5-72.5-179.8178.300112.9T306 S307 I312 A313 A359 N360T306-M310 HydrophobicContact CG2-CE 3.79Å; T306-M310 HydrophobicContact CG2-SD 4.12Å; T306-M310 WeakPolarHBondContact O-CG 3.37Å; T306-M310 PolarHBondContact O-N 3.16Å; S307-M310 PolarHBondContact O-N 3.21Å; M310-I312 PolarHBondContact O-N 3.19Å; M310-A313 VanDerWaalsContact O-CB 3.23Å; M310-A313 WeakPolarHBondContact O-CB 3.25Å; M310-A313 PolarHBondContact O-N 3.41Å; M310-A359 HydrophobicContact CE-CB 4.41Å; M310-A359 HydrophobicContact CG-CB 3.87Å; M310-N360 HydrophobicContact CE-CB 3.71Å
311I97.3Very high97.2Very high85 Ų8547.4 Ų47.444%0.43627%0.265SS..Hα-helixtrans-59.4-29.1177-72.3166.5000111.9L283 S307 A308 T309 A313 I314 P315L283-I311 HydrophobicContact CD1-CG2 4Å; S307-I311 WeakPolarHBondContact O-CG1 3.31Å; S307-I311 PolarHBondContact O-N 2.79Å; S307-I311 VanDerWaalsContact O-N 3.11Å; A308-I311 PolarHBondContact O-N 3.23Å; T309-I311 VanDerWaalsContact C-N 3.28Å; T309-I311 PolarHBondContact O-N 3.36Å; I311-A313 PolarHBondContact O-N 3.15Å; I311-A313 VanDerWaalsContact O-N 3.17Å; I311-I314 WeakPolarHBondContact O-CB 3.23Å; I311-I314 PolarHBondContact O-N 3.17Å; I311-P315 VanDerWaalsContact O-CD 3.23Å; I311-P315 WeakPolarHBondContact O-CD 3.33Å
312I96.6Very high97.2Very high8 Ų845.5 Ų45.54%0.04125%0.254CS..THydrogen-bonded Turntrans-62.2-24.3178.4-59.6-177.5000112.2Y244 I280 L283 V287 T309 M310 I314 P315 T316Y244-I312 HydrophobicContact CE2-CD1 4.18Å; Y244-I312 WeakPolarHBondContact OH-CD1 3.26Å; I280-I312 HydrophobicContact CG1-CG2 4.41Å; I280-I312 HydrophobicContact CG2-CG2 4.47Å; L283-I312 HydrophobicContact CB-CD1 3.97Å; L283-I312 HydrophobicContact CB-CG1 3.8Å; L283-I312 HydrophobicContact CD1-CG1 3.87Å; L283-I312 HydrophobicContact CG-CG1 4.43Å; V287-I312 HydrophobicContact CB-CD1 4.29Å; V287-I312 HydrophobicContact CG1-CD1 3.83Å; V287-I312 HydrophobicContact CG2-CD1 3.69Å; T309-I312 WeakPolarHBondContact O-CB 3.19Å; T309-I312 PolarHBondContact O-N 2.91Å; T309-I312 VanDerWaalsContact O-N 3.16Å; M310-I312 PolarHBondContact O-N 3.19Å; I312-I314 PolarHBondContact O-N 3.45Å; I312-P315 VanDerWaalsContact O-CD 3.29Å; I312-P315 WeakPolarHBondContact O-CD 3.23Å; I312-P315 WeakPolarHBondContact O-CG 3.24Å; I312-T316 WeakPolarHBondContact O-CB 3.42Å; I312-T316 PolarHBondContact O-N 3.27Å; I312-T316 PolarHBondContact O-OG1 3.29Å
313A96.4Very high97.3Very high38 Ų3842.6 Ų42.631%0.31424%0.243SC..Hα-helixtrans-60.8-29174.800000112.4M310 I311 G317 I356M310-A313 VanDerWaalsContact O-CB 3.23Å; M310-A313 WeakPolarHBondContact O-CB 3.25Å; M310-A313 PolarHBondContact O-N 3.41Å; I311-A313 PolarHBondContact O-N 3.15Å; I311-A313 VanDerWaalsContact O-N 3.17Å; A313-G317 PolarHBondContact O-N 2.8Å; A313-I356 HydrophobicContact CB-CD1 3.81Å; A313-I356 HydrophobicContact CB-CG1 4.1Å
314I97.6Very high97.3Very high114 Ų11444.5 Ų44.559%0.58525%0.245SC*.Hα-helixtrans-65.7-62.3-179-59.9173.3000111.8I311 I312 T316 G317 V318I311-I314 WeakPolarHBondContact O-CB 3.23Å; I311-I314 PolarHBondContact O-N 3.17Å; I312-I314 PolarHBondContact O-N 3.45Å; I314-T316 PolarHBondContact O-N 2.85Å; I314-G317 PolarHBondContact O-N 3.23Å; I314-G317 VanDerWaalsContact O-N 3.1Å; I314-V318 WeakPolarHBondContact O-CG2 3.48Å; I314-V318 PolarHBondContact O-N 3.12Å
315P97.6Very high97.3Very high12 Ų1239.7 Ų39.78%0.07823%0.231CC..Hα-helixtrans-63.3-29.6178.825.7-35000112.3A276 I280 L283 I311 I312 V318 K319A276-P315 HydrophobicContact CB-CB 3.85Å; A276-P315 WeakPolarHBondContact CB-O 3.25Å; I280-P315 HydrophobicContact CD1-CB 4.21Å; I280-P315 HydrophobicContact CD1-CG 4.38Å; I280-P315 HydrophobicContact CG1-CB 3.88Å; I280-P315 HydrophobicContact CG1-CG 3.67Å; L283-P315 HydrophobicContact CD1-CG 4.42Å; I311-P315 VanDerWaalsContact O-CD 3.23Å; I311-P315 WeakPolarHBondContact O-CD 3.33Å; I312-P315 VanDerWaalsContact O-CD 3.29Å; I312-P315 WeakPolarHBondContact O-CD 3.23Å; I312-P315 WeakPolarHBondContact O-CG 3.24Å; P315-V318 PolarHBondContact O-N 3.16Å; P315-K319 PolarHBondContact O-N 3.46Å
316T96.2Very high97.2Very high26 Ų2639 Ų3916%0.1623%0.228CC..Hα-helixtrans-64.2-45.6173-57.40000111.2I312 I314 V318 K319 V320 F348I312-T316 WeakPolarHBondContact O-CB 3.42Å; I312-T316 PolarHBondContact O-N 3.27Å; I312-T316 PolarHBondContact O-OG1 3.29Å; I314-T316 PolarHBondContact O-N 2.85Å; T316-V318 PolarHBondContact O-N 2.89Å; T316-K319 PolarHBondContact O-N 3.4Å; T316-V320 PolarHBondContact O-N 3.01Å; T316-V320 VanDerWaalsContact O-N 3.11Å; T316-F348 HydrophobicContact CG2-CE1 3.51Å; T316-F348 HydrophobicContact CG2-CZ 3.89Å
317G97.1Very high97Very high35 Ų3539.3 Ų39.336%0.36123%0.229SC..Hα-helixtrans-62.3-39.5175.600000113.1A313 I314 K319 V320 F321A313-G317 PolarHBondContact O-N 2.8Å; I314-G317 PolarHBondContact O-N 3.23Å; I314-G317 VanDerWaalsContact O-N 3.1Å; G317-K319 VanDerWaalsContact C-N 3.25Å; G317-K319 PolarHBondContact O-N 3.43Å; G317-V320 PolarHBondContact O-N 3.45Å; G317-F321 WeakPolarHBondContact O-CB 3.12Å; G317-F321 PolarHBondContact O-N 2.88Å
318V97.6Very high96.9Very high62 Ų6243.2 Ų43.238%0.37624%0.239SC..Hα-helixtrans-55.6-42.2173.6170.80000111.1A276 I314 P315 T316 S322A276-V318 HydrophobicContact CB-CB 4.43Å; A276-V318 HydrophobicContact CB-CG1 4.32Å; I314-V318 WeakPolarHBondContact O-CG2 3.48Å; I314-V318 PolarHBondContact O-N 3.12Å; P315-V318 PolarHBondContact O-N 3.16Å; T316-V318 PolarHBondContact O-N 2.89Å; V318-S322 VanDerWaalsContact O-CB 3.25Å; V318-S322 WeakPolarHBondContact O-CB 3.37Å; V318-S322 PolarHBondContact O-N 2.97Å
319K97.1Very high96.5Very high1 Ų146.5 Ų46.50%0.00427%0.274CS..Hα-helixtrans-69.5-44.3178.7-69.4172.355.3-89.90112.4F251 A276 M277 I280 P315 T316 G317 F321 S322 W323F251-K319 VanDerWaalsContact CE2-NZ 3.29Å; F251-K319 VanDerWaalsContact CG-CE 3.49Å; A276-K319 HydrophobicContact CB-CD 3.99Å; A276-K319 HydrophobicContact CB-CG 3.8Å; M277-K319 HydrophobicContact CG-CD 4.05Å; I280-K319 HydrophobicContact CD1-CD 4.16Å; P315-K319 PolarHBondContact O-N 3.46Å; T316-K319 PolarHBondContact O-N 3.4Å; G317-K319 VanDerWaalsContact C-N 3.25Å; G317-K319 PolarHBondContact O-N 3.43Å; K319-F321 VanDerWaalsContact C-N 3.34Å; K319-F321 PolarHBondContact O-N 2.83Å; K319-S322 PolarHBondContact O-N 3.41Å; K319-W323 HydrophobicContact CB-CH2 4.29Å; K319-W323 HydrophobicContact CB-CZ2 4.43Å; K319-W323 HydrophobicContact CB-CZ3 4.48Å; K319-W323 VanDerWaalsContact NZ-CH2 3.31Å; K319-W323 VanDerWaalsContact O-CD2 3.31Å; K319-W323 PolarHBondContact O-N 3.34Å
320V97.6Very high96.1Very high22 Ų2247 Ų4713%0.13328%0.278CS..Hα-helixtrans-59.2-47.6175.91730000110.6T316 G317 S322 W323 L324 I345 F348T316-V320 PolarHBondContact O-N 3.01Å; T316-V320 VanDerWaalsContact O-N 3.11Å; G317-V320 PolarHBondContact O-N 3.45Å; V320-S322 PolarHBondContact O-N 2.65Å; V320-W323 HydrophobicContact CG2-CE3 4.32Å; V320-W323 HydrophobicContact CG2-CZ3 4.09Å; V320-W323 PolarHBondContact O-N 3.43Å; V320-L324 HydrophobicContact CG1-CD1 4.27Å; V320-L324 WeakPolarHBondContact O-CG 3.41Å; V320-L324 PolarHBondContact O-N 2.99Å; V320-L324 VanDerWaalsContact O-N 3.12Å; V320-I345 HydrophobicContact CG1-CG2 4.25Å; V320-F348 HydrophobicContact CG2-CD1 4.5Å
321F97.9Very high95.6Very high127 Ų12751.7 Ų51.756%0.55730%0.304SS*.Hα-helixtrans-59.4-45.4175.9177-100.2000112F268 G317 K319 W323 L324 A325F268-F321 HydrophobicContact CD1-CE1 4.38Å; F268-F321 HydrophobicContact CE1-CD1 4.32Å; F268-F321 AromaticContact CE1-CE1 3.72Å; F268-F321 HydrophobicContact CE1-CE1 3.72Å; F268-F321 HydrophobicContact CZ-CE1 4.4Å; G317-F321 WeakPolarHBondContact O-CB 3.12Å; G317-F321 PolarHBondContact O-N 2.88Å; K319-F321 VanDerWaalsContact C-N 3.34Å; K319-F321 PolarHBondContact O-N 2.83Å; F321-W323 PolarHBondContact O-N 2.76Å; F321-L324 PolarHBondContact O-N 3.46Å; F321-A325 HydrophobicContact CE1-CB 4.43Å; F321-A325 WeakPolarHBondContact O-CB 3.49Å; F321-A325 PolarHBondContact O-N 3.17Å
322S97.9Very high94.9Very high4 Ų449.4 Ų49.43%0.02829%0.292CS..Hα-helixtrans-59.7-42.5178.2167.20000112.6F268 M273 V318 K319 V320 A325 T326F268-S322 WeakPolarHBondContact O-CB 3.44Å; F268-S322 PolarHBondContact O-OG 3.4Å; M273-S322 WeakPolarHBondContact CG-OG 3.01Å; M273-S322 PolarHBondContact SD-OG 2.74Å; V318-S322 VanDerWaalsContact O-CB 3.25Å; V318-S322 WeakPolarHBondContact O-CB 3.37Å; V318-S322 PolarHBondContact O-N 2.97Å; K319-S322 PolarHBondContact O-N 3.41Å; V320-S322 PolarHBondContact O-N 2.65Å; S322-A325 PolarHBondContact O-N 3.49Å; S322-T326 WeakPolarHBondContact O-CB 3.43Å; S322-T326 PolarHBondContact O-N 2.71Å; S322-T326 PolarHBondContact O-OG1 2.58Å
323W97.7Very high94.3Very high0 Ų054.7 Ų54.70%032%0.315CS..Hα-helixtrans-62.2-46.1174.6-65.4-42.5000111.9F251 I254 S255 M273 K319 V320 F321 A325 T326 L327 F344 I345F251-W323 HydrophobicContact CB-CH2 4.32Å; F251-W323 HydrophobicContact CB-CZ2 4.01Å; F251-W323 AromaticContact CD1-CH2 3.57Å; F251-W323 HydrophobicContact CD1-CH2 3.57Å; F251-W323 HydrophobicContact CD1-CZ2 4.12Å; F251-W323 HydrophobicContact CE1-CH2 4.14Å; F251-W323 HydrophobicContact CG-CH2 4.21Å; F251-W323 HydrophobicContact CG-CZ2 4.39Å; I254-W323 HydrophobicContact CB-CZ2 4.45Å; I254-W323 HydrophobicContact CG2-CD2 4.17Å; I254-W323 HydrophobicContact CG2-CG 4.48Å; I254-W323 HydrophobicContact CG2-CZ2 4.29Å; S255-W323 PolarHBondContact OG-NE1 3.33Å; M273-W323 VanDerWaalsContact CE-NE1 3.33Å; K319-W323 HydrophobicContact CB-CH2 4.29Å; K319-W323 HydrophobicContact CB-CZ2 4.43Å; K319-W323 HydrophobicContact CB-CZ3 4.48Å; K319-W323 VanDerWaalsContact NZ-CH2 3.31Å; K319-W323 VanDerWaalsContact O-CD2 3.31Å; K319-W323 PolarHBondContact O-N 3.34Å; V320-W323 HydrophobicContact CG2-CE3 4.32Å; V320-W323 HydrophobicContact CG2-CZ3 4.09Å; V320-W323 PolarHBondContact O-N 3.43Å; F321-W323 PolarHBondContact O-N 2.76Å; W323-A325 PolarHBondContact O-N 3.05Å; W323-T326 WeakPolarHBondContact O-CB 3.34Å; W323-T326 PolarHBondContact O-N 2.91Å; W323-T326 VanDerWaalsContact O-N 3.16Å; W323-L327 WeakPolarHBondContact O-CG 3.22Å; W323-L327 PolarHBondContact O-N 3.06Å; W323-F344 AromaticContact CH2-CE1 3.67Å; W323-F344 HydrophobicContact CH2-CE1 3.67Å; W323-F344 HydrophobicContact CH2-CZ 4.37Å; W323-F344 HydrophobicContact CZ2-CE1 4.47Å; W323-F344 HydrophobicContact CZ3-CD1 4.49Å; W323-F344 AromaticContact CZ3-CE1 3.75Å; W323-F344 HydrophobicContact CZ3-CE1 3.75Å; W323-I345 HydrophobicContact CB-CD1 3.73Å; W323-I345 HydrophobicContact CB-CG1 4.38Å; W323-I345 HydrophobicContact CD2-CG1 4.35Å; W323-I345 HydrophobicContact CE3-CD1 4.44Å; W323-I345 HydrophobicContact CE3-CG1 3.84Å; W323-I345 HydrophobicContact CG-CD1 4.28Å
324L97Very high94Very high89 Ų8960 Ų6047%0.46633%0.327SS..Hα-helixtrans-62.6-41.8177.8-65.6175.8000112V320 F321 T326 L327 H328 I345V320-L324 HydrophobicContact CG1-CD1 4.27Å; V320-L324 WeakPolarHBondContact O-CG 3.41Å; V320-L324 PolarHBondContact O-N 2.99Å; V320-L324 VanDerWaalsContact O-N 3.12Å; F321-L324 PolarHBondContact O-N 3.46Å; L324-T326 VanDerWaalsContact C-N 3.3Å; L324-T326 PolarHBondContact O-N 3.26Å; L324-L327 PolarHBondContact O-N 3.31Å; L324-H328 PolarHBondContact O-N 3.1Å; L324-I345 HydrophobicContact CD2-CG2 4.26Å
325A97Very high93.8Very high21 Ų2155.1 Ų55.117%0.17430%0.303CS..Hα-helixtrans-65.8-32.9175.200000112.3K264 F268 F321 S322 W323 H328K264-A325 PolarHBondContact NZ-O 2.82Å; F268-A325 HydrophobicContact CB-CB 3.84Å; F268-A325 HydrophobicContact CD1-CB 3.58Å; F268-A325 HydrophobicContact CD2-CB 4.16Å; F268-A325 HydrophobicContact CE1-CB 4.18Å; F268-A325 HydrophobicContact CG-CB 3.56Å; F321-A325 HydrophobicContact CE1-CB 4.43Å; F321-A325 WeakPolarHBondContact O-CB 3.49Å; F321-A325 PolarHBondContact O-N 3.17Å; S322-A325 PolarHBondContact O-N 3.49Å; W323-A325 PolarHBondContact O-N 3.05Å; A325-H328 PolarHBondContact O-N 2.7Å
326T95.7Very high93.8Very high0 Ų054.6 Ų54.60%030%0.299CS..Hα-helixtrans-67.7-39173.8-54.30000111.2V258 K264 P267 F268 S322 W323 L324V258-T326 HydrophobicContact CG1-CG2 3.7Å; K264-T326 HydrophobicContact CD-CG2 4.09Å; K264-T326 WeakPolarHBondContact CD-O 3.35Å; K264-T326 WeakPolarHBondContact CE-O 3.46Å; K264-T326 PolarHBondContact NZ-O 2.87Å; P267-T326 HydrophobicContact CB-CG2 4.42Å; F268-T326 PolarHBondContact N-OG1 2.87Å; S322-T326 WeakPolarHBondContact O-CB 3.43Å; S322-T326 PolarHBondContact O-N 2.71Å; S322-T326 PolarHBondContact O-OG1 2.58Å; W323-T326 WeakPolarHBondContact O-CB 3.34Å; W323-T326 PolarHBondContact O-N 2.91Å; W323-T326 VanDerWaalsContact O-N 3.16Å; L324-T326 VanDerWaalsContact C-N 3.3Å; L324-T326 PolarHBondContact O-N 3.26Å
327L94.6Very high93.8Very high21 Ų2153.3 Ų53.311%0.1129%0.292CS..Hα-helixtrans-73.8-26.8175.3-62.8163.3000112.5V258 W323 L324 G329 S330 M332 L342 I345V258-L327 HydrophobicContact CB-CD2 4.45Å; V258-L327 HydrophobicContact CG1-CD1 4.45Å; V258-L327 HydrophobicContact CG1-CD2 3.79Å; V258-L327 HydrophobicContact CG1-CG 3.76Å; V258-L327 HydrophobicContact CG2-CD2 4.33Å; W323-L327 WeakPolarHBondContact O-CG 3.22Å; W323-L327 PolarHBondContact O-N 3.06Å; L324-L327 PolarHBondContact O-N 3.31Å; L327-G329 PolarHBondContact O-N 3.19Å; L327-S330 PolarHBondContact O-N 3.07Å; L327-S330 PolarHBondContact O-OG 3.2Å; L327-M332 HydrophobicContact CB-SD 4.32Å; L327-M332 HydrophobicContact CD2-SD 3.35Å; L327-M332 WeakPolarHBondContact CD2-SD 3.48Å; L327-M332 HydrophobicContact CG-SD 4.39Å; L327-L342 HydrophobicContact CD1-CD2 3.67Å; L327-I345 HydrophobicContact CD1-CD1 4.18Å
328H94.4Very high93.7Very high153 Ų15351.9 Ų51.971%0.70828%0.276SS*.THydrogen-bonded Turntrans-62.9129.9-178.8-176.2-92.5000112.1K264 L324 A325 S330K264-H328 PolarHBondContact NZ-O 3.26Å; L324-H328 PolarHBondContact O-N 3.1Å; A325-H328 PolarHBondContact O-N 2.7Å; H328-S330 VanDerWaalsContact C-N 3.27Å; H328-S330 PolarHBondContact O-N 3.48Å
329G89.3Confident93.7Very high77 Ų7750.7 Ų50.779%0.79427%0.267SS*.THydrogen-bonded Turntrans73.49.517800000115.3L327L327-G329 PolarHBondContact O-N 3.19Å
330S88.9Confident93.8Very high27 Ų2750.7 Ų50.719%0.18927%0.267CS..  trans-90.3148.717469.10000112S262 L327 H328 M332S262-S330 WeakPolarHBondContact O-CB 3.3Å; L327-S330 PolarHBondContact O-N 3.07Å; L327-S330 PolarHBondContact O-OG 3.2Å; H328-S330 VanDerWaalsContact C-N 3.27Å; H328-S330 PolarHBondContact O-N 3.48Å; S330-M332 PolarHBondContact O-N 2.95Å; S330-M332 WeakPolarHBondContact OG-CG 3.21Å
331N85.8Confident93.8Very high163 Ų16349.7 Ų49.787%0.87226%0.261SS*.  trans-88.482.2171.7-173.310000109.3
332M83.9Confident93.8Very high38 Ų3846 Ų4619%0.18725%0.247CC..  trans-75.3132.6-172.1-63.8-166.1-61.400113.2L327 S330 W334 V338L327-M332 HydrophobicContact CB-SD 4.32Å; L327-M332 HydrophobicContact CD2-SD 3.35Å; L327-M332 WeakPolarHBondContact CD2-SD 3.48Å; L327-M332 HydrophobicContact CG-SD 4.39Å; S330-M332 PolarHBondContact O-N 2.95Å; S330-M332 WeakPolarHBondContact OG-CG 3.21Å; M332-W334 HydrophobicContact CE-CH2 3.79Å; M332-W334 HydrophobicContact CE-CZ2 4.03Å; M332-W334 HydrophobicContact CE-CZ3 4.28Å; M332-V338 HydrophobicContact SD-CG1 4.36Å
333K83.4Confident93.8Very high118 Ų11846 Ų4651%0.51325%0.247SC..  trans-79.6121.5160.3-66.9177.3-176.1166.10109S335 E486K333-S335 PolarHBondContact O-N 2.99Å; K333-E486 IonicContact NZ-OE1 3.81Å; K333-E486 PolarHBondContact NZ-OE1 2.99Å; K333-E486 IonicContact NZ-OE2 2.68Å; K333-E486 PolarHBondContact NZ-OE2 3.41Å
334W90.7Very high93.8Very high149 Ų14946 Ų4656%0.56425%0.247SC*.  trans-72.970.8176.6-63.7102.7000112M332 V338 L339 L342 K411M332-W334 HydrophobicContact CE-CH2 3.79Å; M332-W334 HydrophobicContact CE-CZ2 4.03Å; M332-W334 HydrophobicContact CE-CZ3 4.28Å; W334-V338 HydrophobicContact CE3-CG1 4.45Å; W334-L339 HydrophobicContact CE3-CD2 4.16Å; W334-L342 HydrophobicContact CE3-CD1 4.44Å; W334-L342 HydrophobicContact CH2-CD1 4.2Å; W334-L342 HydrophobicContact CZ3-CD1 3.5Å; W334-K411 WeakPolarHBondContact O-CE 3.27Å; W334-K411 PolarHBondContact O-NZ 3.29Å
335S93.8Very high93.8Very high13 Ų1342.1 Ų42.19%0.09123%0.227CC..  trans-80.9161.3172.473.60000111.1Y261 K333 A337 V338 L339Y261-S335 WeakPolarHBondContact CD1-OG 3.33Å; Y261-S335 WeakPolarHBondContact CE1-OG 3.42Å; K333-S335 PolarHBondContact O-N 2.99Å; S335-A337 VanDerWaalsContact C-N 3.28Å; S335-A337 PolarHBondContact O-N 2.99Å; S335-V338 PolarHBondContact O-N 2.93Å; S335-V338 WeakPolarHBondContact OG-CG2 3.25Å; S335-V338 PolarHBondContact OG-N 3.1Å; S335-L339 PolarHBondContact O-N 2.98Å
336A96.7Very high93.8Very high0 Ų046.6 Ų46.60%024%0.243CC..Hα-helixtrans-59.2-39.1175.700000112.3V338 L339 W340 I394 Q407 A410 K411A336-V338 VanDerWaalsContact C-N 3.31Å; A336-V338 PolarHBondContact O-N 3.02Å; A336-L339 WeakPolarHBondContact O-CB 3.38Å; A336-L339 PolarHBondContact O-N 2.95Å; A336-L339 VanDerWaalsContact O-N 3.1Å; A336-W340 PolarHBondContact O-N 3.35Å; A336-I394 HydrophobicContact CB-CD1 4.42Å; A336-I394 HydrophobicContact CB-CG2 4.16Å; A336-Q407 VanDerWaalsContact N-OE1 3.16Å; A336-A410 HydrophobicContact CB-CB 3.5Å; A336-A410 VanDerWaalsContact CB-CB 3.5Å; A336-K411 HydrophobicContact CB-CG 4.29Å
337A96.1Very high93.9Very high0 Ų046.6 Ų46.60%024%0.243CC..Hα-helixtrans-60-38.817800000112.8I257 Y261 S335 W340 A341 I394 H395I257-A337 HydrophobicContact CG2-CB 4.1Å; Y261-A337 HydrophobicContact CD2-CB 4.39Å; Y261-A337 HydrophobicContact CE2-CB 3.53Å; S335-A337 VanDerWaalsContact C-N 3.28Å; S335-A337 PolarHBondContact O-N 2.99Å; A337-W340 PolarHBondContact O-N 2.66Å; A337-A341 PolarHBondContact O-N 3.45Å; A337-I394 HydrophobicContact CB-CG2 4.17Å; A337-H395 HydrophobicContact CB-CB 4.25Å
338V95.8Very high94Very high5 Ų546.2 Ų46.23%0.0324%0.24CC..Hα-helixtrans-65.2-40.3174.4174.40000111.2Y261 M332 W334 S335 A336 W340 A341 L342Y261-V338 HydrophobicContact CD1-CG2 3.94Å; Y261-V338 HydrophobicContact CD2-CG2 3.76Å; Y261-V338 HydrophobicContact CG-CG2 3.39Å; M332-V338 HydrophobicContact SD-CG1 4.36Å; W334-V338 HydrophobicContact CE3-CG1 4.45Å; S335-V338 PolarHBondContact O-N 2.93Å; S335-V338 WeakPolarHBondContact OG-CG2 3.25Å; S335-V338 PolarHBondContact OG-N 3.1Å; A336-V338 VanDerWaalsContact C-N 3.31Å; A336-V338 PolarHBondContact O-N 3.02Å; V338-W340 PolarHBondContact O-N 2.71Å; V338-A341 PolarHBondContact O-N 3.39Å; V338-L342 HydrophobicContact CG1-CD1 3.92Å; V338-L342 HydrophobicContact CG1-CG 4.28Å; V338-L342 WeakPolarHBondContact O-CG 3.31Å; V338-L342 PolarHBondContact O-N 3.27Å
339L97.7Very high94.1Very high37 Ų3741.3 Ų41.319%0.19422%0.221CC..Hα-helixtrans-61.4-43.8176.1-63.7178.6000111.6W334 S335 A336 A341 L342 G343 K411 F414W334-L339 HydrophobicContact CE3-CD2 4.16Å; S335-L339 PolarHBondContact O-N 2.98Å; A336-L339 WeakPolarHBondContact O-CB 3.38Å; A336-L339 PolarHBondContact O-N 2.95Å; A336-L339 VanDerWaalsContact O-N 3.1Å; L339-A341 VanDerWaalsContact C-N 3.34Å; L339-A341 PolarHBondContact O-N 3.41Å; L339-L342 PolarHBondContact O-N 3.17Å; L339-G343 PolarHBondContact O-N 3.07Å; L339-K411 HydrophobicContact CD1-CB 4.46Å; L339-K411 HydrophobicContact CD1-CG 3.93Å; L339-F414 VanDerWaalsContact C-CE2 3.49Å; L339-F414 HydrophobicContact CB-CD1 3.69Å; L339-F414 HydrophobicContact CB-CD2 4.1Å; L339-F414 HydrophobicContact CB-CE1 3.79Å; L339-F414 HydrophobicContact CB-CE2 4.17Å; L339-F414 HydrophobicContact CB-CG 3.85Å; L339-F414 HydrophobicContact CB-CZ 4.02Å; L339-F414 HydrophobicContact CD1-CD1 3.9Å; L339-F414 HydrophobicContact CD1-CE1 4.39Å; L339-F414 HydrophobicContact CD1-CG 4.48Å; L339-F414 HydrophobicContact CG-CD1 4.35Å; L339-F414 HydrophobicContact CG-CE1 4.48Å; L339-F414 WeakPolarHBondContact O-CE2 3.44Å; L339-F414 WeakPolarHBondContact O-CZ 3.21Å
340W98.1Very high94.4Very high0 Ų039.2 Ų39.20%019%0.193CC..Hα-helixtrans-61.5-41173.8-75.5101.8000112.5A336 A337 V338 G343 F344 F387 M390 I394 H413 F414 M417A336-W340 PolarHBondContact O-N 3.35Å; A337-W340 PolarHBondContact O-N 2.66Å; V338-W340 PolarHBondContact O-N 2.71Å; W340-G343 PolarHBondContact O-N 3.02Å; W340-F344 WeakPolarHBondContact O-CB 3.26Å; W340-F344 PolarHBondContact O-N 2.8Å; W340-F387 HydrophobicContact CE3-CB 4.08Å; W340-F387 AromaticContact CE3-CD1 3.47Å; W340-F387 HydrophobicContact CE3-CD1 3.47Å; W340-F387 VanDerWaalsContact CE3-CD1 3.47Å; W340-F387 HydrophobicContact CE3-CD2 4.36Å; W340-F387 AromaticContact CE3-CE1 3.85Å; W340-F387 HydrophobicContact CE3-CE1 3.85Å; W340-F387 AromaticContact CE3-CG 3.74Å; W340-F387 HydrophobicContact CE3-CG 3.74Å; W340-F387 HydrophobicContact CE3-CZ 4.45Å; W340-F387 HydrophobicContact CZ3-CB 4.42Å; W340-F387 AromaticContact CZ3-CD1 3.71Å; W340-F387 HydrophobicContact CZ3-CD1 3.71Å; W340-F387 AromaticContact CZ3-CD2 3.92Å; W340-F387 HydrophobicContact CZ3-CD2 3.92Å; W340-F387 AromaticContact CZ3-CE1 3.75Å; W340-F387 HydrophobicContact CZ3-CE1 3.75Å; W340-F387 AromaticContact CZ3-CE2 3.98Å; W340-F387 HydrophobicContact CZ3-CE2 3.98Å; W340-F387 AromaticContact CZ3-CG 3.78Å; W340-F387 HydrophobicContact CZ3-CG 3.78Å; W340-F387 AromaticContact CZ3-CZ 3.9Å; W340-F387 HydrophobicContact CZ3-CZ 3.9Å; W340-M390 HydrophobicContact CD2-CB 3.67Å; W340-M390 HydrophobicContact CE3-CB 3.57Å; W340-M390 HydrophobicContact CE3-CG 4.33Å; W340-M390 HydrophobicContact CG-CB 4.41Å; W340-M390 HydrophobicContact CH2-CB 3.81Å; W340-M390 HydrophobicContact CH2-CG 3.86Å; W340-M390 HydrophobicContact CZ2-CB 3.94Å; W340-M390 HydrophobicContact CZ2-CG 4.31Å; W340-M390 HydrophobicContact CZ3-CB 3.63Å; W340-M390 HydrophobicContact CZ3-CG 3.88Å; W340-I394 HydrophobicContact CG-CD1 4.41Å; W340-H413 AromaticContact CH2-CE1 3.92Å; W340-H413 AromaticContact CZ2-CE1 3.47Å; W340-H413 VanDerWaalsContact CZ2-CE1 3.47Å; W340-H413 WeakPolarHBondContact CZ2-CE1 3.35Å; W340-H413 AromaticContact CZ2-ND1 3.46Å; W340-H413 WeakPolarHBondContact CZ2-ND1 3.35Å; W340-F414 AromaticContact CD2-CD2 3.7Å; W340-F414 HydrophobicContact CD2-CD2 3.7Å; W340-F414 AromaticContact CE2-CD2 3.82Å; W340-F414 HydrophobicContact CE3-CD2 4.06Å; W340-F414 AromaticContact CG-CD2 3.97Å; W340-F414 HydrophobicContact CG-CD2 3.97Å; W340-F414 HydrophobicContact CZ2-CB 4.05Å; W340-F414 HydrophobicContact CZ2-CD2 4.28Å; W340-M417 HydrophobicContact CH2-CB 3.72Å; W340-M417 HydrophobicContact CH2-CG 3.74Å; W340-M417 HydrophobicContact CZ2-CB 4.44Å; W340-M417 HydrophobicContact CZ3-CG 4.21Å
341A97.5Very high94.8Very high1 Ų138 Ų381%0.00818%0.184CC..Hα-helixtrans-65.9-41.6176.900000112.9I254 I257 V258 A337 V338 L339 F344 I345I254-A341 HydrophobicContact CD1-CB 4.08Å; I254-A341 HydrophobicContact CG2-CB 4.43Å; I257-A341 HydrophobicContact CG2-CB 3.91Å; V258-A341 HydrophobicContact CG2-CB 4.16Å; A337-A341 PolarHBondContact O-N 3.45Å; V338-A341 PolarHBondContact O-N 3.39Å; L339-A341 VanDerWaalsContact C-N 3.34Å; L339-A341 PolarHBondContact O-N 3.41Å; A341-F344 WeakPolarHBondContact O-CB 3.39Å; A341-F344 PolarHBondContact O-N 2.62Å; A341-I345 VanDerWaalsContact O-CG1 3.24Å; A341-I345 WeakPolarHBondContact O-CG1 3.34Å; A341-I345 PolarHBondContact O-N 2.93Å
342L97.4Very high95.2Very high50 Ų5031.4 Ų31.426%0.26216%0.155SC..Hα-helixtrans-68.1-41.2175.1-70173000112L327 W334 V338 L339 F344 I345 F346L327-L342 HydrophobicContact CD1-CD2 3.67Å; W334-L342 HydrophobicContact CE3-CD1 4.44Å; W334-L342 HydrophobicContact CH2-CD1 4.2Å; W334-L342 HydrophobicContact CZ3-CD1 3.5Å; V338-L342 HydrophobicContact CG1-CD1 3.92Å; V338-L342 HydrophobicContact CG1-CG 4.28Å; V338-L342 WeakPolarHBondContact O-CG 3.31Å; V338-L342 PolarHBondContact O-N 3.27Å; L339-L342 PolarHBondContact O-N 3.17Å; L342-F344 VanDerWaalsContact C-N 3.32Å; L342-F344 PolarHBondContact O-N 3.24Å; L342-I345 PolarHBondContact O-N 3.45Å; L342-F346 WeakPolarHBondContact O-CB 3.17Å; L342-F346 PolarHBondContact O-N 3.45Å
343G97.6Very high95.8Very high3 Ų334.7 Ų34.73%0.03117%0.173CC..Hα-helixtrans-58.8-44.6173.500000111.5L339 W340 L347L339-G343 PolarHBondContact O-N 3.07Å; W340-G343 PolarHBondContact O-N 3.02Å; G343-L347 WeakPolarHBondContact O-CB 3.45Å; G343-L347 WeakPolarHBondContact O-CG 3.3Å; G343-L347 PolarHBondContact O-N 3.3Å
344F98Very high96.5Very high0 Ų030 Ų300%015%0.154CC..Hα-helixtrans-56.3-55.2171.9172.6-86.7000111.4I247 F251 I254 W323 W340 A341 L342 F346 L347 F348 G384 F387 A388I247-F344 HydrophobicContact CD1-CE2 3.88Å; I247-F344 HydrophobicContact CD1-CZ 4.28Å; F251-F344 HydrophobicContact CD1-CE1 4.24Å; F251-F344 AromaticContact CD1-CZ 3.7Å; F251-F344 HydrophobicContact CD1-CZ 3.7Å; F251-F344 HydrophobicContact CE1-CE1 4.48Å; F251-F344 AromaticContact CE1-CZ 3.81Å; F251-F344 HydrophobicContact CE1-CZ 3.81Å; I254-F344 HydrophobicContact CB-CD1 4.24Å; I254-F344 HydrophobicContact CB-CE1 4.37Å; I254-F344 HydrophobicContact CD1-CB 3.97Å; I254-F344 HydrophobicContact CD1-CD1 4.22Å; I254-F344 HydrophobicContact CD1-CD2 4.45Å; I254-F344 HydrophobicContact CD1-CG 3.96Å; I254-F344 HydrophobicContact CG1-CB 4.26Å; I254-F344 HydrophobicContact CG1-CD1 3.57Å; I254-F344 HydrophobicContact CG1-CD2 4.09Å; I254-F344 HydrophobicContact CG1-CE1 3.88Å; I254-F344 HydrophobicContact CG1-CE2 4.34Å; I254-F344 HydrophobicContact CG1-CG 3.7Å; I254-F344 HydrophobicContact CG1-CZ 4.27Å; I254-F344 HydrophobicContact CG2-CD1 3.96Å; I254-F344 HydrophobicContact CG2-CE1 4.32Å; W323-F344 AromaticContact CH2-CE1 3.67Å; W323-F344 HydrophobicContact CH2-CE1 3.67Å; W323-F344 HydrophobicContact CH2-CZ 4.37Å; W323-F344 HydrophobicContact CZ2-CE1 4.47Å; W323-F344 HydrophobicContact CZ3-CD1 4.49Å; W323-F344 AromaticContact CZ3-CE1 3.75Å; W323-F344 HydrophobicContact CZ3-CE1 3.75Å; W340-F344 WeakPolarHBondContact O-CB 3.26Å; W340-F344 PolarHBondContact O-N 2.8Å; A341-F344 WeakPolarHBondContact O-CB 3.39Å; A341-F344 PolarHBondContact O-N 2.62Å; L342-F344 VanDerWaalsContact C-N 3.32Å; L342-F344 PolarHBondContact O-N 3.24Å; F344-F346 VanDerWaalsContact C-N 3.27Å; F344-F346 PolarHBondContact O-N 3.48Å; F344-L347 PolarHBondContact O-N 3.26Å; F344-F348 HydrophobicContact CE1-CB 4.28Å; F344-F348 HydrophobicContact CE1-CG 4.34Å; F344-F348 HydrophobicContact CZ-CB 4.28Å; F344-F348 HydrophobicContact CZ-CD2 4.25Å; F344-F348 HydrophobicContact CZ-CG 4.12Å; F344-F348 WeakPolarHBondContact O-CB 3.34Å; F344-F348 PolarHBondContact O-N 3.3Å; F344-G384 WeakPolarHBondContact CD2-O 3.48Å; F344-G384 WeakPolarHBondContact CE2-O 3.35Å; F344-F387 HydrophobicContact CB-CB 4.15Å; F344-F387 HydrophobicContact CD2-CB 4.4Å; F344-A388 HydrophobicContact CD2-CB 4.07Å; F344-A388 HydrophobicContact CE2-CB 4.11Å
345I97.9Very high96.8Very high8 Ų823.6 Ų23.64%0.04113%0.134CC..Hα-helixtrans-57.3-44.9-175.5-68.8164.9000110.5I254 V258 V320 W323 L324 L327 A341 L342 T349I254-I345 HydrophobicContact CG2-CG1 4.33Å; V258-I345 HydrophobicContact CG2-CD1 4.28Å; V320-I345 HydrophobicContact CG1-CG2 4.25Å; W323-I345 HydrophobicContact CB-CD1 3.73Å; W323-I345 HydrophobicContact CB-CG1 4.38Å; W323-I345 HydrophobicContact CD2-CG1 4.35Å; W323-I345 HydrophobicContact CE3-CD1 4.44Å; W323-I345 HydrophobicContact CE3-CG1 3.84Å; W323-I345 HydrophobicContact CG-CD1 4.28Å; L324-I345 HydrophobicContact CD2-CG2 4.26Å; L327-I345 HydrophobicContact CD1-CD1 4.18Å; A341-I345 VanDerWaalsContact O-CG1 3.24Å; A341-I345 WeakPolarHBondContact O-CG1 3.34Å; A341-I345 PolarHBondContact O-N 2.93Å; L342-I345 PolarHBondContact O-N 3.45Å; I345-T349 WeakPolarHBondContact O-CB 3.17Å; I345-T349 PolarHBondContact O-N 2.86Å; I345-T349 VanDerWaalsContact O-N 3.17Å; I345-T349 PolarHBondContact O-OG1 3.07Å
346F97.4Very high96.9Very high116 Ų11626.2 Ų26.251%0.50915%0.147SC..Hα-helixtrans-64.3-58179.1176.2-107.3000112.2L342 F344 F348 T349 V350 F418L342-F346 WeakPolarHBondContact O-CB 3.17Å; L342-F346 PolarHBondContact O-N 3.45Å; F344-F346 VanDerWaalsContact C-N 3.27Å; F344-F346 PolarHBondContact O-N 3.48Å; F346-F348 PolarHBondContact O-N 2.91Å; F346-T349 PolarHBondContact O-N 3.47Å; F346-T349 VanDerWaalsContact O-N 3.15Å; F346-V350 HydrophobicContact CE1-CG2 4.34Å; F346-V350 HydrophobicContact CE2-CG2 4.2Å; F346-V350 HydrophobicContact CZ-CG2 4.05Å; F346-V350 PolarHBondContact O-N 3.01Å; F346-F418 HydrophobicContact CD1-CE2 4.29Å; F346-F418 AromaticContact CD1-CZ 4Å; F346-F418 HydrophobicContact CD1-CZ 4Å; F346-F418 HydrophobicContact CE1-CZ 4.21Å
347L97Very high96.9Very high0 Ų028.5 Ų28.50%016%0.161CC..Hα-helixtrans-68.2-37.7-173.5-60.9169.7000111.7G343 F344 T349 V350 G351 Y379 M383 F387 F418 V421 N422G343-L347 WeakPolarHBondContact O-CB 3.45Å; G343-L347 WeakPolarHBondContact O-CG 3.3Å; G343-L347 PolarHBondContact O-N 3.3Å; F344-L347 PolarHBondContact O-N 3.26Å; L347-T349 VanDerWaalsContact C-N 3.28Å; L347-T349 PolarHBondContact O-N 2.79Å; L347-V350 PolarHBondContact O-N 3Å; L347-G351 PolarHBondContact O-N 3.21Å; L347-Y379 HydrophobicContact CB-CD1 4.26Å; L347-Y379 HydrophobicContact CD2-CD1 4.35Å; L347-Y379 HydrophobicContact CD2-CE1 3.75Å; L347-M383 HydrophobicContact CB-CB 3.7Å; L347-M383 HydrophobicContact CB-CG 4.36Å; L347-M383 HydrophobicContact CB-SD 4.01Å; L347-M383 HydrophobicContact CD1-CB 3.85Å; L347-M383 HydrophobicContact CD1-CG 3.86Å; L347-M383 HydrophobicContact CD1-SD 3.72Å; L347-M383 HydrophobicContact CD2-SD 3.84Å; L347-M383 HydrophobicContact CG-CB 4.36Å; L347-M383 HydrophobicContact CG-SD 4.04Å; L347-F387 HydrophobicContact CD1-CD1 4.22Å; L347-F387 HydrophobicContact CD1-CE1 3.68Å; L347-F387 HydrophobicContact CD1-CE2 4.23Å; L347-F387 HydrophobicContact CD1-CZ 3.68Å; L347-F418 HydrophobicContact CD1-CD2 3.87Å; L347-F418 HydrophobicContact CD1-CE2 3.69Å; L347-F418 HydrophobicContact CD2-CE2 4.03Å; L347-F418 HydrophobicContact CD2-CZ 4.3Å; L347-F418 HydrophobicContact CG-CE2 3.9Å; L347-V421 HydrophobicContact CD1-CG2 4.49Å; L347-N422 WeakPolarHBondContact CD2-ND2 3.45Å; L347-N422 VanDerWaalsContact CD2-OD1 3.23Å; L347-N422 WeakPolarHBondContact CD2-OD1 3.28Å
348F96.6Very high97Very high12 Ų1229.3 Ų29.35%0.05317%0.165CC..Hα-helixtrans-63-36.2174.3-179.1-98000111.7I247 F251 T316 V320 F344 F346 G352 V380I247-F348 HydrophobicContact CD1-CD2 4.42Å; I247-F348 HydrophobicContact CD1-CE2 4.41Å; I247-F348 HydrophobicContact CG1-CD2 4.36Å; I247-F348 HydrophobicContact CG1-CE2 3.87Å; F251-F348 HydrophobicContact CE1-CD1 4.45Å; F251-F348 HydrophobicContact CE1-CD2 4.36Å; F251-F348 AromaticContact CE1-CE1 3.87Å; F251-F348 HydrophobicContact CE1-CE1 3.87Å; F251-F348 AromaticContact CE1-CE2 3.76Å; F251-F348 HydrophobicContact CE1-CE2 3.76Å; F251-F348 AromaticContact CE1-CZ 3.5Å; F251-F348 HydrophobicContact CE1-CZ 3.5Å; F251-F348 HydrophobicContact CZ-CE1 4.1Å; F251-F348 AromaticContact CZ-CE2 3.88Å; F251-F348 HydrophobicContact CZ-CE2 3.88Å; F251-F348 AromaticContact CZ-CZ 3.44Å; F251-F348 HydrophobicContact CZ-CZ 3.44Å; F251-F348 VanDerWaalsContact CZ-CZ 3.44Å; T316-F348 HydrophobicContact CG2-CE1 3.51Å; T316-F348 HydrophobicContact CG2-CZ 3.89Å; V320-F348 HydrophobicContact CG2-CD1 4.5Å; F344-F348 HydrophobicContact CE1-CB 4.28Å; F344-F348 HydrophobicContact CE1-CG 4.34Å; F344-F348 HydrophobicContact CZ-CB 4.28Å; F344-F348 HydrophobicContact CZ-CD2 4.25Å; F344-F348 HydrophobicContact CZ-CG 4.12Å; F344-F348 WeakPolarHBondContact O-CB 3.34Å; F344-F348 PolarHBondContact O-N 3.3Å; F346-F348 PolarHBondContact O-N 2.91Å; F348-G352 PolarHBondContact O-N 3.39Å; F348-V380 HydrophobicContact CD2-CG1 4.36Å; F348-V380 HydrophobicContact CE2-CG1 3.92Å
349T96.8Very high97.1Very high50 Ų5029.3 Ų29.331%0.30717%0.165SC..Hα-helixtrans-69.2-43174.8-62.90000111.5I345 F346 L347 G351 G352 L353I345-T349 WeakPolarHBondContact O-CB 3.17Å; I345-T349 PolarHBondContact O-N 2.86Å; I345-T349 VanDerWaalsContact O-N 3.17Å; I345-T349 PolarHBondContact O-OG1 3.07Å; F346-T349 PolarHBondContact O-N 3.47Å; F346-T349 VanDerWaalsContact O-N 3.15Å; L347-T349 VanDerWaalsContact C-N 3.28Å; L347-T349 PolarHBondContact O-N 2.79Å; T349-G351 PolarHBondContact O-N 3.15Å; T349-G352 PolarHBondContact O-N 2.95Å; T349-L353 HydrophobicContact CG2-CD1 4.49Å; T349-L353 WeakPolarHBondContact O-CG 3.46Å; T349-L353 PolarHBondContact O-N 2.92Å
350V96.4Very high97.1Very high34 Ų3429.8 Ų29.821%0.20617%0.168CC..Hα-helixtrans-58.4-47.4174.1173.80000110.9F346 L347 G352 L353 T354 Y379F346-V350 HydrophobicContact CE1-CG2 4.34Å; F346-V350 HydrophobicContact CE2-CG2 4.2Å; F346-V350 HydrophobicContact CZ-CG2 4.05Å; F346-V350 PolarHBondContact O-N 3.01Å; L347-V350 PolarHBondContact O-N 3Å; V350-G352 PolarHBondContact O-N 3.45Å; V350-L353 PolarHBondContact O-N 3.41Å; V350-T354 PolarHBondContact O-N 3.05Å; V350-Y379 HydrophobicContact CB-CD1 4.19Å; V350-Y379 HydrophobicContact CB-CE1 4.31Å; V350-Y379 HydrophobicContact CG1-CD1 4.01Å; V350-Y379 HydrophobicContact CG1-CE1 3.92Å
351G96Very high97Very high0 Ų030.4 Ų30.40%017%0.172CC..Hα-helixtrans-61.4-41.2174.400000113.1L347 T349 L353 T354 G355 H376L347-G351 PolarHBondContact O-N 3.21Å; T349-G351 PolarHBondContact O-N 3.15Å; G351-L353 VanDerWaalsContact C-N 3.33Å; G351-L353 PolarHBondContact O-N 3.07Å; G351-T354 PolarHBondContact O-N 2.94Å; G351-T354 PolarHBondContact O-OG1 3.37Å; G351-G355 PolarHBondContact O-N 3.34Å; G351-H376 PolarHBondContact O-CE1 3.39Å; G351-H376 PolarHBondContact O-ND1 2.9Å
352G95.5Very high96.9Very high25 Ų2534.3 Ų34.326%0.25820%0.199SC..Hα-helixtrans-60.4-40.817600000112.7F348 T349 V350 G355 I356F348-G352 PolarHBondContact O-N 3.39Å; T349-G352 PolarHBondContact O-N 2.95Å; V350-G352 PolarHBondContact O-N 3.45Å; G352-G355 WeakPolarHBondContact O-CA 3.21Å; G352-G355 PolarHBondContact O-N 3.48Å; G352-G355 VanDerWaalsContact O-N 3.17Å; G352-I356 WeakPolarHBondContact O-CG1 3.32Å; G352-I356 PolarHBondContact O-N 3.35Å
353L96.2Very high96.9Very high108 Ų10836 Ų3657%0.56521%0.208SC*.Hα-helixtrans-64.6-41.9177.3-68.8173.9000112.2T349 V350 G351 G355 I356 V357T349-L353 HydrophobicContact CG2-CD1 4.49Å; T349-L353 WeakPolarHBondContact O-CG 3.46Å; T349-L353 PolarHBondContact O-N 2.92Å; V350-L353 PolarHBondContact O-N 3.41Å; G351-L353 VanDerWaalsContact C-N 3.33Å; G351-L353 PolarHBondContact O-N 3.07Å; L353-G355 PolarHBondContact O-N 2.97Å; L353-I356 HydrophobicContact CD2-CD1 4.41Å; L353-I356 PolarHBondContact O-N 2.97Å; L353-V357 PolarHBondContact O-N 3.15Å
354T97.3Very high96.8Very high18 Ų1836.1 Ų36.111%0.1121%0.208CC..Hα-helixtrans-69-26.3174.762.60000112.1V350 G351 V357 L358 H376V350-T354 PolarHBondContact O-N 3.05Å; G351-T354 PolarHBondContact O-N 2.94Å; G351-T354 PolarHBondContact O-OG1 3.37Å; T354-V357 WeakPolarHBondContact O-CB 3.31Å; T354-V357 PolarHBondContact O-N 2.86Å; T354-L358 PolarHBondContact O-N 3.12Å; T354-H376 PolarHBondContact OG1-ND1 3.02Å; T354-H376 VanDerWaalsContact OG1-ND1 3.14Å
355G96.3Very high96.6Very high15 Ų1540.6 Ų40.616%0.15523%0.231CC..Hα-helixtrans-67.7-35.8171.700000113.5G351 G352 L353 V357 L358 A359 H376G351-G355 PolarHBondContact O-N 3.34Å; G352-G355 WeakPolarHBondContact O-CA 3.21Å; G352-G355 PolarHBondContact O-N 3.48Å; G352-G355 VanDerWaalsContact O-N 3.17Å; L353-G355 PolarHBondContact O-N 2.97Å; G355-V357 PolarHBondContact O-N 2.87Å; G355-L358 CarbonylContact O-C 3.53Å; G355-L358 PolarHBondContact O-N 3.31Å; G355-A359 WeakPolarHBondContact O-CB 3.46Å; G355-A359 PolarHBondContact O-N 3.18Å; G355-H376 WeakPolarHBondContact CA-CE1 3.4Å; G355-H376 VanDerWaalsContact CA-ND1 3.34Å; G355-H376 WeakPolarHBondContact CA-ND1 3.36Å; G355-H376 PolarHBondContact N-CE1 3.08Å; G355-H376 PolarHBondContact N-ND1 3.02Å
356I96.4Very high96.6Very high68 Ų6845.4 Ų45.435%0.34926%0.261SS..Hα-helixtrans-64.2-34.6174.3-65.1168.4000110.7A313 G352 L353 A359A313-I356 HydrophobicContact CB-CD1 3.81Å; A313-I356 HydrophobicContact CB-CG1 4.1Å; G352-I356 WeakPolarHBondContact O-CG1 3.32Å; G352-I356 PolarHBondContact O-N 3.35Å; L353-I356 HydrophobicContact CD2-CD1 4.41Å; L353-I356 PolarHBondContact O-N 2.97Å; I356-A359 PolarHBondContact O-N 3.36Å
357V97.6Very high96.6Very high49 Ų4940.7 Ų40.730%0.29724%0.241SC..Hα-helixtrans-63.5-48173.4-179.90000110.4L353 T354 G355 A359 N360 L363 L367 Y372L353-V357 PolarHBondContact O-N 3.15Å; T354-V357 WeakPolarHBondContact O-CB 3.31Å; T354-V357 PolarHBondContact O-N 2.86Å; G355-V357 PolarHBondContact O-N 2.87Å; V357-A359 VanDerWaalsContact C-N 3.29Å; V357-A359 PolarHBondContact O-N 3.34Å; V357-N360 WeakPolarHBondContact O-CB 3.38Å; V357-N360 PolarHBondContact O-N 3.11Å; V357-L363 HydrophobicContact CG1-CD1 3.88Å; V357-L367 HydrophobicContact CG1-CD1 3.83Å; V357-Y372 HydrophobicContact CB-CE1 4.4Å; V357-Y372 HydrophobicContact CG1-CE1 4.37Å
358L97.5Very high96.6Very high17 Ų1742.4 Ų42.49%0.08925%0.249CC..Hα-helixtrans-68.7-24.5178.1-69.5173.3000113.8T354 G355 N360 L367 Y372 V373 H376T354-L358 PolarHBondContact O-N 3.12Å; G355-L358 CarbonylContact O-C 3.53Å; G355-L358 PolarHBondContact O-N 3.31Å; L358-N360 PolarHBondContact O-N 3.12Å; L358-L367 HydrophobicContact CD2-CB 3.82Å; L358-L367 HydrophobicContact CD2-CD1 4.16Å; L358-Y372 HydrophobicContact CD1-CD1 4.01Å; L358-Y372 HydrophobicContact CD1-CE1 4.22Å; L358-Y372 HydrophobicContact CD2-CD1 3.71Å; L358-Y372 HydrophobicContact CD2-CE1 4.1Å; L358-Y372 HydrophobicContact CG-CD1 3.85Å; L358-Y372 HydrophobicContact CG-CE1 3.85Å; L358-V373 HydrophobicContact CD1-CB 4.38Å; L358-V373 HydrophobicContact CD1-CG2 3.99Å; L358-V373 HydrophobicContact CD2-CG2 3.74Å; L358-H376 HydrophobicContact CD1-CB 3.62Å
359A97.1Very high96.6Very high4 Ų445.1 Ų45.13%0.03326%0.264CS..THydrogen-bonded Turntrans-65.3-18.4174.100000112.4T306 T309 M310 G355 I356 V357 S361T306-A359 WeakPolarHBondContact CA-O 2.99Å; T306-A359 WeakPolarHBondContact CG2-O 3.4Å; T309-A359 HydrophobicContact CG2-CB 3.59Å; M310-A359 HydrophobicContact CE-CB 4.41Å; M310-A359 HydrophobicContact CG-CB 3.87Å; G355-A359 WeakPolarHBondContact O-CB 3.46Å; G355-A359 PolarHBondContact O-N 3.18Å; I356-A359 PolarHBondContact O-N 3.36Å; V357-A359 VanDerWaalsContact C-N 3.29Å; V357-A359 PolarHBondContact O-N 3.34Å; A359-S361 PolarHBondContact O-N 3.01Å
360N97.6Very high96.7Very high48 Ų4843.2 Ų43.226%0.25725%0.252SS..  trans-83.3110.4177.3-172.1-56.4000111M310 V357 L358 S362 L363 D364M310-N360 HydrophobicContact CE-CB 3.71Å; V357-N360 WeakPolarHBondContact O-CB 3.38Å; V357-N360 PolarHBondContact O-N 3.11Å; L358-N360 PolarHBondContact O-N 3.12Å; N360-S362 PolarHBondContact O-N 2.95Å; N360-S362 VanDerWaalsContact O-N 3.12Å; N360-S362 WeakPolarHBondContact OD1-CA 3.37Å; N360-S362 VanDerWaalsContact OD1-CB 3.32Å; N360-S362 WeakPolarHBondContact OD1-CB 3.39Å; N360-S362 PolarHBondContact OD1-N 3.47Å; N360-L363 HydrophobicContact CB-CB 4.2Å; N360-L363 HydrophobicContact CB-CD1 4.1Å; N360-L363 HydrophobicContact CB-CG 4.17Å; N360-L363 PolarHBondContact O-N 3.22Å; N360-L363 VanDerWaalsContact O-N 3.07Å; N360-L363 PolarHBondContact OD1-N 3.3Å; N360-D364 WeakPolarHBondContact O-CB 3.49Å; N360-D364 PolarHBondContact O-N 3.2Å
361S96.4Very high96.7Very high13 Ų1342 Ų429%0.09124%0.244CC..Hα-helixtrans-56.9-28.3-179.656.50000115.4T306 A359 I365T306-S361 VanDerWaalsContact OG1-CB 3.31Å; T306-S361 WeakPolarHBondContact OG1-CB 3.44Å; T306-S361 PolarHBondContact OG1-N 2.9Å; T306-S361 PolarHBondContact OG1-OG 3.14Å; A359-S361 PolarHBondContact O-N 3.01Å; S361-I365 WeakPolarHBondContact O-CG1 3.48Å; S361-I365 PolarHBondContact O-N 3.48Å
362S95.7Very high96.9Very high82 Ų8242.9 Ų42.957%0.57325%0.247SC*.Hα-helixtrans-75.1-36.8177.2-58.30000112.4N360N360-S362 PolarHBondContact O-N 2.95Å; N360-S362 VanDerWaalsContact O-N 3.12Å; N360-S362 WeakPolarHBondContact OD1-CA 3.37Å; N360-S362 VanDerWaalsContact OD1-CB 3.32Å; N360-S362 WeakPolarHBondContact OD1-CB 3.39Å; N360-S362 PolarHBondContact OD1-N 3.47Å
363L96.8Very high97Very high85 Ų8543 Ų4345%0.44524%0.243SC..Hα-helixtrans-77.5-36.9176.2-63.5178.9000111.2V357 N360 I365 V366 L367V357-L363 HydrophobicContact CG1-CD1 3.88Å; N360-L363 HydrophobicContact CB-CB 4.2Å; N360-L363 HydrophobicContact CB-CD1 4.1Å; N360-L363 HydrophobicContact CB-CG 4.17Å; N360-L363 PolarHBondContact O-N 3.22Å; N360-L363 VanDerWaalsContact O-N 3.07Å; N360-L363 PolarHBondContact OD1-N 3.3Å; L363-I365 PolarHBondContact O-N 3.48Å; L363-V366 PolarHBondContact O-N 2.95Å; L363-V366 VanDerWaalsContact O-N 3.09Å; L363-L367 PolarHBondContact O-N 2.81Å
364D96.4Very high97Very high7 Ų739.3 Ų39.34%0.03723%0.225CC..Hα-helixtrans-59-34.5179.3-167.564.4000111.2F293 N360 V366 L367 H368F293-D364 HydrophobicContact CB-CB 4.45Å; F293-D364 HydrophobicContact CD2-CB 3.76Å; N360-D364 WeakPolarHBondContact O-CB 3.49Å; N360-D364 PolarHBondContact O-N 3.2Å; D364-V366 PolarHBondContact O-N 3.34Å; D364-L367 CarbonylContact O-C 3.59Å; D364-L367 PolarHBondContact O-N 2.94Å; D364-H368 WeakPolarHBondContact O-CA 3.27Å; D364-H368 WeakPolarHBondContact O-CB 3.37Å; D364-H368 PolarHBondContact O-N 3.11Å; D364-H368 IonicContact OD1-ND1 3.63Å; D364-H368 IonicContact OD2-CE1 2.99Å; D364-H368 IonicContact OD2-CG 3.84Å; D364-H368 IonicContact OD2-ND1 2.61Å; D364-H368 PolarHBondContact OD2-ND1 3.35Å
365I94.5Very high97.1Very high93 Ų9338.5 Ų38.548%0.47722%0.22SC..Hα-helixtrans-49.2-36.5175.5-68.8162.9000113.2S361 L363S361-I365 WeakPolarHBondContact O-CG1 3.48Å; S361-I365 PolarHBondContact O-N 3.48Å; L363-I365 PolarHBondContact O-N 3.48Å
366V96.5Very high97.1Very high110 Ų11039.4 Ų39.467%0.66722%0.22SC*.Hα-helixtrans-92.8-23.8-178.1-159.80000112.2L363 D364L363-V366 PolarHBondContact O-N 2.95Å; L363-V366 VanDerWaalsContact O-N 3.09Å; D364-V366 PolarHBondContact O-N 3.34Å
367L97.7Very high97.1Very high16 Ų1638.7 Ų38.78%0.08421%0.214CC..Hα-helixtrans-100.6-15.6-175.7-60.8177.2000113.3V357 L358 L363 D364 T370 Y372 V373 L433V357-L367 HydrophobicContact CG1-CD1 3.83Å; L358-L367 HydrophobicContact CD2-CB 3.82Å; L358-L367 HydrophobicContact CD2-CD1 4.16Å; L363-L367 PolarHBondContact O-N 2.81Å; D364-L367 CarbonylContact O-C 3.59Å; D364-L367 PolarHBondContact O-N 2.94Å; L367-T370 WeakPolarHBondContact O-CB 3.31Å; L367-T370 WeakPolarHBondContact O-CG2 3.38Å; L367-T370 PolarHBondContact O-N 3.1Å; L367-T370 VanDerWaalsContact O-N 3.13Å; L367-T370 PolarHBondContact O-OG1 2.83Å; L367-Y372 HydrophobicContact CD1-CD1 4.03Å; L367-Y372 HydrophobicContact CD1-CE1 4.13Å; L367-Y372 HydrophobicContact CD1-CG 4.27Å; L367-Y372 HydrophobicContact CD2-CD2 4.3Å; L367-Y372 HydrophobicContact CD2-CG 4.13Å; L367-V373 WeakPolarHBondContact O-CG2 3.45Å; L367-L433 HydrophobicContact CD2-CD2 4.04Å
368H97.7Very high97Very high36 Ų3638.4 Ų38.417%0.16721%0.21CC..THydrogen-bonded Turntrans-58.5139.1-178.9-159.388.4000109.9H291 T294 D364 T370H291-H368 PolarHBondContact O-CE1 2.81Å; T294-H368 HydrophobicContact CG2-CB 3.5Å; T294-H368 VanDerWaalsContact CG2-CG 3.45Å; T294-H368 PolarHBondContact OG1-CD2 3.36Å; T294-H368 VanDerWaalsContact OG1-CD2 3.3Å; T294-H368 PolarHBondContact OG1-NE2 2.95Å; D364-H368 WeakPolarHBondContact O-CA 3.27Å; D364-H368 WeakPolarHBondContact O-CB 3.37Å; D364-H368 PolarHBondContact O-N 3.11Å; D364-H368 IonicContact OD1-ND1 3.63Å; D364-H368 IonicContact OD2-CE1 2.99Å; D364-H368 IonicContact OD2-CG 3.84Å; D364-H368 IonicContact OD2-ND1 2.61Å; D364-H368 PolarHBondContact OD2-ND1 3.35Å; H368-T370 PolarHBondContact O-N 2.97Å
369D96.3Very high96.9Very high70 Ų7037.6 Ų37.637%0.37421%0.206SC..THydrogen-bonded Turntrans55.116.9-177.1-70.6-36.5000115.7P437 R438D369-P437 CarbonylContact O-C 3.59Å; D369-P437 WeakPolarHBondContact O-CA 3.12Å; D369-R438 HydrophobicContact CB-CG 4.42Å; D369-R438 VanDerWaalsContact O-CG 3.27Å; D369-R438 WeakPolarHBondContact O-CG 3.49Å; D369-R438 PolarHBondContact O-N 3.27Å; D369-R438 IonicContact OD1-CZ 2.79Å; D369-R438 IonicContact OD1-NE 3.74Å; D369-R438 PolarHBondContact OD1-NE 2.61Å; D369-R438 IonicContact OD1-NH2 2.74Å; D369-R438 PolarHBondContact OD1-NH2 3.32Å
370T98.3Very high96.7Very high9 Ų938.9 Ų38.96%0.05521%0.213CC..BIsolated β-bridgetrans-95.4172.117275.20000112L367 H368 Y372 V373 M436L367-T370 WeakPolarHBondContact O-CB 3.31Å; L367-T370 WeakPolarHBondContact O-CG2 3.38Å; L367-T370 PolarHBondContact O-N 3.1Å; L367-T370 VanDerWaalsContact O-N 3.13Å; L367-T370 PolarHBondContact O-OG1 2.83Å; H368-T370 PolarHBondContact O-N 2.97Å; T370-Y372 PolarHBondContact O-N 3.5Å; T370-Y372 VanDerWaalsContact O-N 3.12Å; T370-Y372 WeakPolarHBondContact OG1-CB 3.38Å; T370-Y372 PolarHBondContact OG1-N 2.9Å; T370-Y372 VanDerWaalsContact OG1-N 3.11Å; T370-V373 PolarHBondContact O-N 2.86Å; T370-M436 CarbonylContact C-O 3.42Å; T370-M436 VanDerWaalsContact CA-O 3.26Å; T370-M436 WeakPolarHBondContact CA-O 3.32Å; T370-M436 WeakPolarHBondContact CB-O 3.36Å
371Y98.1Very high96Very high10 Ų1037.8 Ų37.84%0.03921%0.207CC..Hα-helixtrans-61.5-11.6169.7-88.3-103.1000114.1L41 V374 A375 Q428 L431 M436 P437L41-Y371 WeakPolarHBondContact CD1-OH 3.38Å; Y371-V374 PolarHBondContact O-N 3.2Å; Y371-A375 WeakPolarHBondContact O-CB 3.3Å; Y371-A375 PolarHBondContact O-N 3.31Å; Y371-Q428 CarbonylContact C-O 3.46Å; Y371-Q428 WeakPolarHBondContact CB-O 3.49Å; Y371-Q428 HydrophobicContact CD1-CB 4.12Å; Y371-Q428 HydrophobicContact CD1-CG 3.92Å; Y371-L431 HydrophobicContact CD1-CD1 4.31Å; Y371-L431 HydrophobicContact CG-CB 4.27Å; Y371-M436 HydrophobicContact CD2-CB 4.11Å; Y371-M436 HydrophobicContact CD2-CE 4.2Å; Y371-M436 HydrophobicContact CD2-CG 3.68Å; Y371-M436 HydrophobicContact CD2-SD 3.83Å; Y371-M436 HydrophobicContact CE2-CE 3.54Å; Y371-M436 HydrophobicContact CE2-CG 3.89Å; Y371-M436 HydrophobicContact CE2-SD 3.8Å; Y371-M436 HydrophobicContact CG-SD 4.35Å; Y371-M436 PolarHBondContact N-O 3.11Å; Y371-P437 WeakPolarHBondContact CE2-O 3.13Å
372Y98.4Very high95Very high17 Ų1738.4 Ų38.47%0.06721%0.211CC..Hα-helixtrans-66-44.6175.3-167-85000110.6V357 L358 L367 T370 V374 A375 H376 H429 G432 L433V357-Y372 HydrophobicContact CB-CE1 4.4Å; V357-Y372 HydrophobicContact CG1-CE1 4.37Å; L358-Y372 HydrophobicContact CD1-CD1 4.01Å; L358-Y372 HydrophobicContact CD1-CE1 4.22Å; L358-Y372 HydrophobicContact CD2-CD1 3.71Å; L358-Y372 HydrophobicContact CD2-CE1 4.1Å; L358-Y372 HydrophobicContact CG-CD1 3.85Å; L358-Y372 HydrophobicContact CG-CE1 3.85Å; L367-Y372 HydrophobicContact CD1-CD1 4.03Å; L367-Y372 HydrophobicContact CD1-CE1 4.13Å; L367-Y372 HydrophobicContact CD1-CG 4.27Å; L367-Y372 HydrophobicContact CD2-CD2 4.3Å; L367-Y372 HydrophobicContact CD2-CG 4.13Å; T370-Y372 PolarHBondContact O-N 3.5Å; T370-Y372 VanDerWaalsContact O-N 3.12Å; T370-Y372 WeakPolarHBondContact OG1-CB 3.38Å; T370-Y372 PolarHBondContact OG1-N 2.9Å; T370-Y372 VanDerWaalsContact OG1-N 3.11Å; Y372-V374 VanDerWaalsContact C-N 3.32Å; Y372-A375 PolarHBondContact O-N 3.29Å; Y372-H376 WeakPolarHBondContact O-CB 3.43Å; Y372-H376 PolarHBondContact O-N 2.84Å; Y372-H429 HydrophobicContact CD2-CB 4.31Å; Y372-H429 HydrophobicContact CE2-CB 4.41Å; Y372-H429 AromaticContact CE2-CD2 3.93Å; Y372-G432 VanDerWaalsContact N-CA 3.31Å; Y372-L433 HydrophobicContact CD2-CD2 4.06Å; Y372-L433 HydrophobicContact CD2-CG 3.91Å; Y372-L433 HydrophobicContact CE2-CD1 4.46Å; Y372-L433 HydrophobicContact CE2-CD2 4.02Å; Y372-L433 HydrophobicContact CE2-CG 4.09Å
373V97.8Very high94.3Very high29 Ų2934.5 Ų34.518%0.17618%0.184CC..Hα-helixtrans-65.6-39.1176.1-179.80000110.6L358 L367 T370 F377L358-V373 HydrophobicContact CD1-CB 4.38Å; L358-V373 HydrophobicContact CD1-CG2 3.99Å; L358-V373 HydrophobicContact CD2-CG2 3.74Å; L367-V373 WeakPolarHBondContact O-CG2 3.45Å; T370-V373 PolarHBondContact O-N 2.86Å; V373-F377 WeakPolarHBondContact O-CB 3.46Å; V373-F377 PolarHBondContact O-N 2.83Å
374V97.8Very high93.8Very high30 Ų3030.4 Ų30.418%0.18216%0.163CC..Hα-helixtrans-60.6-48.5175.5-177.70000110.1Y371 Y372 F377 H378 R438Y371-V374 PolarHBondContact O-N 3.2Å; Y372-V374 VanDerWaalsContact C-N 3.32Å; V374-F377 PolarHBondContact O-N 3.25Å; V374-H378 PolarHBondContact O-N 2.91Å; V374-H378 PolarHBondContact O-ND1 3.46Å; V374-R438 HydrophobicContact CG2-CB 3.86Å
375A98Very high93.6Very high0 Ų030.1 Ų30.10%016%0.161CC..Hα-helixtrans-61.9-50.7178.700000111.7Y371 Y372 F377 H378 Y379 Q428 H429Y371-A375 WeakPolarHBondContact O-CB 3.3Å; Y371-A375 PolarHBondContact O-N 3.31Å; Y372-A375 PolarHBondContact O-N 3.29Å; A375-F377 VanDerWaalsContact C-N 3.33Å; A375-F377 PolarHBondContact O-N 2.96Å; A375-H378 PolarHBondContact O-N 3.47Å; A375-Y379 WeakPolarHBondContact O-CD2 3.46Å; A375-Y379 PolarHBondContact O-N 2.74Å; A375-Q428 HydrophobicContact CB-CB 3.76Å; A375-H429 WeakPolarHBondContact CB-NE2 3.23Å
376H97.6Very high93.6Very high35 Ų3526.5 Ų26.516%0.16214%0.143CC..Hα-helixtrans-51.2-52.9175.7166.262.5000111.4G351 T354 G355 L358 Y372 H378 Y379 V380G351-H376 PolarHBondContact O-CE1 3.39Å; G351-H376 PolarHBondContact O-ND1 2.9Å; T354-H376 PolarHBondContact OG1-ND1 3.02Å; T354-H376 VanDerWaalsContact OG1-ND1 3.14Å; G355-H376 WeakPolarHBondContact CA-CE1 3.4Å; G355-H376 VanDerWaalsContact CA-ND1 3.34Å; G355-H376 WeakPolarHBondContact CA-ND1 3.36Å; G355-H376 PolarHBondContact N-CE1 3.08Å; G355-H376 PolarHBondContact N-ND1 3.02Å; L358-H376 HydrophobicContact CD1-CB 3.62Å; Y372-H376 WeakPolarHBondContact O-CB 3.43Å; Y372-H376 PolarHBondContact O-N 2.84Å; H376-H378 VanDerWaalsContact C-N 3.34Å; H376-H378 PolarHBondContact O-N 3.28Å; H376-Y379 PolarHBondContact O-N 3.17Å; H376-Y379 VanDerWaalsContact O-N 3.17Å; H376-V380 PolarHBondContact O-N 3.04Å
377F94.8Very high93.6Very high53 Ų5321.3 Ų21.323%0.23211%0.112CC..Hα-helixtrans-66.3-35.5-176.8-170-116.9000112.2V243 V373 V374 A375 V380 L381V243-F377 HydrophobicContact CB-CE2 4.11Å; V243-F377 HydrophobicContact CG1-CE2 3.43Å; V243-F377 VanDerWaalsContact CG1-CE2 3.43Å; V243-F377 HydrophobicContact CG1-CZ 3.82Å; V373-F377 WeakPolarHBondContact O-CB 3.46Å; V373-F377 PolarHBondContact O-N 2.83Å; V374-F377 PolarHBondContact O-N 3.25Å; A375-F377 VanDerWaalsContact C-N 3.33Å; A375-F377 PolarHBondContact O-N 2.96Å; F377-V380 PolarHBondContact O-N 3.39Å; F377-L381 HydrophobicContact CD1-CB 4.43Å; F377-L381 HydrophobicContact CD1-CD2 4.3Å; F377-L381 HydrophobicContact CD2-CB 4.5Å; F377-L381 HydrophobicContact CE1-CB 4.14Å; F377-L381 HydrophobicContact CE1-CD2 3.43Å; F377-L381 VanDerWaalsContact CE1-CD2 3.43Å; F377-L381 HydrophobicContact CE1-CG 4.36Å; F377-L381 HydrophobicContact CE2-CB 4.18Å; F377-L381 HydrophobicContact CZ-CB 4.02Å; F377-L381 HydrophobicContact CZ-CD2 3.57Å; F377-L381 HydrophobicContact CZ-CG 4.24Å; F377-L381 WeakPolarHBondContact O-CA 3.33Å; F377-L381 WeakPolarHBondContact O-CB 3.49Å; F377-L381 PolarHBondContact O-N 3.16Å
378H97Very high93.6Very high42 Ų4220.6 Ų20.619%0.19411%0.108CC..Hα-helixtrans-71.7-30.4174.4-7484.3000112.8V374 A375 H376 S382 M383 F425V374-H378 PolarHBondContact O-N 2.91Å; V374-H378 PolarHBondContact O-ND1 3.46Å; A375-H378 PolarHBondContact O-N 3.47Å; H376-H378 VanDerWaalsContact C-N 3.34Å; H376-H378 PolarHBondContact O-N 3.28Å; H378-S382 CarbonylContact O-C 3.59Å; H378-S382 VanDerWaalsContact O-CA 3.28Å; H378-S382 WeakPolarHBondContact O-CA 3.39Å; H378-S382 WeakPolarHBondContact O-CB 3.49Å; H378-S382 PolarHBondContact O-N 3.46Å; H378-M383 PolarHBondContact O-N 3.34Å; H378-F425 HydrophobicContact CB-CB 4.45Å; H378-F425 HydrophobicContact CB-CD1 3.38Å; H378-F425 HydrophobicContact CB-CD2 4.07Å; H378-F425 HydrophobicContact CB-CE1 3.48Å; H378-F425 VanDerWaalsContact CB-CE1 3.48Å; H378-F425 HydrophobicContact CB-CE2 4.13Å; H378-F425 HydrophobicContact CB-CG 3.7Å; H378-F425 HydrophobicContact CB-CZ 3.86Å; H378-F425 AromaticContact CD2-CE1 3.15Å; H378-F425 WeakPolarHBondContact CD2-CE1 3.39Å; H378-F425 AromaticContact CD2-CZ 3.27Å; H378-F425 WeakPolarHBondContact CD2-CZ 3.45Å; H378-F425 AromaticContact CG-CD1 3.6Å; H378-F425 AromaticContact CG-CE1 3.22Å; H378-F425 AromaticContact CG-CZ 3.71Å; H378-F425 AromaticContact ND1-CE1 3.89Å; H378-F425 AromaticContact NE2-CE1 3.8Å
379Y95.4Very high93.7Very high1 Ų119.1 Ų19.10%0.00410%0.101CC..Hα-helixtrans-66-36.7169.8-91.3-94000112.8L347 V350 A375 H376 M383 G384 N422 F425 F426 H429L347-Y379 HydrophobicContact CB-CD1 4.26Å; L347-Y379 HydrophobicContact CD2-CD1 4.35Å; L347-Y379 HydrophobicContact CD2-CE1 3.75Å; V350-Y379 HydrophobicContact CB-CD1 4.19Å; V350-Y379 HydrophobicContact CB-CE1 4.31Å; V350-Y379 HydrophobicContact CG1-CD1 4.01Å; V350-Y379 HydrophobicContact CG1-CE1 3.92Å; A375-Y379 WeakPolarHBondContact O-CD2 3.46Å; A375-Y379 PolarHBondContact O-N 2.74Å; H376-Y379 PolarHBondContact O-N 3.17Å; H376-Y379 VanDerWaalsContact O-N 3.17Å; Y379-M383 HydrophobicContact CD1-CE 3.54Å; Y379-M383 HydrophobicContact CD1-SD 3.49Å; Y379-M383 WeakPolarHBondContact CD1-SD 3.45Å; Y379-M383 HydrophobicContact CD2-CE 3.21Å; Y379-M383 HydrophobicContact CD2-SD 4.29Å; Y379-M383 HydrophobicContact CE1-CE 3.61Å; Y379-M383 HydrophobicContact CE1-SD 3.43Å; Y379-M383 WeakPolarHBondContact CE1-SD 3.47Å; Y379-M383 HydrophobicContact CE2-CE 3.29Å; Y379-M383 HydrophobicContact CE2-SD 4.24Å; Y379-M383 HydrophobicContact CG-CE 3.32Å; Y379-M383 HydrophobicContact CG-SD 3.93Å; Y379-M383 VanDerWaalsContact CZ-CE 3.47Å; Y379-M383 WeakPolarHBondContact O-CB 3.35Å; Y379-G384 PolarHBondContact O-N 2.87Å; Y379-N422 PolarHBondContact OH-OD1 2.95Å; Y379-F425 HydrophobicContact CD2-CB 4.08Å; Y379-F425 HydrophobicContact CE2-CB 3.74Å; Y379-F426 WeakPolarHBondContact OH-CB 3.45Å; Y379-H429 AromaticContact CD2-CE1 3.53Å; Y379-H429 AromaticContact CE2-CE1 3.52Å
380V92.1Very high93.7Very high31 Ų3117.3 Ų17.319%0.1889%0.091CC..Hα-helixtrans-84-41.9-179.9179.20000112.3F348 H376 F377 G384F348-V380 HydrophobicContact CD2-CG1 4.36Å; F348-V380 HydrophobicContact CE2-CG1 3.92Å; H376-V380 PolarHBondContact O-N 3.04Å; F377-V380 PolarHBondContact O-N 3.39Å; V380-G384 WeakPolarHBondContact O-CA 3.22Å; V380-G384 PolarHBondContact O-N 2.99Å
381L83Confident93.7Very high24 Ų2416.9 Ų16.913%0.1269%0.088CC..Iπ-helixtrans-88.5-59.2-178.6-175.371.2000112.3I66 L246 F377 A385I66-L381 HydrophobicContact CG1-CD2 4.11Å; L246-L381 HydrophobicContact CB-CD1 3.66Å; L246-L381 HydrophobicContact CD1-CD1 3.64Å; L246-L381 HydrophobicContact CG-CD1 4.22Å; F377-L381 HydrophobicContact CD1-CB 4.43Å; F377-L381 HydrophobicContact CD1-CD2 4.3Å; F377-L381 HydrophobicContact CD2-CB 4.5Å; F377-L381 HydrophobicContact CE1-CB 4.14Å; F377-L381 HydrophobicContact CE1-CD2 3.43Å; F377-L381 VanDerWaalsContact CE1-CD2 3.43Å; F377-L381 HydrophobicContact CE1-CG 4.36Å; F377-L381 HydrophobicContact CE2-CB 4.18Å; F377-L381 HydrophobicContact CZ-CB 4.02Å; F377-L381 HydrophobicContact CZ-CD2 3.57Å; F377-L381 HydrophobicContact CZ-CG 4.24Å; F377-L381 WeakPolarHBondContact O-CA 3.33Å; F377-L381 WeakPolarHBondContact O-CB 3.49Å; F377-L381 PolarHBondContact O-N 3.16Å; L381-A385 HydrophobicContact CD1-CB 4.25Å; L381-A385 WeakPolarHBondContact O-CA 3.4Å; L381-A385 WeakPolarHBondContact O-CB 3.28Å; L381-A385 PolarHBondContact O-N 3.23Å
382S74.9Confident93.7Very high26 Ų2616.4 Ų16.418%0.1829%0.086CC..Iπ-helixtrans-66-54.6-178.4-174.80000110.4H378 G384 V386H378-S382 CarbonylContact O-C 3.59Å; H378-S382 VanDerWaalsContact O-CA 3.28Å; H378-S382 WeakPolarHBondContact O-CA 3.39Å; H378-S382 WeakPolarHBondContact O-CB 3.49Å; H378-S382 PolarHBondContact O-N 3.46Å; S382-G384 VanDerWaalsContact C-N 3.33Å; S382-G384 PolarHBondContact O-N 3.27Å; S382-V386 WeakPolarHBondContact O-CB 3.27Å; S382-V386 WeakPolarHBondContact O-CG2 3.09Å; S382-V386 PolarHBondContact O-N 3.37Å; S382-V386 VanDerWaalsContact O-N 3.15Å
383M81Confident93.7Very high0 Ų017.4 Ų17.40%09%0.091CC..Iπ-helixtrans-80.5-11.5-179.3-65.4173.5-110.400114.5L347 H378 Y379 F387 V421 F425L347-M383 HydrophobicContact CB-CB 3.7Å; L347-M383 HydrophobicContact CB-CG 4.36Å; L347-M383 HydrophobicContact CB-SD 4.01Å; L347-M383 HydrophobicContact CD1-CB 3.85Å; L347-M383 HydrophobicContact CD1-CG 3.86Å; L347-M383 HydrophobicContact CD1-SD 3.72Å; L347-M383 HydrophobicContact CD2-SD 3.84Å; L347-M383 HydrophobicContact CG-CB 4.36Å; L347-M383 HydrophobicContact CG-SD 4.04Å; H378-M383 PolarHBondContact O-N 3.34Å; Y379-M383 HydrophobicContact CD1-CE 3.54Å; Y379-M383 HydrophobicContact CD1-SD 3.49Å; Y379-M383 WeakPolarHBondContact CD1-SD 3.45Å; Y379-M383 HydrophobicContact CD2-CE 3.21Å; Y379-M383 HydrophobicContact CD2-SD 4.29Å; Y379-M383 HydrophobicContact CE1-CE 3.61Å; Y379-M383 HydrophobicContact CE1-SD 3.43Å; Y379-M383 WeakPolarHBondContact CE1-SD 3.47Å; Y379-M383 HydrophobicContact CE2-CE 3.29Å; Y379-M383 HydrophobicContact CE2-SD 4.24Å; Y379-M383 HydrophobicContact CG-CE 3.32Å; Y379-M383 HydrophobicContact CG-SD 3.93Å; Y379-M383 VanDerWaalsContact CZ-CE 3.47Å; Y379-M383 WeakPolarHBondContact O-CB 3.35Å; M383-F387 HydrophobicContact CB-CD2 4.32Å; M383-F387 HydrophobicContact CB-CE2 4.41Å; M383-F387 HydrophobicContact CG-CE2 4.17Å; M383-F387 VanDerWaalsContact O-CB 3.26Å; M383-F387 WeakPolarHBondContact O-CB 3.31Å; M383-F387 WeakPolarHBondContact O-CG 3.41Å; M383-V421 HydrophobicContact CG-CB 4.17Å; M383-V421 HydrophobicContact CG-CG2 3.81Å; M383-V421 HydrophobicContact SD-CB 4.34Å; M383-V421 HydrophobicContact SD-CG2 3.86Å; M383-F425 HydrophobicContact CE-CB 3.64Å; M383-F425 HydrophobicContact CE-CD2 3.57Å; M383-F425 HydrophobicContact CE-CG 3.94Å
384G86.1Confident93.7Very high0 Ų016.5 Ų16.50%09%0.085CC..Iπ-helixtrans-88.5-71.5168.100000111.7I247 F344 Y379 V380 S382 V386 F387 A388I247-G384 VanDerWaalsContact CD1-C 3.47Å; F344-G384 WeakPolarHBondContact CD2-O 3.48Å; F344-G384 WeakPolarHBondContact CE2-O 3.35Å; Y379-G384 PolarHBondContact O-N 2.87Å; V380-G384 WeakPolarHBondContact O-CA 3.22Å; V380-G384 PolarHBondContact O-N 2.99Å; S382-G384 VanDerWaalsContact C-N 3.33Å; S382-G384 PolarHBondContact O-N 3.27Å; G384-V386 PolarHBondContact O-N 2.97Å; G384-F387 PolarHBondContact O-N 3.43Å; G384-A388 WeakPolarHBondContact O-CB 3.47Å; G384-A388 PolarHBondContact O-N 3.25Å
385A92.5Very high93.6Very high0 Ų015.4 Ų15.40%08%0.078CC..Iπ-helixtrans-64.1-46.1-172.400000112.5V70 M74 L246 I247 L381 F387 A388 I389V70-A385 HydrophobicContact CG1-CB 3.78Å; V70-A385 HydrophobicContact CG2-CB 4.49Å; M74-A385 HydrophobicContact CE-CB 4.34Å; L246-A385 VanDerWaalsContact O-CB 3.29Å; L246-A385 WeakPolarHBondContact O-CB 3.36Å; I247-A385 HydrophobicContact CD1-CB 4.36Å; L381-A385 HydrophobicContact CD1-CB 4.25Å; L381-A385 WeakPolarHBondContact O-CA 3.4Å; L381-A385 WeakPolarHBondContact O-CB 3.28Å; L381-A385 PolarHBondContact O-N 3.23Å; A385-F387 PolarHBondContact O-N 3.42Å; A385-A388 PolarHBondContact O-N 2.96Å; A385-I389 WeakPolarHBondContact O-CB 3.34Å; A385-I389 VanDerWaalsContact O-CG1 3.26Å; A385-I389 WeakPolarHBondContact O-CG1 3.35Å; A385-I389 PolarHBondContact O-N 3.46Å
386V94.6Very high93.5Very high18 Ų1815.4 Ų15.411%0.1098%0.078CC..Iπ-helixtrans-68.1-39-178.3-173.20000111.1M69 S382 G384 A388 I389 M390M69-V386 HydrophobicContact CE-CG1 4.3Å; M69-V386 HydrophobicContact CE-CG2 4.13Å; S382-V386 WeakPolarHBondContact O-CB 3.27Å; S382-V386 WeakPolarHBondContact O-CG2 3.09Å; S382-V386 PolarHBondContact O-N 3.37Å; S382-V386 VanDerWaalsContact O-N 3.15Å; G384-V386 PolarHBondContact O-N 2.97Å; V386-A388 VanDerWaalsContact C-N 3.34Å; V386-A388 PolarHBondContact O-N 3.02Å; V386-I389 WeakPolarHBondContact O-CB 3.33Å; V386-I389 PolarHBondContact O-N 2.84Å; V386-M390 HydrophobicContact CG1-CE 3.92Å; V386-M390 HydrophobicContact CG1-CG 4.23Å; V386-M390 VanDerWaalsContact O-CG 3.25Å; V386-M390 WeakPolarHBondContact O-CG 3.39Å; V386-M390 PolarHBondContact O-N 3.01Å
387F97.3Very high93.5Very high1 Ų114 Ų140%0.0047%0.072CC..Hα-helixtrans-65.6-38.9176.4-85.4-120.3000112.1W340 F344 L347 M383 G384 A385 M390 G391 F414 M417 F418 V421W340-F387 HydrophobicContact CE3-CB 4.08Å; W340-F387 AromaticContact CE3-CD1 3.47Å; W340-F387 HydrophobicContact CE3-CD1 3.47Å; W340-F387 VanDerWaalsContact CE3-CD1 3.47Å; W340-F387 HydrophobicContact CE3-CD2 4.36Å; W340-F387 AromaticContact CE3-CE1 3.85Å; W340-F387 HydrophobicContact CE3-CE1 3.85Å; W340-F387 AromaticContact CE3-CG 3.74Å; W340-F387 HydrophobicContact CE3-CG 3.74Å; W340-F387 HydrophobicContact CE3-CZ 4.45Å; W340-F387 HydrophobicContact CZ3-CB 4.42Å; W340-F387 AromaticContact CZ3-CD1 3.71Å; W340-F387 HydrophobicContact CZ3-CD1 3.71Å; W340-F387 AromaticContact CZ3-CD2 3.92Å; W340-F387 HydrophobicContact CZ3-CD2 3.92Å; W340-F387 AromaticContact CZ3-CE1 3.75Å; W340-F387 HydrophobicContact CZ3-CE1 3.75Å; W340-F387 AromaticContact CZ3-CE2 3.98Å; W340-F387 HydrophobicContact CZ3-CE2 3.98Å; W340-F387 AromaticContact CZ3-CG 3.78Å; W340-F387 HydrophobicContact CZ3-CG 3.78Å; W340-F387 AromaticContact CZ3-CZ 3.9Å; W340-F387 HydrophobicContact CZ3-CZ 3.9Å; F344-F387 HydrophobicContact CB-CB 4.15Å; F344-F387 HydrophobicContact CD2-CB 4.4Å; L347-F387 HydrophobicContact CD1-CD1 4.22Å; L347-F387 HydrophobicContact CD1-CE1 3.68Å; L347-F387 HydrophobicContact CD1-CE2 4.23Å; L347-F387 HydrophobicContact CD1-CZ 3.68Å; M383-F387 HydrophobicContact CB-CD2 4.32Å; M383-F387 HydrophobicContact CB-CE2 4.41Å; M383-F387 HydrophobicContact CG-CE2 4.17Å; M383-F387 VanDerWaalsContact O-CB 3.26Å; M383-F387 WeakPolarHBondContact O-CB 3.31Å; M383-F387 WeakPolarHBondContact O-CG 3.41Å; G384-F387 PolarHBondContact O-N 3.43Å; A385-F387 PolarHBondContact O-N 3.42Å; F387-M390 PolarHBondContact O-N 3.05Å; F387-G391 PolarHBondContact O-N 2.96Å; F387-F414 HydrophobicContact CE1-CE2 4.09Å; F387-M417 HydrophobicContact CE2-CG 4.27Å; F387-M417 HydrophobicContact CZ-CG 4.33Å; F387-F418 AromaticContact CE1-CD2 3.98Å; F387-F418 HydrophobicContact CE1-CD2 3.98Å; F387-F418 HydrophobicContact CZ-CD2 4.33Å; F387-V421 HydrophobicContact CE2-CG1 4.47Å; F387-V421 HydrophobicContact CE2-CG2 3.96Å; F387-V421 HydrophobicContact CZ-CG2 3.9Å
388A97.8Very high93.6Very high0 Ų012.7 Ų12.70%07%0.068CC..Hα-helixtrans-65.7-40.1173.800000111.7G250 M253 I254 F344 G384 A385 V386 G392G250-A388 VanDerWaalsContact CA-CB 3.43Å; M253-A388 HydrophobicContact CE-CB 4.24Å; I254-A388 HydrophobicContact CD1-CB 4.21Å; I254-A388 HydrophobicContact CG1-CB 4.11Å; F344-A388 HydrophobicContact CD2-CB 4.07Å; F344-A388 HydrophobicContact CE2-CB 4.11Å; G384-A388 WeakPolarHBondContact O-CB 3.47Å; G384-A388 PolarHBondContact O-N 3.25Å; A385-A388 PolarHBondContact O-N 2.96Å; V386-A388 VanDerWaalsContact C-N 3.34Å; V386-A388 PolarHBondContact O-N 3.02Å; A388-G392 PolarHBondContact O-N 3.24Å
389I97.9Very high93.5Very high6 Ų610.7 Ų10.73%0.0316%0.059CC..Hα-helixtrans-58.6-47.1172-73.5166.7000110.8I73 M74 F78 A385 V386 G392 F393I73-I389 HydrophobicContact CB-CD1 4.15Å; I73-I389 HydrophobicContact CG2-CB 4.37Å; I73-I389 HydrophobicContact CG2-CD1 3.9Å; I73-I389 HydrophobicContact CG2-CG1 3.81Å; I73-I389 HydrophobicContact CG2-CG2 3.69Å; M74-I389 HydrophobicContact CG-CD1 3.74Å; M74-I389 HydrophobicContact CG-CG1 3.59Å; M74-I389 HydrophobicContact SD-CD1 4.48Å; M74-I389 HydrophobicContact SD-CG1 4.09Å; F78-I389 HydrophobicContact CE2-CG2 4.46Å; A385-I389 WeakPolarHBondContact O-CB 3.34Å; A385-I389 VanDerWaalsContact O-CG1 3.26Å; A385-I389 WeakPolarHBondContact O-CG1 3.35Å; A385-I389 PolarHBondContact O-N 3.46Å; V386-I389 WeakPolarHBondContact O-CB 3.33Å; V386-I389 PolarHBondContact O-N 2.84Å; I389-G392 PolarHBondContact O-N 3.39Å; I389-F393 WeakPolarHBondContact O-CB 3.43Å; I389-F393 PolarHBondContact O-N 3.19Å
390M97.9Very high93.6Very high31 Ų3112 Ų1215%0.1537%0.065CC..Hα-helixtrans-69.5-42.1-178.1-66.4-57.1159.400112W340 V386 F387 F393 I394 M468W340-M390 HydrophobicContact CD2-CB 3.67Å; W340-M390 HydrophobicContact CE3-CB 3.57Å; W340-M390 HydrophobicContact CE3-CG 4.33Å; W340-M390 HydrophobicContact CG-CB 4.41Å; W340-M390 HydrophobicContact CH2-CB 3.81Å; W340-M390 HydrophobicContact CH2-CG 3.86Å; W340-M390 HydrophobicContact CZ2-CB 3.94Å; W340-M390 HydrophobicContact CZ2-CG 4.31Å; W340-M390 HydrophobicContact CZ3-CB 3.63Å; W340-M390 HydrophobicContact CZ3-CG 3.88Å; V386-M390 HydrophobicContact CG1-CE 3.92Å; V386-M390 HydrophobicContact CG1-CG 4.23Å; V386-M390 VanDerWaalsContact O-CG 3.25Å; V386-M390 WeakPolarHBondContact O-CG 3.39Å; V386-M390 PolarHBondContact O-N 3.01Å; F387-M390 PolarHBondContact O-N 3.05Å; M390-F393 PolarHBondContact O-N 2.82Å; M390-I394 WeakPolarHBondContact O-CG1 3.2Å; M390-I394 PolarHBondContact O-N 2.9Å; M390-M468 HydrophobicContact CE-CE 4.44Å; M390-M468 HydrophobicContact SD-CE 3.18Å; M390-M468 WeakPolarHBondContact SD-CE 3.4Å
391G97.9Very high93.7Very high0 Ų011.6 Ų11.60%06%0.063CC..Hα-helixtrans-61.1-45.7173.500000111.7F387 H395F387-G391 PolarHBondContact O-N 2.96Å; G391-H395 VanDerWaalsContact O-CB 3.31Å; G391-H395 WeakPolarHBondContact O-CB 3.32Å; G391-H395 PolarHBondContact O-N 3.46Å
392G97.7Very high94.3Very high0 Ų010.8 Ų10.80%06%0.06CC..Hα-helixtrans-64-44.2175.400000112.2A388 I389 I394 H395 W396A388-G392 PolarHBondContact O-N 3.24Å; I389-G392 PolarHBondContact O-N 3.39Å; G392-I394 PolarHBondContact O-N 3.17Å; G392-H395 PolarHBondContact O-N 2.94Å; G392-W396 VanDerWaalsContact CA-CE3 3.4Å; G392-W396 PolarHBondContact O-N 2.87Å
393F97.9Very high95.3Very high39 Ų3911.9 Ų11.917%0.1716%0.061CC..Hα-helixtrans-59.4-50.2177.9178.7-100.4000110.1F78 I389 M390 H395 W396 F397 L405 M468 I472F78-F393 HydrophobicContact CZ-CB 4.34Å; I389-F393 WeakPolarHBondContact O-CB 3.43Å; I389-F393 PolarHBondContact O-N 3.19Å; M390-F393 PolarHBondContact O-N 2.82Å; F393-H395 VanDerWaalsContact C-N 3.31Å; F393-H395 PolarHBondContact O-N 2.78Å; F393-W396 PolarHBondContact O-N 3.39Å; F393-F397 AromaticContact CE1-CD2 3.82Å; F393-F397 HydrophobicContact CE1-CD2 3.82Å; F393-F397 HydrophobicContact CE1-CE2 4.37Å; F393-F397 AromaticContact CE2-CD2 3.77Å; F393-F397 HydrophobicContact CE2-CD2 3.77Å; F393-F397 HydrophobicContact CE2-CE2 4.37Å; F393-F397 AromaticContact CZ-CD2 3.32Å; F393-F397 HydrophobicContact CZ-CD2 3.32Å; F393-F397 AromaticContact CZ-CE2 3.71Å; F393-F397 HydrophobicContact CZ-CE2 3.71Å; F393-F397 HydrophobicContact CZ-CG 4.37Å; F393-F397 WeakPolarHBondContact O-CA 3.5Å; F393-F397 WeakPolarHBondContact O-CB 3.46Å; F393-F397 PolarHBondContact O-N 2.72Å; F393-L405 HydrophobicContact CE1-CD1 4.26Å; F393-M468 HydrophobicContact CD1-CE 3.93Å; F393-M468 HydrophobicContact CD1-SD 4.18Å; F393-M468 HydrophobicContact CE1-CE 4.22Å; F393-M468 HydrophobicContact CE1-SD 3.85Å; F393-I472 HydrophobicContact CE1-CD1 4.13Å; F393-I472 HydrophobicContact CE1-CG1 4.07Å; F393-I472 HydrophobicContact CZ-CD1 3.69Å; F393-I472 HydrophobicContact CZ-CG1 3.82Å
394I97.5Very high96Very high9 Ų914 Ų145%0.0467%0.074CC..Hα-helixtrans-63.2-38.7179-71.5160.7000111.9A336 A337 W340 M390 G392 L405A336-I394 HydrophobicContact CB-CD1 4.42Å; A336-I394 HydrophobicContact CB-CG2 4.16Å; A337-I394 HydrophobicContact CB-CG2 4.17Å; W340-I394 HydrophobicContact CG-CD1 4.41Å; M390-I394 WeakPolarHBondContact O-CG1 3.2Å; M390-I394 PolarHBondContact O-N 2.9Å; G392-I394 PolarHBondContact O-N 3.17Å; I394-L405 HydrophobicContact CB-CD1 4.44Å; I394-L405 HydrophobicContact CG1-CD1 3.9Å
395H96.3Very high96.5Very high7 Ų714.6 Ų14.63%0.0328%0.077CC..Hα-helixtrans-68.1-47.5179.4177.852.6000112.5I257 Y260 Y261 A337 G391 G392 F393 P398 W494I257-H395 HydrophobicContact CD1-CB 4.38Å; I257-H395 HydrophobicContact CG1-CB 4.03Å; Y260-H395 AromaticContact CD1-CE1 3.64Å; Y260-H395 AromaticContact CE1-CE1 3.98Å; Y260-H395 AromaticContact CG-CE1 3.66Å; Y261-H395 AromaticContact CE2-ND1 3.76Å; A337-H395 HydrophobicContact CB-CB 4.25Å; G391-H395 VanDerWaalsContact O-CB 3.31Å; G391-H395 WeakPolarHBondContact O-CB 3.32Å; G391-H395 PolarHBondContact O-N 3.46Å; G392-H395 PolarHBondContact O-N 2.94Å; F393-H395 VanDerWaalsContact C-N 3.31Å; F393-H395 PolarHBondContact O-N 2.78Å; H395-P398 WeakPolarHBondContact O-CD 3.49Å; H395-W494 AromaticContact CE1-CZ2 3.86Å; H395-W494 AromaticContact NE2-CZ2 3.92Å; H395-W494 WeakPolarHBondContact O-CH2 3.46Å
396W97.1Very high96.7Very high0 Ų017 Ų170%09%0.09CC..Hα-helixtrans-96-1.3-176.6-67.6-69.2000114.5F78 L82 M86 M253 H256 G392 F393 P398 L399 F400 W494F78-W396 AromaticContact CD1-CE3 3.97Å; F78-W396 HydrophobicContact CD1-CE3 3.97Å; F78-W396 AromaticContact CE1-CE3 3.69Å; F78-W396 HydrophobicContact CE1-CE3 3.69Å; F78-W396 HydrophobicContact CE1-CZ3 4.41Å; L82-W396 HydrophobicContact CD1-CD2 3.78Å; L82-W396 HydrophobicContact CD1-CE3 3.97Å; L82-W396 HydrophobicContact CD1-CG 4.37Å; L82-W396 HydrophobicContact CD1-CH2 4.24Å; L82-W396 HydrophobicContact CD1-CZ2 3.97Å; L82-W396 HydrophobicContact CD1-CZ3 4.22Å; L82-W396 HydrophobicContact CD2-CD2 4.34Å; L82-W396 HydrophobicContact CD2-CG 4.12Å; M86-W396 HydrophobicContact CE-CZ2 3.93Å; M253-W396 HydrophobicContact CB-CH2 4.02Å; M253-W396 HydrophobicContact CB-CZ3 3.88Å; M253-W396 HydrophobicContact CG-CH2 3.94Å; M253-W396 HydrophobicContact CG-CZ3 3.61Å; M253-W396 HydrophobicContact SD-CZ3 3.96Å; H256-W396 HydrophobicContact CB-CH2 4.02Å; H256-W396 HydrophobicContact CB-CZ2 3.91Å; G392-W396 VanDerWaalsContact CA-CE3 3.4Å; G392-W396 PolarHBondContact O-N 2.87Å; F393-W396 PolarHBondContact O-N 3.39Å; W396-P398 VanDerWaalsContact C-CD 3.42Å; W396-P398 VanDerWaalsContact C-N 3.3Å; W396-L399 HydrophobicContact CB-CB 4.42Å; W396-L399 WeakPolarHBondContact O-CA 3.48Å; W396-L399 VanDerWaalsContact O-CB 3.26Å; W396-L399 WeakPolarHBondContact O-CB 3.47Å; W396-L399 PolarHBondContact O-N 2.72Å; W396-F400 HydrophobicContact CB-CD2 4.31Å; W396-F400 HydrophobicContact CB-CE1 3.87Å; W396-F400 HydrophobicContact CB-CE2 3.67Å; W396-F400 HydrophobicContact CB-CZ 3.41Å; W396-F400 VanDerWaalsContact CB-CZ 3.41Å; W396-F400 HydrophobicContact CG-CZ 4.21Å; W396-F400 WeakPolarHBondContact O-CD2 3.47Å; W396-F400 WeakPolarHBondContact O-CG 3.07Å; W396-F400 PolarHBondContact O-N 3.32Å; W396-W494 AromaticContact CD1-CZ2 3.48Å; W396-W494 VanDerWaalsContact CD1-CZ2 3.48Å; W396-W494 HydrophobicContact CG-CZ2 4.41Å; W396-W494 AromaticContact NE1-CZ2 3.93Å
397F97.1Very high96.7Very high7 Ų719.8 Ų19.83%0.03110%0.102CC..Hα-helixtrans-53.1-42.2174.6-177.6-95.3000112.9F393 L399 F400 S401 Y403 L405 A475 F476F393-F397 AromaticContact CE1-CD2 3.82Å; F393-F397 HydrophobicContact CE1-CD2 3.82Å; F393-F397 HydrophobicContact CE1-CE2 4.37Å; F393-F397 AromaticContact CE2-CD2 3.77Å; F393-F397 HydrophobicContact CE2-CD2 3.77Å; F393-F397 HydrophobicContact CE2-CE2 4.37Å; F393-F397 AromaticContact CZ-CD2 3.32Å; F393-F397 HydrophobicContact CZ-CD2 3.32Å; F393-F397 AromaticContact CZ-CE2 3.71Å; F393-F397 HydrophobicContact CZ-CE2 3.71Å; F393-F397 HydrophobicContact CZ-CG 4.37Å; F393-F397 WeakPolarHBondContact O-CA 3.5Å; F393-F397 WeakPolarHBondContact O-CB 3.46Å; F393-F397 PolarHBondContact O-N 2.72Å; F397-L399 VanDerWaalsContact C-N 3.32Å; F397-L399 PolarHBondContact O-N 3.32Å; F397-F400 PolarHBondContact O-N 3.02Å; F397-S401 WeakPolarHBondContact CE1-OG 3.45Å; F397-S401 WeakPolarHBondContact O-CB 3.26Å; F397-S401 PolarHBondContact O-N 3.37Å; F397-S401 PolarHBondContact O-OG 3.12Å; F397-Y403 VanDerWaalsContact CD1-O 3.28Å; F397-Y403 WeakPolarHBondContact CD1-O 3.48Å; F397-L405 HydrophobicContact CB-CD1 4.17Å; F397-L405 HydrophobicContact CB-CG 4.38Å; F397-L405 HydrophobicContact CD1-CD1 4.24Å; F397-L405 HydrophobicContact CD1-CD2 3.8Å; F397-L405 HydrophobicContact CD1-CG 3.56Å; F397-L405 HydrophobicContact CD2-CD2 4.44Å; F397-L405 HydrophobicContact CE1-CD2 3.61Å; F397-L405 HydrophobicContact CE1-CG 3.9Å; F397-L405 HydrophobicContact CE2-CD2 4.28Å; F397-L405 HydrophobicContact CG-CD1 4.11Å; F397-L405 HydrophobicContact CG-CD2 4.2Å; F397-L405 HydrophobicContact CG-CG 3.94Å; F397-L405 HydrophobicContact CZ-CD2 3.87Å; F397-A475 HydrophobicContact CE1-CB 3.78Å; F397-A475 HydrophobicContact CZ-CB 3.86Å; F397-F476 HydrophobicContact CE2-CE2 4.42Å; F397-F476 HydrophobicContact CZ-CE2 4.23Å; F397-F476 HydrophobicContact CZ-CZ 4.39Å
398P95.8Very high96.7Very high25 Ų2524 Ų2416%0.16213%0.128CC..Hα-helixtrans-60.2-40.2172.7-22.935.7000113H395 W396 G402 Y403 V482 W494 C498H395-P398 WeakPolarHBondContact O-CD 3.49Å; W396-P398 VanDerWaalsContact C-CD 3.42Å; W396-P398 VanDerWaalsContact C-N 3.3Å; P398-G402 VanDerWaalsContact O-CA 3.25Å; P398-G402 WeakPolarHBondContact O-CA 3.25Å; P398-G402 PolarHBondContact O-N 3.39Å; P398-Y403 VanDerWaalsContact CA-O 3.27Å; P398-Y403 WeakPolarHBondContact CA-O 3.38Å; P398-V482 HydrophobicContact CB-CG2 3.61Å; P398-W494 HydrophobicContact CB-CZ3 4.39Å; P398-C498 WeakPolarHBondContact O-CB 3Å
399L95.7Very high96.7Very high0 Ų028.4 Ų28.40%015%0.145CC..Hα-helixtrans-62.9-44.1177.7-174.565.5000111.7L82 L85 W396 F397 E493 W494 P499 P500L82-L399 HydrophobicContact CD2-CD2 3.82Å; L85-L399 HydrophobicContact CD1-CD2 4.23Å; W396-L399 HydrophobicContact CB-CB 4.42Å; W396-L399 WeakPolarHBondContact O-CA 3.48Å; W396-L399 VanDerWaalsContact O-CB 3.26Å; W396-L399 WeakPolarHBondContact O-CB 3.47Å; W396-L399 PolarHBondContact O-N 2.72Å; F397-L399 VanDerWaalsContact C-N 3.32Å; F397-L399 PolarHBondContact O-N 3.32Å; L399-E493 WeakPolarHBondContact CD1-O 3.35Å; L399-E493 HydrophobicContact CD2-CB 4.1Å; L399-E493 HydrophobicContact CD2-CG 4.1Å; L399-W494 HydrophobicContact CB-CE3 4.22Å; L399-W494 HydrophobicContact CB-CH2 3.69Å; L399-W494 HydrophobicContact CB-CZ2 4.46Å; L399-W494 HydrophobicContact CB-CZ3 3.55Å; L399-W494 HydrophobicContact CD1-CE3 3.99Å; L399-W494 HydrophobicContact CD1-CZ3 4.18Å; L399-W494 HydrophobicContact CG-CZ3 4.39Å; L399-P499 VanDerWaalsContact O-CA 3.31Å; L399-P499 WeakPolarHBondContact O-CA 3.42Å; L399-P499 WeakPolarHBondContact O-CB 3.39Å; L399-P500 HydrophobicContact CD1-CG 4.26Å
400F96.3Very high96.7Very high29 Ų2928.1 Ų28.113%0.12714%0.144CC..Hα-helixtrans-75.9-38.8-175.3-55.1-28000112.8L20 F78 W81 L82 W396 F397L20-F400 HydrophobicContact CD1-CD2 4.16Å; L20-F400 HydrophobicContact CD1-CE2 4.12Å; F78-F400 HydrophobicContact CD1-CE2 4.17Å; F78-F400 AromaticContact CD1-CZ 3.81Å; F78-F400 HydrophobicContact CD1-CZ 3.81Å; F78-F400 AromaticContact CE1-CE2 3.68Å; F78-F400 HydrophobicContact CE1-CE2 3.68Å; F78-F400 AromaticContact CE1-CZ 3.75Å; F78-F400 HydrophobicContact CE1-CZ 3.75Å; F78-F400 HydrophobicContact CZ-CE2 4.48Å; W81-F400 HydrophobicContact CB-CD1 4.48Å; W81-F400 HydrophobicContact CB-CE1 3.78Å; W81-F400 HydrophobicContact CB-CZ 4.32Å; W81-F400 AromaticContact CD2-CD1 3.59Å; W81-F400 HydrophobicContact CD2-CD1 3.59Å; W81-F400 AromaticContact CD2-CE1 3.8Å; W81-F400 HydrophobicContact CD2-CE1 3.8Å; W81-F400 AromaticContact CE2-CD1 3.97Å; W81-F400 AromaticContact CE3-CD1 3.64Å; W81-F400 HydrophobicContact CE3-CD1 3.64Å; W81-F400 AromaticContact CE3-CE1 3.96Å; W81-F400 HydrophobicContact CE3-CE1 3.96Å; W81-F400 AromaticContact CG-CD1 3.99Å; W81-F400 HydrophobicContact CG-CD1 3.99Å; W81-F400 AromaticContact CG-CE1 3.74Å; W81-F400 HydrophobicContact CG-CE1 3.74Å; W81-F400 HydrophobicContact CG-CZ 4.42Å; W81-F400 HydrophobicContact CH2-CD1 4.37Å; W81-F400 HydrophobicContact CZ2-CB 4.45Å; W81-F400 HydrophobicContact CZ2-CD1 4.35Å; W81-F400 HydrophobicContact CZ3-CD1 4.04Å; L82-F400 HydrophobicContact CD2-CE1 4.13Å; L82-F400 HydrophobicContact CD2-CZ 4.44Å; W396-F400 HydrophobicContact CB-CD2 4.31Å; W396-F400 HydrophobicContact CB-CE1 3.87Å; W396-F400 HydrophobicContact CB-CE2 3.67Å; W396-F400 HydrophobicContact CB-CZ 3.41Å; W396-F400 VanDerWaalsContact CB-CZ 3.41Å; W396-F400 HydrophobicContact CG-CZ 4.21Å; W396-F400 WeakPolarHBondContact O-CD2 3.47Å; W396-F400 WeakPolarHBondContact O-CG 3.07Å; W396-F400 PolarHBondContact O-N 3.32Å; F397-F400 PolarHBondContact O-N 3.02Å
401S96.2Very high96.7Very high21 Ų2130.4 Ų30.415%0.14715%0.153CC..Hα-helixtrans-107.2-21.7-169.370.80000114.6F397 Y403F397-S401 WeakPolarHBondContact CE1-OG 3.45Å; F397-S401 WeakPolarHBondContact O-CB 3.26Å; F397-S401 PolarHBondContact O-N 3.37Å; F397-S401 PolarHBondContact O-OG 3.12Å; S401-Y403 WeakPolarHBondContact O-CD2 3.45Å; S401-Y403 PolarHBondContact O-N 3Å; S401-Y403 PolarHBondContact OG-N 2.93Å; S401-Y403 VanDerWaalsContact OG-N 3.08Å; S401-Y403 PolarHBondContact OG-O 3.29Å
402G95.4Very high96.7Very high7 Ų734 Ų347%0.07217%0.171CC..SBendtrans74.34.5-167.600000114.9P398 K481 V482 C498P398-G402 VanDerWaalsContact O-CA 3.25Å; P398-G402 WeakPolarHBondContact O-CA 3.25Å; P398-G402 PolarHBondContact O-N 3.39Å; G402-K481 WeakPolarHBondContact O-CA 3.49Å; G402-V482 PolarHBondContact O-N 2.65Å; G402-C498 VanDerWaalsContact CA-O 3.23Å; G402-C498 WeakPolarHBondContact CA-O 3.22Å
403Y96.1Very high96.8Very high49 Ų4934 Ų3419%0.19217%0.171CC..BIsolated β-bridgetrans-116.9158.6179.7-58.7-61.1000112.7F397 P398 S401 F476 K479 R480 K481F397-Y403 VanDerWaalsContact CD1-O 3.28Å; F397-Y403 WeakPolarHBondContact CD1-O 3.48Å; P398-Y403 VanDerWaalsContact CA-O 3.27Å; P398-Y403 WeakPolarHBondContact CA-O 3.38Å; S401-Y403 WeakPolarHBondContact O-CD2 3.45Å; S401-Y403 PolarHBondContact O-N 3Å; S401-Y403 PolarHBondContact OG-N 2.93Å; S401-Y403 VanDerWaalsContact OG-N 3.08Å; S401-Y403 PolarHBondContact OG-O 3.29Å; Y403-F476 AromaticContact CD2-CD1 3.62Å; Y403-F476 HydrophobicContact CD2-CD1 3.62Å; Y403-F476 AromaticContact CD2-CE1 3.68Å; Y403-F476 HydrophobicContact CD2-CE1 3.68Å; Y403-F476 AromaticContact CE2-CD1 3.65Å; Y403-F476 HydrophobicContact CE2-CD1 3.65Å; Y403-F476 AromaticContact CE2-CE1 3.87Å; Y403-F476 HydrophobicContact CE2-CE1 3.87Å; Y403-K479 HydrophobicContact CD1-CB 4.34Å; Y403-K479 HydrophobicContact CE1-CB 3.73Å; Y403-K479 HydrophobicContact CE1-CG 4.2Å; Y403-R480 CarbonylContact C-O 3.5Å; Y403-R480 VanDerWaalsContact CA-O 3.22Å; Y403-R480 WeakPolarHBondContact CA-O 3.24Å; Y403-K481 HydrophobicContact CD1-CG 4.25Å; Y403-K481 HydrophobicContact CE1-CG 4.01Å
404T95.4Very high96.8Very high45 Ų4533.2 Ų33.228%0.27617%0.168SC..  trans-106138.717861.50000112.5R480 V482T404-R480 PolarHBondContact N-O 3Å; T404-R480 PolarHBondContact O-NE 2.95Å; T404-R480 PolarHBondContact O-NH2 2.91Å; T404-R480 WeakPolarHBondContact OG1-CB 3.43Å; T404-R480 PolarHBondContact OG1-O 2.98Å; T404-V482 HydrophobicContact CG2-CG2 3.94Å
405L96Very high96.8Very high13 Ų1336.1 Ų36.17%0.06819%0.186CC..  trans-75.1142.3168.8-62.4174.2000110F393 I394 F397 Q407 M471 A475F393-L405 HydrophobicContact CE1-CD1 4.26Å; I394-L405 HydrophobicContact CB-CD1 4.44Å; I394-L405 HydrophobicContact CG1-CD1 3.9Å; F397-L405 HydrophobicContact CB-CD1 4.17Å; F397-L405 HydrophobicContact CB-CG 4.38Å; F397-L405 HydrophobicContact CD1-CD1 4.24Å; F397-L405 HydrophobicContact CD1-CD2 3.8Å; F397-L405 HydrophobicContact CD1-CG 3.56Å; F397-L405 HydrophobicContact CD2-CD2 4.44Å; F397-L405 HydrophobicContact CE1-CD2 3.61Å; F397-L405 HydrophobicContact CE1-CG 3.9Å; F397-L405 HydrophobicContact CE2-CD2 4.28Å; F397-L405 HydrophobicContact CG-CD1 4.11Å; F397-L405 HydrophobicContact CG-CD2 4.2Å; F397-L405 HydrophobicContact CG-CG 3.94Å; F397-L405 HydrophobicContact CZ-CD2 3.87Å; L405-Q407 PolarHBondContact O-N 3.35Å; L405-M471 HydrophobicContact CB-CE 4.43Å; L405-M471 HydrophobicContact CD1-CE 4.02Å; L405-M471 HydrophobicContact CD2-CB 4.5Å; L405-M471 HydrophobicContact CD2-CE 4.4Å; L405-A475 HydrophobicContact CD2-CB 3.92Å
406D96.4Very high96.9Very high50 Ų5038 Ų3827%0.26720%0.196SC..  trans-64.8126.5170.1-177.6-85.3000110.4T408 Y409 A410D406-T408 VanDerWaalsContact C-N 3.3Å; D406-T408 PolarHBondContact O-N 2.95Å; D406-T408 VanDerWaalsContact OD1-CA 3.3Å; D406-T408 WeakPolarHBondContact OD1-CA 3.48Å; D406-T408 WeakPolarHBondContact OD1-CB 3.23Å; D406-T408 PolarHBondContact OD1-N 3.47Å; D406-T408 PolarHBondContact OD1-OG1 3.05Å; D406-Y409 HydrophobicContact CB-CD2 3.74Å; D406-Y409 HydrophobicContact CB-CE2 4.46Å; D406-Y409 HydrophobicContact CB-CG 4.5Å; D406-Y409 PolarHBondContact OD1-N 3.41Å; D406-A410 WeakPolarHBondContact O-CB 3.19Å; D406-A410 PolarHBondContact O-N 3.33Å
407Q94.9Very high97Very high77 Ų7738.7 Ų38.736%0.3620%0.199SC..Hα-helixtrans-70.3-25.8-175.5-73.2-63.8-45.500113.1A336 L405 K411A336-Q407 VanDerWaalsContact N-OE1 3.16Å; L405-Q407 PolarHBondContact O-N 3.35Å; Q407-K411 WeakPolarHBondContact O-CB 3.46Å; Q407-K411 WeakPolarHBondContact O-CG 3.23Å; Q407-K411 PolarHBondContact O-N 3Å; Q407-K411 VanDerWaalsContact O-N 3.07Å
408T97.1Very high97Very high90 Ų9041 Ų4155%0.55221%0.209SC*.Hα-helixtrans-70-51.7177.7-500000109.4D406 A410 K411 I412D406-T408 VanDerWaalsContact C-N 3.3Å; D406-T408 PolarHBondContact O-N 2.95Å; D406-T408 VanDerWaalsContact OD1-CA 3.3Å; D406-T408 WeakPolarHBondContact OD1-CA 3.48Å; D406-T408 WeakPolarHBondContact OD1-CB 3.23Å; D406-T408 PolarHBondContact OD1-N 3.47Å; D406-T408 PolarHBondContact OD1-OG1 3.05Å; T408-A410 VanDerWaalsContact C-N 3.31Å; T408-A410 PolarHBondContact O-N 2.9Å; T408-K411 PolarHBondContact O-N 3.02Å; T408-I412 HydrophobicContact CG2-CD1 4.09Å; T408-I412 WeakPolarHBondContact O-CG1 3.41Å; T408-I412 PolarHBondContact O-N 3.44Å
409Y97.8Very high97.1Very high91 Ų9143.7 Ų43.736%0.35722%0.221SC..Hα-helixtrans-62.3-39.4176.2-63.6-46.9000112D406 K411 I412 H413 F470D406-Y409 HydrophobicContact CB-CD2 3.74Å; D406-Y409 HydrophobicContact CB-CE2 4.46Å; D406-Y409 HydrophobicContact CB-CG 4.5Å; D406-Y409 PolarHBondContact OD1-N 3.41Å; Y409-K411 VanDerWaalsContact C-N 3.33Å; Y409-K411 PolarHBondContact O-N 3.49Å; Y409-I412 HydrophobicContact CD1-CD1 4.49Å; Y409-I412 PolarHBondContact O-N 3.22Å; Y409-H413 WeakPolarHBondContact O-CB 3.45Å; Y409-H413 PolarHBondContact O-N 3.13Å; Y409-F470 HydrophobicContact CD2-CE1 4.14Å; Y409-F470 HydrophobicContact CE1-CE1 4.34Å; Y409-F470 AromaticContact CE2-CE1 3.97Å; Y409-F470 HydrophobicContact CE2-CE1 3.97Å; Y409-F470 HydrophobicContact CG-CE1 4.43Å
410A97.9Very high97.2Very high0 Ų043.7 Ų43.70%022%0.221CC..Hα-helixtrans-63.6-35.9177.900000113.4A336 D406 T408 F414 M471A336-A410 HydrophobicContact CB-CB 3.5Å; A336-A410 VanDerWaalsContact CB-CB 3.5Å; D406-A410 WeakPolarHBondContact O-CB 3.19Å; D406-A410 PolarHBondContact O-N 3.33Å; T408-A410 VanDerWaalsContact C-N 3.31Å; T408-A410 PolarHBondContact O-N 2.9Å; A410-F414 PolarHBondContact O-N 2.85Å; A410-F414 VanDerWaalsContact O-N 3.14Å; A410-M471 HydrophobicContact CB-CE 3.65Å
411K98.4Very high97.3Very high80 Ų8042.6 Ų42.635%0.34822%0.217SC..Hα-helixtrans-71.1-42.8173.9-73.5174.1-179.5-173.70111.9W334 A336 L339 Q407 T408 Y409 H413 F414 T415W334-K411 WeakPolarHBondContact O-CE 3.27Å; W334-K411 PolarHBondContact O-NZ 3.29Å; A336-K411 HydrophobicContact CB-CG 4.29Å; L339-K411 HydrophobicContact CD1-CB 4.46Å; L339-K411 HydrophobicContact CD1-CG 3.93Å; Q407-K411 WeakPolarHBondContact O-CB 3.46Å; Q407-K411 WeakPolarHBondContact O-CG 3.23Å; Q407-K411 PolarHBondContact O-N 3Å; Q407-K411 VanDerWaalsContact O-N 3.07Å; T408-K411 PolarHBondContact O-N 3.02Å; Y409-K411 VanDerWaalsContact C-N 3.33Å; Y409-K411 PolarHBondContact O-N 3.49Å; K411-H413 VanDerWaalsContact C-N 3.3Å; K411-H413 PolarHBondContact O-N 2.66Å; K411-F414 WeakPolarHBondContact O-CB 3.19Å; K411-F414 PolarHBondContact O-N 2.97Å; K411-T415 PolarHBondContact O-N 3.25Å; K411-T415 PolarHBondContact O-OG1 2.8Å
412I98.4Very high97.3Very high74 Ų7443 Ų4338%0.37922%0.218SC..Hα-helixtrans-59.5-44.9174.9-66.7167.3000110T408 Y409 F414 T415 I416 L467T408-I412 HydrophobicContact CG2-CD1 4.09Å; T408-I412 WeakPolarHBondContact O-CG1 3.41Å; T408-I412 PolarHBondContact O-N 3.44Å; Y409-I412 HydrophobicContact CD1-CD1 4.49Å; Y409-I412 PolarHBondContact O-N 3.22Å; I412-F414 PolarHBondContact O-N 3.22Å; I412-T415 PolarHBondContact O-N 3.16Å; I412-T415 VanDerWaalsContact O-N 3.17Å; I412-I416 HydrophobicContact CG2-CD1 3.62Å; I412-I416 HydrophobicContact CG2-CG1 4.2Å; I412-I416 WeakPolarHBondContact O-CG1 3.33Å; I412-I416 PolarHBondContact O-N 3.37Å; I412-L467 HydrophobicContact CB-CD2 4.27Å; I412-L467 HydrophobicContact CG2-CD2 3.73Å
413H98.6Very high97.4Very high1 Ų145.3 Ų45.31%0.00523%0.228CC..Hα-helixtrans-57.1-47.1176.5175.8-117.1000112.2W340 Y409 K411 M417 A464 L467 M468 M471W340-H413 AromaticContact CH2-CE1 3.92Å; W340-H413 AromaticContact CZ2-CE1 3.47Å; W340-H413 VanDerWaalsContact CZ2-CE1 3.47Å; W340-H413 WeakPolarHBondContact CZ2-CE1 3.35Å; W340-H413 AromaticContact CZ2-ND1 3.46Å; W340-H413 WeakPolarHBondContact CZ2-ND1 3.35Å; Y409-H413 WeakPolarHBondContact O-CB 3.45Å; Y409-H413 PolarHBondContact O-N 3.13Å; K411-H413 VanDerWaalsContact C-N 3.3Å; K411-H413 PolarHBondContact O-N 2.66Å; H413-M417 WeakPolarHBondContact O-CB 3.26Å; H413-M417 PolarHBondContact O-N 2.94Å; H413-A464 PolarHBondContact CD2-O 2.64Å; H413-A464 PolarHBondContact NE2-O 2.75Å; H413-L467 HydrophobicContact CB-CD2 3.8Å; H413-L467 HydrophobicContact CB-CG 4.19Å; H413-M468 WeakPolarHBondContact CE1-CE 3.3Å; H413-M471 HydrophobicContact CB-SD 3.62Å
414F98.4Very high97.5Very high23 Ų2343.2 Ų43.210%0.10122%0.22CC..Hα-helixtrans-56.9-51.1172.9169.6-99.1000112L339 W340 F387 A410 K411 I412 I416 M417 F418L339-F414 VanDerWaalsContact C-CE2 3.49Å; L339-F414 HydrophobicContact CB-CD1 3.69Å; L339-F414 HydrophobicContact CB-CD2 4.1Å; L339-F414 HydrophobicContact CB-CE1 3.79Å; L339-F414 HydrophobicContact CB-CE2 4.17Å; L339-F414 HydrophobicContact CB-CG 3.85Å; L339-F414 HydrophobicContact CB-CZ 4.02Å; L339-F414 HydrophobicContact CD1-CD1 3.9Å; L339-F414 HydrophobicContact CD1-CE1 4.39Å; L339-F414 HydrophobicContact CD1-CG 4.48Å; L339-F414 HydrophobicContact CG-CD1 4.35Å; L339-F414 HydrophobicContact CG-CE1 4.48Å; L339-F414 WeakPolarHBondContact O-CE2 3.44Å; L339-F414 WeakPolarHBondContact O-CZ 3.21Å; W340-F414 AromaticContact CD2-CD2 3.7Å; W340-F414 HydrophobicContact CD2-CD2 3.7Å; W340-F414 AromaticContact CE2-CD2 3.82Å; W340-F414 HydrophobicContact CE3-CD2 4.06Å; W340-F414 AromaticContact CG-CD2 3.97Å; W340-F414 HydrophobicContact CG-CD2 3.97Å; W340-F414 HydrophobicContact CZ2-CB 4.05Å; W340-F414 HydrophobicContact CZ2-CD2 4.28Å; F387-F414 HydrophobicContact CE1-CE2 4.09Å; A410-F414 PolarHBondContact O-N 2.85Å; A410-F414 VanDerWaalsContact O-N 3.14Å; K411-F414 WeakPolarHBondContact O-CB 3.19Å; K411-F414 PolarHBondContact O-N 2.97Å; I412-F414 PolarHBondContact O-N 3.22Å; F414-I416 PolarHBondContact O-N 2.93Å; F414-M417 PolarHBondContact O-N 2.91Å; F414-F418 HydrophobicContact CE1-CB 4.4Å; F414-F418 HydrophobicContact CE2-CB 4.33Å; F414-F418 HydrophobicContact CE2-CD2 4.12Å; F414-F418 HydrophobicContact CZ-CB 4.17Å; F414-F418 AromaticContact CZ-CD2 3.84Å; F414-F418 HydrophobicContact CZ-CD2 3.84Å; F414-F418 HydrophobicContact CZ-CG 4.12Å; F414-F418 VanDerWaalsContact O-CB 3.22Å; F414-F418 WeakPolarHBondContact O-CB 3.46Å; F414-F418 PolarHBondContact O-N 2.82Å
415T98.4Very high97.7Very high70 Ų7042 Ų4243%0.42921%0.211SC..Hα-helixtrans-61.5-45.6-175.7-600000112K411 I412 F418 I419K411-T415 PolarHBondContact O-N 3.25Å; K411-T415 PolarHBondContact O-OG1 2.8Å; I412-T415 PolarHBondContact O-N 3.16Å; I412-T415 VanDerWaalsContact O-N 3.17Å; T415-F418 PolarHBondContact O-N 2.94Å; T415-I419 HydrophobicContact CG2-CD1 3.92Å; T415-I419 WeakPolarHBondContact O-CG1 3.33Å; T415-I419 PolarHBondContact O-N 3.22Å
416I98.4Very high97.7Very high47 Ų4746.2 Ų46.224%0.24123%0.229CC..Hα-helixtrans-63.8-47.5178.7-63.7174.3000110.2I412 F414 F418 I419 G420 I460 T463 A464 L467I412-I416 HydrophobicContact CG2-CD1 3.62Å; I412-I416 HydrophobicContact CG2-CG1 4.2Å; I412-I416 WeakPolarHBondContact O-CG1 3.33Å; I412-I416 PolarHBondContact O-N 3.37Å; F414-I416 PolarHBondContact O-N 2.93Å; I416-F418 PolarHBondContact O-N 3.42Å; I416-I419 PolarHBondContact O-N 3.44Å; I416-G420 PolarHBondContact O-N 3.39Å; I416-I460 HydrophobicContact CG2-CG2 3.86Å; I416-T463 WeakPolarHBondContact CG2-OG1 3.3Å; I416-A464 HydrophobicContact CB-CB 4.24Å; I416-A464 HydrophobicContact CG2-CB 3.86Å; I416-L467 HydrophobicContact CD1-CD2 4.15Å
417M97.8Very high97.8Very high14 Ų1444 Ų447%0.06922%0.218CC..Hα-helixtrans-61.5-47.5178.6-173.865.679.300111.1W340 F387 H413 F414 I419 G420 V421 A464 V465W340-M417 HydrophobicContact CH2-CB 3.72Å; W340-M417 HydrophobicContact CH2-CG 3.74Å; W340-M417 HydrophobicContact CZ2-CB 4.44Å; W340-M417 HydrophobicContact CZ3-CG 4.21Å; F387-M417 HydrophobicContact CE2-CG 4.27Å; F387-M417 HydrophobicContact CZ-CG 4.33Å; H413-M417 WeakPolarHBondContact O-CB 3.26Å; H413-M417 PolarHBondContact O-N 2.94Å; F414-M417 PolarHBondContact O-N 2.91Å; M417-I419 VanDerWaalsContact C-N 3.33Å; M417-I419 PolarHBondContact O-N 3.45Å; M417-G420 PolarHBondContact O-N 3.35Å; M417-V421 HydrophobicContact CG-CG1 4.08Å; M417-V421 WeakPolarHBondContact O-CG1 3.41Å; M417-V421 WeakPolarHBondContact O-CG2 3.39Å; M417-V421 PolarHBondContact O-N 3.08Å; M417-V421 HydrophobicContact SD-CG1 3.7Å; M417-A464 HydrophobicContact CB-CB 3.83Å; M417-A464 HydrophobicContact CE-CB 3.7Å; M417-A464 HydrophobicContact SD-CB 4.15Å; M417-V465 HydrophobicContact CE-CG2 4.16Å
418F97.9Very high98Very high55 Ų5540.5 Ų40.524%0.24120%0.201CC..Hα-helixtrans-58.6-44-178.6-174.2-90.5000111.9F346 L347 F387 F414 T415 I416 N422F346-F418 HydrophobicContact CD1-CE2 4.29Å; F346-F418 AromaticContact CD1-CZ 4Å; F346-F418 HydrophobicContact CD1-CZ 4Å; F346-F418 HydrophobicContact CE1-CZ 4.21Å; L347-F418 HydrophobicContact CD1-CD2 3.87Å; L347-F418 HydrophobicContact CD1-CE2 3.69Å; L347-F418 HydrophobicContact CD2-CE2 4.03Å; L347-F418 HydrophobicContact CD2-CZ 4.3Å; L347-F418 HydrophobicContact CG-CE2 3.9Å; F387-F418 AromaticContact CE1-CD2 3.98Å; F387-F418 HydrophobicContact CE1-CD2 3.98Å; F387-F418 HydrophobicContact CZ-CD2 4.33Å; F414-F418 HydrophobicContact CE1-CB 4.4Å; F414-F418 HydrophobicContact CE2-CB 4.33Å; F414-F418 HydrophobicContact CE2-CD2 4.12Å; F414-F418 HydrophobicContact CZ-CB 4.17Å; F414-F418 AromaticContact CZ-CD2 3.84Å; F414-F418 HydrophobicContact CZ-CD2 3.84Å; F414-F418 HydrophobicContact CZ-CG 4.12Å; F414-F418 VanDerWaalsContact O-CB 3.22Å; F414-F418 WeakPolarHBondContact O-CB 3.46Å; F414-F418 PolarHBondContact O-N 2.82Å; T415-F418 PolarHBondContact O-N 2.94Å; I416-F418 PolarHBondContact O-N 3.42Å; F418-N422 PolarHBondContact O-N 2.76Å; F418-N422 PolarHBondContact O-ND2 2.93Å
419I98.3Very high98Very high81 Ų8136.9 Ų36.942%0.41518%0.178SC..Hα-helixtrans-66.6-48.1175.6-67.7169.5000110.4T415 I416 M417 V421 N422 L423T415-I419 HydrophobicContact CG2-CD1 3.92Å; T415-I419 WeakPolarHBondContact O-CG1 3.33Å; T415-I419 PolarHBondContact O-N 3.22Å; I416-I419 PolarHBondContact O-N 3.44Å; M417-I419 VanDerWaalsContact C-N 3.33Å; M417-I419 PolarHBondContact O-N 3.45Å; I419-V421 PolarHBondContact O-N 2.91Å; I419-N422 PolarHBondContact O-N 2.98Å; I419-L423 HydrophobicContact CG2-CD1 3.72Å; I419-L423 HydrophobicContact CG2-CG 4.27Å; I419-L423 WeakPolarHBondContact O-CB 3.49Å; I419-L423 WeakPolarHBondContact O-CG 3.42Å; I419-L423 PolarHBondContact O-N 2.71Å
420G97.9Very high98.1Very high0 Ų036.3 Ų36.30%018%0.178CC..Hα-helixtrans-58.6-49.3-177.300000113.3I416 M417 N422 L423 T424 G457 S461I416-G420 PolarHBondContact O-N 3.39Å; M417-G420 PolarHBondContact O-N 3.35Å; G420-N422 PolarHBondContact O-N 2.85Å; G420-L423 PolarHBondContact O-N 2.96Å; G420-T424 WeakPolarHBondContact O-CB 3.28Å; G420-T424 PolarHBondContact O-N 3.34Å; G420-T424 PolarHBondContact O-OG1 2.92Å; G420-G457 CarbonylContact C-O 3.25Å; G420-G457 WeakPolarHBondContact CA-O 3.2Å; G420-G457 CarbonylContact O-C 3.48Å; G420-G457 WeakPolarHBondContact O-CA 3.22Å; G420-S461 WeakPolarHBondContact CA-OG 3.4Å
421V96.9Very high98.1Very high6 Ų636.3 Ų36.34%0.03618%0.178CC..Hα-helixtrans-67.7-37.6-178.2-60.10000112.1L347 M383 F387 M417 I419 T424 F425 S461L347-V421 HydrophobicContact CD1-CG2 4.49Å; M383-V421 HydrophobicContact CG-CB 4.17Å; M383-V421 HydrophobicContact CG-CG2 3.81Å; M383-V421 HydrophobicContact SD-CB 4.34Å; M383-V421 HydrophobicContact SD-CG2 3.86Å; F387-V421 HydrophobicContact CE2-CG1 4.47Å; F387-V421 HydrophobicContact CE2-CG2 3.96Å; F387-V421 HydrophobicContact CZ-CG2 3.9Å; M417-V421 HydrophobicContact CG-CG1 4.08Å; M417-V421 WeakPolarHBondContact O-CG1 3.41Å; M417-V421 WeakPolarHBondContact O-CG2 3.39Å; M417-V421 PolarHBondContact O-N 3.08Å; M417-V421 HydrophobicContact SD-CG1 3.7Å; I419-V421 PolarHBondContact O-N 2.91Å; V421-T424 WeakPolarHBondContact O-CB 3.37Å; V421-T424 PolarHBondContact O-N 3.02Å; V421-F425 HydrophobicContact CB-CD2 4.3Å; V421-F425 HydrophobicContact CB-CE2 4.47Å; V421-F425 VanDerWaalsContact O-CD2 3.24Å; V421-F425 WeakPolarHBondContact O-CD2 3.33Å; V421-F425 PolarHBondContact O-N 2.92Å; V421-S461 PolarHBondContact N-OG 3.31Å
422N97.6Very high98Very high30 Ų3032.6 Ų32.616%0.1616%0.162CC..Hα-helixtrans-68.7-42.6176.7-80.5-78.7000111.1L347 Y379 F418 I419 G420 T424 F426 P427L347-N422 WeakPolarHBondContact CD2-ND2 3.45Å; L347-N422 VanDerWaalsContact CD2-OD1 3.23Å; L347-N422 WeakPolarHBondContact CD2-OD1 3.28Å; Y379-N422 PolarHBondContact OH-OD1 2.95Å; F418-N422 PolarHBondContact O-N 2.76Å; F418-N422 PolarHBondContact O-ND2 2.93Å; I419-N422 PolarHBondContact O-N 2.98Å; G420-N422 PolarHBondContact O-N 2.85Å; N422-T424 PolarHBondContact O-N 3.26Å; N422-F426 WeakPolarHBondContact O-CB 3.26Å; N422-F426 PolarHBondContact O-N 3.33Å; N422-P427 WeakPolarHBondContact O-CD 3.25Å
423L97.6Very high98Very high56 Ų5634.2 Ų34.229%0.29317%0.171SC..Hα-helixtrans-63.1-29.2172.8-72.1178.6000112.2I419 G420 P427 L453 S454 I460I419-L423 HydrophobicContact CG2-CD1 3.72Å; I419-L423 HydrophobicContact CG2-CG 4.27Å; I419-L423 WeakPolarHBondContact O-CB 3.49Å; I419-L423 WeakPolarHBondContact O-CG 3.42Å; I419-L423 PolarHBondContact O-N 2.71Å; G420-L423 PolarHBondContact O-N 2.96Å; L423-P427 WeakPolarHBondContact O-CD 3.26Å; L423-P427 WeakPolarHBondContact O-CG 3.39Å; L423-L453 HydrophobicContact CD2-CD1 4.07Å; L423-L453 HydrophobicContact CD2-CG 4.38Å; L423-S454 WeakPolarHBondContact O-CA 3.15Å; L423-I460 HydrophobicContact CD1-CD1 3.75Å
424T97.9Very high97.9Very high4 Ų437 Ų373%0.02519%0.19CC..Hα-helixtrans-71.6-56.9176-52.60000111.5G420 V421 N422 S454 G457 S458G420-T424 WeakPolarHBondContact O-CB 3.28Å; G420-T424 PolarHBondContact O-N 3.34Å; G420-T424 PolarHBondContact O-OG1 2.92Å; V421-T424 WeakPolarHBondContact O-CB 3.37Å; V421-T424 PolarHBondContact O-N 3.02Å; N422-T424 PolarHBondContact O-N 3.26Å; T424-S454 WeakPolarHBondContact CA-O 3.47Å; T424-S454 VanDerWaalsContact O-CB 3.24Å; T424-S454 WeakPolarHBondContact O-CB 3.42Å; T424-S454 PolarHBondContact O-OG 2.82Å; T424-G457 WeakPolarHBondContact OG1-CA 3.43Å; T424-G457 PolarHBondContact OG1-O 2.87Å; T424-S458 WeakPolarHBondContact OG1-CA 3.42Å; T424-S458 PolarHBondContact OG1-N 2.97Å
425F98.2Very high97.8Very high19 Ų1937.7 Ų37.78%0.08320%0.204CC..Hα-helixtrans-100.9-23.4-163.8-60.7-67.2000113.8H378 Y379 M383 V421 Q428H378-F425 HydrophobicContact CB-CB 4.45Å; H378-F425 HydrophobicContact CB-CD1 3.38Å; H378-F425 HydrophobicContact CB-CD2 4.07Å; H378-F425 HydrophobicContact CB-CE1 3.48Å; H378-F425 VanDerWaalsContact CB-CE1 3.48Å; H378-F425 HydrophobicContact CB-CE2 4.13Å; H378-F425 HydrophobicContact CB-CG 3.7Å; H378-F425 HydrophobicContact CB-CZ 3.86Å; H378-F425 AromaticContact CD2-CE1 3.15Å; H378-F425 WeakPolarHBondContact CD2-CE1 3.39Å; H378-F425 AromaticContact CD2-CZ 3.27Å; H378-F425 WeakPolarHBondContact CD2-CZ 3.45Å; H378-F425 AromaticContact CG-CD1 3.6Å; H378-F425 AromaticContact CG-CE1 3.22Å; H378-F425 AromaticContact CG-CZ 3.71Å; H378-F425 AromaticContact ND1-CE1 3.89Å; H378-F425 AromaticContact NE2-CE1 3.8Å; Y379-F425 HydrophobicContact CD2-CB 4.08Å; Y379-F425 HydrophobicContact CE2-CB 3.74Å; M383-F425 HydrophobicContact CE-CB 3.64Å; M383-F425 HydrophobicContact CE-CD2 3.57Å; M383-F425 HydrophobicContact CE-CG 3.94Å; V421-F425 HydrophobicContact CB-CD2 4.3Å; V421-F425 HydrophobicContact CB-CE2 4.47Å; V421-F425 VanDerWaalsContact O-CD2 3.24Å; V421-F425 WeakPolarHBondContact O-CD2 3.33Å; V421-F425 PolarHBondContact O-N 2.92Å; F425-Q428 WeakPolarHBondContact O-CB 3.5Å; F425-Q428 PolarHBondContact O-N 3.46Å
426F97.7Very high97.8Very high102 Ų10234.5 Ų34.545%0.44718%0.184SC..Hα-helixtrans-61.2-46176.5-164.4-106.4000111.8Y379 N422 Q428 H429 F430Y379-F426 WeakPolarHBondContact OH-CB 3.45Å; N422-F426 WeakPolarHBondContact O-CB 3.26Å; N422-F426 PolarHBondContact O-N 3.33Å; F426-Q428 PolarHBondContact O-N 2.87Å; F426-Q428 VanDerWaalsContact O-N 3.16Å; F426-H429 PolarHBondContact O-N 3.5Å; F426-H429 PolarHBondContact O-ND1 2.89Å; F426-F430 AromaticContact CD1-CE2 3.94Å; F426-F430 HydrophobicContact CD1-CE2 3.94Å; F426-F430 AromaticContact CE1-CE2 3.65Å; F426-F430 HydrophobicContact CE1-CE2 3.65Å; F426-F430 HydrophobicContact CE1-CZ 4Å; F426-F430 HydrophobicContact CZ-CE2 4.44Å; F426-F430 HydrophobicContact CZ-CZ 4.48Å
427P98.1Very high97.8Very high4 Ų434.8 Ų34.83%0.02619%0.189CC..Hα-helixtrans-57.7-29.1175.6-30.341.6000114.4N422 L423 H429 F430 L431 W450 L453N422-P427 WeakPolarHBondContact O-CD 3.25Å; L423-P427 WeakPolarHBondContact O-CD 3.26Å; L423-P427 WeakPolarHBondContact O-CG 3.39Å; P427-H429 PolarHBondContact O-N 3.32Å; P427-F430 WeakPolarHBondContact O-CB 3.46Å; P427-F430 PolarHBondContact O-N 2.68Å; P427-L431 PolarHBondContact O-N 3.18Å; P427-L431 VanDerWaalsContact O-N 3.12Å; P427-W450 HydrophobicContact CB-CB 4.17Å; P427-W450 HydrophobicContact CB-CD2 4.37Å; P427-W450 HydrophobicContact CB-CE3 3.78Å; P427-W450 HydrophobicContact CG-CE3 4.3Å; P427-L453 HydrophobicContact CG-CB 4.28Å; P427-L453 HydrophobicContact CG-CD2 3.65Å; P427-L453 HydrophobicContact CG-CG 3.95Å
428Q98.3Very high97.7Very high4 Ų436.3 Ų36.32%0.01919%0.194CC..Hα-helixtrans-67.7-23.8-177.7-65.1-178.27.100112.8Y371 A375 F425 F426 F430 L431 G432 S454Y371-Q428 CarbonylContact C-O 3.46Å; Y371-Q428 WeakPolarHBondContact CB-O 3.49Å; Y371-Q428 HydrophobicContact CD1-CB 4.12Å; Y371-Q428 HydrophobicContact CD1-CG 3.92Å; A375-Q428 HydrophobicContact CB-CB 3.76Å; F425-Q428 WeakPolarHBondContact O-CB 3.5Å; F425-Q428 PolarHBondContact O-N 3.46Å; F426-Q428 PolarHBondContact O-N 2.87Å; F426-Q428 VanDerWaalsContact O-N 3.16Å; Q428-F430 VanDerWaalsContact C-N 3.31Å; Q428-F430 PolarHBondContact O-N 3.31Å; Q428-L431 HydrophobicContact CG-CD1 4.28Å; Q428-L431 PolarHBondContact O-N 3.32Å; Q428-G432 PolarHBondContact O-N 3.42Å; Q428-S454 PolarHBondContact NE2-OG 3.29Å
429H98.2Very high97.5Very high13 Ų1336.8 Ų36.86%0.0619%0.194CC..Hα-helixtrans-62.4-40.6169.2-65.1102.5000111.4Y372 A375 Y379 F426 P427 G432 L433Y372-H429 HydrophobicContact CD2-CB 4.31Å; Y372-H429 HydrophobicContact CE2-CB 4.41Å; Y372-H429 AromaticContact CE2-CD2 3.93Å; A375-H429 WeakPolarHBondContact CB-NE2 3.23Å; Y379-H429 AromaticContact CD2-CE1 3.53Å; Y379-H429 AromaticContact CE2-CE1 3.52Å; F426-H429 PolarHBondContact O-N 3.5Å; F426-H429 PolarHBondContact O-ND1 2.89Å; P427-H429 PolarHBondContact O-N 3.32Å; H429-G432 PolarHBondContact O-N 3.43Å; H429-L433 WeakPolarHBondContact O-CB 3.29Å; H429-L433 VanDerWaalsContact O-CG 3.25Å; H429-L433 WeakPolarHBondContact O-CG 3.23Å; H429-L433 PolarHBondContact O-N 3.13Å
430F98.3Very high97.4Very high80 Ų8039.7 Ų39.735%0.35120%0.201SC..Hα-helixtrans-70.7-36.6177.2-59.4-69.8000112F426 P427 Q428 G432 L433 S434 W450F426-F430 AromaticContact CD1-CE2 3.94Å; F426-F430 HydrophobicContact CD1-CE2 3.94Å; F426-F430 AromaticContact CE1-CE2 3.65Å; F426-F430 HydrophobicContact CE1-CE2 3.65Å; F426-F430 HydrophobicContact CE1-CZ 4Å; F426-F430 HydrophobicContact CZ-CE2 4.44Å; F426-F430 HydrophobicContact CZ-CZ 4.48Å; P427-F430 WeakPolarHBondContact O-CB 3.46Å; P427-F430 PolarHBondContact O-N 2.68Å; Q428-F430 VanDerWaalsContact C-N 3.31Å; Q428-F430 PolarHBondContact O-N 3.31Å; F430-G432 VanDerWaalsContact C-N 3.32Å; F430-G432 PolarHBondContact O-N 2.99Å; F430-L433 PolarHBondContact O-N 3.29Å; F430-S434 WeakPolarHBondContact O-CB 3.43Å; F430-S434 PolarHBondContact O-N 3.07Å; F430-S434 PolarHBondContact O-OG 3.23Å; F430-W450 HydrophobicContact CB-CD2 4.29Å; F430-W450 HydrophobicContact CB-CG 4.41Å; F430-W450 HydrophobicContact CB-CZ2 4.24Å; F430-W450 HydrophobicContact CD2-CH2 4.08Å; F430-W450 HydrophobicContact CD2-CZ2 4.02Å; F430-W450 HydrophobicContact CD2-CZ3 4.36Å; F430-W450 HydrophobicContact CE2-CH2 4.37Å; F430-W450 HydrophobicContact CG-CZ2 4.09Å
431L98Very high97.2Very high0 Ų040.2 Ų40.20%021%0.205CC..Hα-helixtrans-58.1-45.8169.8-69.5175.7000111.2Y371 P427 Q428 S434 G435 M436 Y447 W450Y371-L431 HydrophobicContact CD1-CD1 4.31Å; Y371-L431 HydrophobicContact CG-CB 4.27Å; P427-L431 PolarHBondContact O-N 3.18Å; P427-L431 VanDerWaalsContact O-N 3.12Å; Q428-L431 HydrophobicContact CG-CD1 4.28Å; Q428-L431 PolarHBondContact O-N 3.32Å; L431-S434 WeakPolarHBondContact CA-OG 3.37Å; L431-S434 PolarHBondContact O-N 3.42Å; L431-S434 PolarHBondContact O-OG 3.17Å; L431-G435 PolarHBondContact O-N 2.81Å; L431-M436 HydrophobicContact CB-CB 4.12Å; L431-M436 HydrophobicContact CB-SD 4.05Å; L431-M436 HydrophobicContact CD1-SD 3.9Å; L431-M436 HydrophobicContact CD2-SD 3.74Å; L431-M436 HydrophobicContact CG-SD 4.11Å; L431-M436 VanDerWaalsContact O-CB 3.26Å; L431-M436 WeakPolarHBondContact O-CB 3.15Å; L431-M436 PolarHBondContact O-N 3.26Å; L431-Y447 HydrophobicContact CD2-CD1 3.83Å; L431-Y447 HydrophobicContact CD2-CG 4.13Å; L431-W450 HydrophobicContact CD1-CB 4.13Å; L431-W450 HydrophobicContact CD2-CB 3.55Å; L431-W450 HydrophobicContact CD2-CG 4.28Å; L431-W450 HydrophobicContact CG-CB 3.64Å; L431-W450 HydrophobicContact CG-CG 4.42Å
432G97.8Very high97.2Very high1 Ų143.2 Ų43.21%0.0122%0.22CC..Hα-helixtrans-64.5-46177.300000113.9Y372 Q428 H429 F430 S434 G435Y372-G432 VanDerWaalsContact N-CA 3.31Å; Q428-G432 PolarHBondContact O-N 3.42Å; H429-G432 PolarHBondContact O-N 3.43Å; F430-G432 VanDerWaalsContact C-N 3.32Å; F430-G432 PolarHBondContact O-N 2.99Å; G432-S434 PolarHBondContact O-N 2.83Å; G432-G435 PolarHBondContact O-N 3.1Å
433L97.4Very high97.1Very high109 Ų10942.3 Ų42.357%0.57122%0.215SC*.Hα-helixtrans-63.1-26176.9-72.2170.3000113L367 Y372 H429 F430 G435L367-L433 HydrophobicContact CD2-CD2 4.04Å; Y372-L433 HydrophobicContact CD2-CD2 4.06Å; Y372-L433 HydrophobicContact CD2-CG 3.91Å; Y372-L433 HydrophobicContact CE2-CD1 4.46Å; Y372-L433 HydrophobicContact CE2-CD2 4.02Å; Y372-L433 HydrophobicContact CE2-CG 4.09Å; H429-L433 WeakPolarHBondContact O-CB 3.29Å; H429-L433 VanDerWaalsContact O-CG 3.25Å; H429-L433 WeakPolarHBondContact O-CG 3.23Å; H429-L433 PolarHBondContact O-N 3.13Å; F430-L433 PolarHBondContact O-N 3.29Å; L433-G435 VanDerWaalsContact C-N 3.29Å
434S97.1Very high97.1Very high58 Ų5843.7 Ų43.741%0.40623%0.228SC..THydrogen-bonded Turntrans-89.68.2173.7540000113.4F430 L431 G432 Y447F430-S434 WeakPolarHBondContact O-CB 3.43Å; F430-S434 PolarHBondContact O-N 3.07Å; F430-S434 PolarHBondContact O-OG 3.23Å; L431-S434 WeakPolarHBondContact CA-OG 3.37Å; L431-S434 PolarHBondContact O-N 3.42Å; L431-S434 PolarHBondContact O-OG 3.17Å; G432-S434 PolarHBondContact O-N 2.83Å; S434-Y447 PolarHBondContact O-OH 3.28Å; S434-Y447 VanDerWaalsContact OG-CE1 3.28Å; S434-Y447 WeakPolarHBondContact OG-CE1 3.19Å
435G96.9Very high96.9Very high39 Ų3949.4 Ų49.440%0.40226%0.258SS..THydrogen-bonded Turntrans83.814.7172.100000115.3L431 G432 L433 P437L431-G435 PolarHBondContact O-N 2.81Å; G432-G435 PolarHBondContact O-N 3.1Å; L433-G435 VanDerWaalsContact C-N 3.29Å; G435-P437 VanDerWaalsContact O-CD 3.28Å; G435-P437 WeakPolarHBondContact O-CD 3.48Å
436M97.8Very high96.9Very high2 Ų252.6 Ų52.61%0.0129%0.288CS..PPolyproline II helixtrans-65.5118.5177.6-172.8179.5176.800110.2T370 Y371 L431 Y443 Y447 N451T370-M436 CarbonylContact C-O 3.42Å; T370-M436 VanDerWaalsContact CA-O 3.26Å; T370-M436 WeakPolarHBondContact CA-O 3.32Å; T370-M436 WeakPolarHBondContact CB-O 3.36Å; Y371-M436 HydrophobicContact CD2-CB 4.11Å; Y371-M436 HydrophobicContact CD2-CE 4.2Å; Y371-M436 HydrophobicContact CD2-CG 3.68Å; Y371-M436 HydrophobicContact CD2-SD 3.83Å; Y371-M436 HydrophobicContact CE2-CE 3.54Å; Y371-M436 HydrophobicContact CE2-CG 3.89Å; Y371-M436 HydrophobicContact CE2-SD 3.8Å; Y371-M436 HydrophobicContact CG-SD 4.35Å; Y371-M436 PolarHBondContact N-O 3.11Å; L431-M436 HydrophobicContact CB-CB 4.12Å; L431-M436 HydrophobicContact CB-SD 4.05Å; L431-M436 HydrophobicContact CD1-SD 3.9Å; L431-M436 HydrophobicContact CD2-SD 3.74Å; L431-M436 HydrophobicContact CG-SD 4.11Å; L431-M436 VanDerWaalsContact O-CB 3.26Å; L431-M436 WeakPolarHBondContact O-CB 3.15Å; L431-M436 PolarHBondContact O-N 3.26Å; M436-Y443 HydrophobicContact CE-CD1 3.75Å; M436-Y443 HydrophobicContact CE-CG 3.78Å; M436-Y447 HydrophobicContact CB-CD1 4.04Å; M436-Y447 HydrophobicContact CB-CD2 4.36Å; M436-Y447 HydrophobicContact CB-CE1 3.88Å; M436-Y447 HydrophobicContact CB-CE2 4.2Å; M436-Y447 HydrophobicContact CB-CG 4.27Å; M436-Y447 HydrophobicContact CG-CD2 4.17Å; M436-Y447 HydrophobicContact CG-CE2 4.32Å; M436-Y447 HydrophobicContact CG-CG 4.27Å; M436-Y447 HydrophobicContact SD-CD2 4.42Å; M436-Y447 HydrophobicContact SD-CG 4.11Å; M436-N451 WeakPolarHBondContact CE-ND2 3.32Å; M436-N451 PolarHBondContact SD-ND2 3.17Å; M436-N451 VanDerWaalsContact SD-ND2 3.45Å
437P97.4Very high96.8Very high53 Ų5349.6 Ų49.634%0.34427%0.274SS..BIsolated β-bridgetrans-76.7150.3-179.732.7-35.8000111.5D369 Y371 G435 Y440D369-P437 CarbonylContact O-C 3.59Å; D369-P437 WeakPolarHBondContact O-CA 3.12Å; Y371-P437 WeakPolarHBondContact CE2-O 3.13Å; G435-P437 VanDerWaalsContact O-CD 3.28Å; G435-P437 WeakPolarHBondContact O-CD 3.48Å; P437-Y440 HydrophobicContact CB-CD2 3.79Å; P437-Y440 HydrophobicContact CB-CE2 3.6Å; P437-Y440 HydrophobicContact CG-CD2 3.56Å; P437-Y440 HydrophobicContact CG-CE2 3.61Å; P437-Y440 HydrophobicContact CG-CG 4.28Å
438R96.5Very high96.8Very high47 Ų4750.7 Ų50.718%0.17728%0.281CS..SBendtrans-80.9159.5176.673.7-173.7-179.2162.7-4.2111.8D369 V374 Y440D369-R438 HydrophobicContact CB-CG 4.42Å; D369-R438 VanDerWaalsContact O-CG 3.27Å; D369-R438 WeakPolarHBondContact O-CG 3.49Å; D369-R438 PolarHBondContact O-N 3.27Å; D369-R438 IonicContact OD1-CZ 2.79Å; D369-R438 IonicContact OD1-NE 3.74Å; D369-R438 PolarHBondContact OD1-NE 2.61Å; D369-R438 IonicContact OD1-NH2 2.74Å; D369-R438 PolarHBondContact OD1-NH2 3.32Å; V374-R438 HydrophobicContact CG2-CB 3.86Å; R438-Y440 VanDerWaalsContact C-N 3.34Å; R438-Y440 VanDerWaalsContact O-CD2 3.28Å; R438-Y440 WeakPolarHBondContact O-CD2 3.3Å; R438-Y440 PolarHBondContact O-N 3.34Å
439R94.6Very high96.7Very high65 Ų6555.5 Ų55.525%0.24531%0.31CS..SBendtrans63.930.8176.2-55174.4-173.4-177.22.9114.9N55N55-R439 PolarHBondContact OD1-O 2.99Å
440Y94.9Very high96.7Very high141 Ų14159.4 Ų59.455%0.55332%0.324SS*.  trans-104.4139.8165.2-72-99.1000109.2Y54 P437 R438Y54-Y440 VanDerWaalsContact CE1-C 3.4Å; Y54-Y440 VanDerWaalsContact CE1-O 3.22Å; Y54-Y440 WeakPolarHBondContact CE1-O 3.35Å; Y54-Y440 PolarHBondContact OH-O 3.04Å; P437-Y440 HydrophobicContact CB-CD2 3.79Å; P437-Y440 HydrophobicContact CB-CE2 3.6Å; P437-Y440 HydrophobicContact CG-CD2 3.56Å; P437-Y440 HydrophobicContact CG-CE2 3.61Å; P437-Y440 HydrophobicContact CG-CG 4.28Å; R438-Y440 VanDerWaalsContact C-N 3.34Å; R438-Y440 VanDerWaalsContact O-CD2 3.28Å; R438-Y440 WeakPolarHBondContact O-CD2 3.3Å; R438-Y440 PolarHBondContact O-N 3.34Å
441S95.3Very high96.7Very high12 Ų1255.6 Ų55.68%0.08431%0.308CS..SBendtrans-76.7-28175.340.80000112.3D51D51-S441 WeakPolarHBondContact CB-OG 3.21Å; D51-S441 PolarHBondContact OD1-OG 3Å
442D96Very high96.7Very high68 Ų6859.5 Ų59.536%0.36433%0.328SS..  trans-128.2162.1-179.3-163.69.9000111.8G45G45-D442 PolarHBondContact N-OD1 3.07Å
443Y96.3Very high96.7Very high11 Ų1162.4 Ų62.44%0.04334%0.343CS..  trans-152152.8-177.459.1-96.3000113.2L41 Q43 P44 M436 N451L41-Y443 HydrophobicContact CB-CE1 4.21Å; L41-Y443 HydrophobicContact CD2-CD1 3.94Å; L41-Y443 HydrophobicContact CD2-CE1 4.11Å; L41-Y443 VanDerWaalsContact O-CE1 3.25Å; L41-Y443 WeakPolarHBondContact O-CE1 3.41Å; L41-Y443 PolarHBondContact O-OH 2.96Å; Q43-Y443 VanDerWaalsContact C-OH 3.29Å; Q43-Y443 VanDerWaalsContact CA-OH 3.32Å; Q43-Y443 WeakPolarHBondContact CA-OH 3.25Å; Q43-Y443 PolarHBondContact N-OH 2.83Å; P44-Y443 HydrophobicContact CG-CD2 4.37Å; P44-Y443 HydrophobicContact CG-CE2 3.77Å; M436-Y443 HydrophobicContact CE-CD1 3.75Å; M436-Y443 HydrophobicContact CE-CG 3.78Å; Y443-N451 HydrophobicContact CE1-CB 4.06Å; Y443-N451 HydrophobicContact CE2-CB 4.17Å; Y443-N451 VanDerWaalsContact OH-CB 3.23Å; Y443-N451 WeakPolarHBondContact OH-CB 3.42Å
444P96.3Very high96.8Very high86 Ų8657.2 Ų57.256%0.55832%0.315SS*.  trans-59.7144.1174.1-2532.5000113.9A446 Y447P444-A446 PolarHBondContact O-N 3.17Å; P444-Y447 HydrophobicContact CB-CD2 4.28Å; P444-Y447 HydrophobicContact CB-CE2 4.36Å; P444-Y447 HydrophobicContact CG-CD2 4.32Å; P444-Y447 HydrophobicContact CG-CE2 4.11Å; P444-Y447 PolarHBondContact O-N 2.81Å
445D95.1Very high96.8Very high123 Ų12354.7 Ų54.766%0.65830%0.298SS*.G310 helixtrans-50.6-25.5-177.6-65.7-4.5000115P44 Y447 T448P44-D445 WeakPolarHBondContact CB-OD1 3.25Å; P44-D445 VanDerWaalsContact CG-OD1 3.31Å; P44-D445 WeakPolarHBondContact CG-OD1 3.25Å; D445-Y447 PolarHBondContact O-N 3.33Å; D445-Y447 VanDerWaalsContact O-N 3.15Å; D445-T448 WeakPolarHBondContact CA-OG1 3.36Å; D445-T448 VanDerWaalsContact O-CB 3.25Å; D445-T448 WeakPolarHBondContact O-CB 3.46Å; D445-T448 PolarHBondContact O-N 3.25Å; D445-T448 VanDerWaalsContact O-N 3.1Å; D445-T448 PolarHBondContact O-OG1 3.3Å
446A96.5Very high96.9Very high87 Ų8756.1 Ų56.172%0.71930%0.299SS*.G310 helixtrans-56.5-26.5175.300000113.8P444P444-A446 PolarHBondContact O-N 3.17Å
447Y97.3Very high96.9Very high39 Ų3956 Ų5615%0.15330%0.298CS..G310 helixtrans-92.9-3.4-179.3-58.1-58.8000114L431 S434 M436 P444 D445 T449 W450 N451L431-Y447 HydrophobicContact CD2-CD1 3.83Å; L431-Y447 HydrophobicContact CD2-CG 4.13Å; S434-Y447 PolarHBondContact O-OH 3.28Å; S434-Y447 VanDerWaalsContact OG-CE1 3.28Å; S434-Y447 WeakPolarHBondContact OG-CE1 3.19Å; M436-Y447 HydrophobicContact CB-CD1 4.04Å; M436-Y447 HydrophobicContact CB-CD2 4.36Å; M436-Y447 HydrophobicContact CB-CE1 3.88Å; M436-Y447 HydrophobicContact CB-CE2 4.2Å; M436-Y447 HydrophobicContact CB-CG 4.27Å; M436-Y447 HydrophobicContact CG-CD2 4.17Å; M436-Y447 HydrophobicContact CG-CE2 4.32Å; M436-Y447 HydrophobicContact CG-CG 4.27Å; M436-Y447 HydrophobicContact SD-CD2 4.42Å; M436-Y447 HydrophobicContact SD-CG 4.11Å; P444-Y447 HydrophobicContact CB-CD2 4.28Å; P444-Y447 HydrophobicContact CB-CE2 4.36Å; P444-Y447 HydrophobicContact CG-CD2 4.32Å; P444-Y447 HydrophobicContact CG-CE2 4.11Å; P444-Y447 PolarHBondContact O-N 2.81Å; D445-Y447 PolarHBondContact O-N 3.33Å; D445-Y447 VanDerWaalsContact O-N 3.15Å; Y447-T449 PolarHBondContact O-N 3.34Å; Y447-W450 PolarHBondContact O-N 3.47Å; Y447-N451 PolarHBondContact O-N 3.17Å; Y447-N451 PolarHBondContact O-ND2 3.32Å
448T97Very high96.9Very high27 Ų2754 Ų5417%0.16629%0.285CS..Hα-helixtrans-57.8-47-171.1-55.40000113.2P44 D445 W450 N451 I452P44-T448 HydrophobicContact CG-CG2 4.37Å; P44-T448 WeakPolarHBondContact CG-OG1 3.09Å; D445-T448 WeakPolarHBondContact CA-OG1 3.36Å; D445-T448 VanDerWaalsContact O-CB 3.25Å; D445-T448 WeakPolarHBondContact O-CB 3.46Å; D445-T448 PolarHBondContact O-N 3.25Å; D445-T448 VanDerWaalsContact O-N 3.1Å; D445-T448 PolarHBondContact O-OG1 3.3Å; T448-W450 VanDerWaalsContact C-N 3.35Å; T448-W450 PolarHBondContact O-N 3.13Å; T448-N451 PolarHBondContact O-N 3.03Å; T448-N451 VanDerWaalsContact O-N 3.17Å; T448-I452 HydrophobicContact CG2-CD1 3.57Å; T448-I452 HydrophobicContact CG2-CG1 4.1Å; T448-I452 WeakPolarHBondContact O-CG1 3.33Å; T448-I452 PolarHBondContact O-N 2.73Å
449T97.2Very high97Very high104 Ų10456.6 Ų56.664%0.63830%0.298SS*.Hα-helixtrans-57.2-46.8-175.3-53.60000112.3Y447 L453Y447-T449 PolarHBondContact O-N 3.34Å; T449-L453 PolarHBondContact O-N 3.21Å
450W98Very high97.2Very high95 Ų9555.8 Ų55.836%0.3630%0.298SS..Hα-helixtrans-74.1-32.2-179.4-66.3128.5000112.6P427 F430 L431 Y447 T448 L453 S454P427-W450 HydrophobicContact CB-CB 4.17Å; P427-W450 HydrophobicContact CB-CD2 4.37Å; P427-W450 HydrophobicContact CB-CE3 3.78Å; P427-W450 HydrophobicContact CG-CE3 4.3Å; F430-W450 HydrophobicContact CB-CD2 4.29Å; F430-W450 HydrophobicContact CB-CG 4.41Å; F430-W450 HydrophobicContact CB-CZ2 4.24Å; F430-W450 HydrophobicContact CD2-CH2 4.08Å; F430-W450 HydrophobicContact CD2-CZ2 4.02Å; F430-W450 HydrophobicContact CD2-CZ3 4.36Å; F430-W450 HydrophobicContact CE2-CH2 4.37Å; F430-W450 HydrophobicContact CG-CZ2 4.09Å; L431-W450 HydrophobicContact CD1-CB 4.13Å; L431-W450 HydrophobicContact CD2-CB 3.55Å; L431-W450 HydrophobicContact CD2-CG 4.28Å; L431-W450 HydrophobicContact CG-CB 3.64Å; L431-W450 HydrophobicContact CG-CG 4.42Å; Y447-W450 PolarHBondContact O-N 3.47Å; T448-W450 VanDerWaalsContact C-N 3.35Å; T448-W450 PolarHBondContact O-N 3.13Å; W450-L453 HydrophobicContact CE3-CD2 4.06Å; W450-L453 HydrophobicContact CZ3-CD2 3.97Å; W450-S454 VanDerWaalsContact O-CB 3.25Å; W450-S454 WeakPolarHBondContact O-CB 3.43Å; W450-S454 PolarHBondContact O-N 3.5Å
451N98Very high97.3Very high0 Ų049.9 Ų49.90%028%0.278CS..Hα-helixtrans-68.8-42.2175.1-91.5-57.3000112.8R38 L41 M436 Y443 Y447 T448 L453 S454 S455R38-N451 PolarHBondContact NH2-O 3.46Å; R38-N451 PolarHBondContact NH2-OD1 3.16Å; R38-N451 VanDerWaalsContact NH2-OD1 3.11Å; L41-N451 WeakPolarHBondContact O-CB 3.34Å; M436-N451 WeakPolarHBondContact CE-ND2 3.32Å; M436-N451 PolarHBondContact SD-ND2 3.17Å; M436-N451 VanDerWaalsContact SD-ND2 3.45Å; Y443-N451 HydrophobicContact CE1-CB 4.06Å; Y443-N451 HydrophobicContact CE2-CB 4.17Å; Y443-N451 VanDerWaalsContact OH-CB 3.23Å; Y443-N451 WeakPolarHBondContact OH-CB 3.42Å; Y447-N451 PolarHBondContact O-N 3.17Å; Y447-N451 PolarHBondContact O-ND2 3.32Å; T448-N451 PolarHBondContact O-N 3.03Å; T448-N451 VanDerWaalsContact O-N 3.17Å; N451-L453 VanDerWaalsContact C-N 3.34Å; N451-L453 PolarHBondContact O-N 2.89Å; N451-S454 PolarHBondContact O-N 3.04Å; N451-S455 WeakPolarHBondContact O-CB 3.42Å; N451-S455 PolarHBondContact O-N 3.03Å; N451-S455 PolarHBondContact O-OG 2.94Å; N451-S455 VanDerWaalsContact O-OG 3.12Å
452I97.8Very high97.4Very high83 Ų8352 Ų5243%0.42629%0.287SS..Hα-helixtrans-57.7-49.3173.1-70170.7000109.9G42 T448 S454 S455 V456G42-I452 WeakPolarHBondContact O-CG1 3.35Å; T448-I452 HydrophobicContact CG2-CD1 3.57Å; T448-I452 HydrophobicContact CG2-CG1 4.1Å; T448-I452 WeakPolarHBondContact O-CG1 3.33Å; T448-I452 PolarHBondContact O-N 2.73Å; I452-S454 VanDerWaalsContact C-N 3.32Å; I452-S454 PolarHBondContact O-N 2.85Å; I452-S455 PolarHBondContact O-N 3.07Å; I452-V456 HydrophobicContact CG2-CG2 4.37Å; I452-V456 WeakPolarHBondContact O-CG2 3.34Å; I452-V456 PolarHBondContact O-N 2.82Å
453L97.9Very high97.5Very high61 Ų6152.2 Ų52.232%0.31929%0.292SS..Hα-helixtrans-61-43.2179.9-170.663.4000111.6L423 P427 T449 W450 N451 S455 V456 G457L423-L453 HydrophobicContact CD2-CD1 4.07Å; L423-L453 HydrophobicContact CD2-CG 4.38Å; P427-L453 HydrophobicContact CG-CB 4.28Å; P427-L453 HydrophobicContact CG-CD2 3.65Å; P427-L453 HydrophobicContact CG-CG 3.95Å; T449-L453 PolarHBondContact O-N 3.21Å; W450-L453 HydrophobicContact CE3-CD2 4.06Å; W450-L453 HydrophobicContact CZ3-CD2 3.97Å; N451-L453 VanDerWaalsContact C-N 3.34Å; N451-L453 PolarHBondContact O-N 2.89Å; L453-S455 PolarHBondContact O-N 3.41Å; L453-V456 PolarHBondContact O-N 3.03Å; L453-G457 PolarHBondContact O-N 3.2Å
454S98.3Very high97.5Very high0 Ų051.7 Ų51.70%029%0.289CS..Hα-helixtrans-61.6-42176.5-177.20000112R38 L423 T424 Q428 W450 N451 I452 G457 S458R38-S454 VanDerWaalsContact CZ-OG 3.23Å; R38-S454 VanDerWaalsContact NH2-CB 3.34Å; R38-S454 PolarHBondContact NH2-OG 2.97Å; L423-S454 WeakPolarHBondContact O-CA 3.15Å; T424-S454 WeakPolarHBondContact CA-O 3.47Å; T424-S454 VanDerWaalsContact O-CB 3.24Å; T424-S454 WeakPolarHBondContact O-CB 3.42Å; T424-S454 PolarHBondContact O-OG 2.82Å; Q428-S454 PolarHBondContact NE2-OG 3.29Å; W450-S454 VanDerWaalsContact O-CB 3.25Å; W450-S454 WeakPolarHBondContact O-CB 3.43Å; W450-S454 PolarHBondContact O-N 3.5Å; N451-S454 PolarHBondContact O-N 3.04Å; I452-S454 VanDerWaalsContact C-N 3.32Å; I452-S454 PolarHBondContact O-N 2.85Å; S454-G457 PolarHBondContact O-N 2.58Å; S454-S458 PolarHBondContact O-N 3.09Å; S454-S458 VanDerWaalsContact O-N 3.14Å
455S98.2Very high97.6Very high5 Ų549.1 Ų49.14%0.03527%0.272CS..Hα-helixtrans-70.2-39.7177.7-63.50000112.6R38 N451 I452 L453 G457 S458 F459R38-S455 PolarHBondContact NE-OG 2.88Å; R38-S455 PolarHBondContact NH2-OG 3.13Å; R38-S455 WeakPolarHBondContact O-CB 3.4Å; R38-S455 PolarHBondContact O-OG 3.35Å; N451-S455 WeakPolarHBondContact O-CB 3.42Å; N451-S455 PolarHBondContact O-N 3.03Å; N451-S455 PolarHBondContact O-OG 2.94Å; N451-S455 VanDerWaalsContact O-OG 3.12Å; I452-S455 PolarHBondContact O-N 3.07Å; L453-S455 PolarHBondContact O-N 3.41Å; S455-G457 VanDerWaalsContact C-N 3.31Å; S455-G457 PolarHBondContact O-N 3.4Å; S455-S458 WeakPolarHBondContact O-CB 3.33Å; S455-S458 PolarHBondContact O-N 3.43Å; S455-S458 VanDerWaalsContact O-N 3.09Å; S455-F459 WeakPolarHBondContact O-CD2 3.25Å; S455-F459 PolarHBondContact O-N 3.29Å; S455-F459 VanDerWaalsContact O-N 3.09Å
456V98.3Very high97.7Very high69 Ų6948.6 Ų48.642%0.41827%0.267SS..Hα-helixtrans-58.4-44171.8170.20000111I452 L453 S458 F459 I460I452-V456 HydrophobicContact CG2-CG2 4.37Å; I452-V456 WeakPolarHBondContact O-CG2 3.34Å; I452-V456 PolarHBondContact O-N 2.82Å; L453-V456 PolarHBondContact O-N 3.03Å; V456-S458 VanDerWaalsContact C-N 3.26Å; V456-S458 PolarHBondContact O-N 3.26Å; V456-F459 PolarHBondContact O-N 2.68Å; V456-I460 HydrophobicContact CG1-CD1 4.02Å; V456-I460 WeakPolarHBondContact O-CG1 3.38Å; V456-I460 PolarHBondContact O-N 3.19Å
457G98.3Very high97.8Very high0 Ų045.9 Ų45.90%024%0.24CC..Hα-helixtrans-57.4-38.9174.300000113.1G420 T424 L453 S454 S455 I460 S461G420-G457 CarbonylContact C-O 3.25Å; G420-G457 WeakPolarHBondContact CA-O 3.2Å; G420-G457 CarbonylContact O-C 3.48Å; G420-G457 WeakPolarHBondContact O-CA 3.22Å; T424-G457 WeakPolarHBondContact OG1-CA 3.43Å; T424-G457 PolarHBondContact OG1-O 2.87Å; L453-G457 PolarHBondContact O-N 3.2Å; S454-G457 PolarHBondContact O-N 2.58Å; S455-G457 VanDerWaalsContact C-N 3.31Å; S455-G457 PolarHBondContact O-N 3.4Å; G457-I460 PolarHBondContact O-N 3.42Å; G457-S461 PolarHBondContact O-N 3.13Å; G457-S461 PolarHBondContact O-OG 3.27Å
458S97.8Very high97.8Very high10 Ų1044.8 Ų44.87%0.0724%0.237CC..Hα-helixtrans-66.6-42.2178.8-173.30000111.7T424 S454 S455 V456 I460 S461 L462T424-S458 WeakPolarHBondContact OG1-CA 3.42Å; T424-S458 PolarHBondContact OG1-N 2.97Å; S454-S458 PolarHBondContact O-N 3.09Å; S454-S458 VanDerWaalsContact O-N 3.14Å; S455-S458 WeakPolarHBondContact O-CB 3.33Å; S455-S458 PolarHBondContact O-N 3.43Å; S455-S458 VanDerWaalsContact O-N 3.09Å; V456-S458 VanDerWaalsContact C-N 3.26Å; V456-S458 PolarHBondContact O-N 3.26Å; S458-I460 PolarHBondContact O-N 3.46Å; S458-S461 WeakPolarHBondContact O-CB 3.43Å; S458-S461 PolarHBondContact O-N 3.41Å; S458-S461 VanDerWaalsContact O-N 3.13Å; S458-L462 PolarHBondContact O-N 3.36Å
459F97.6Very high97.8Very high102 Ų10247.6 Ų47.645%0.44725%0.25SC..Hα-helixtrans-65.8-35.5173.8-73-69.4000112.9L35 S455 V456 S461 L462 T463L35-F459 HydrophobicContact CD2-CD1 4.2Å; L35-F459 HydrophobicContact CD2-CE1 4.34Å; S455-F459 WeakPolarHBondContact O-CD2 3.25Å; S455-F459 PolarHBondContact O-N 3.29Å; S455-F459 VanDerWaalsContact O-N 3.09Å; V456-F459 PolarHBondContact O-N 2.68Å; F459-S461 VanDerWaalsContact C-N 3.32Å; F459-L462 WeakPolarHBondContact O-CB 3.48Å; F459-L462 PolarHBondContact O-N 2.85Å; F459-T463 PolarHBondContact O-N 3.22Å
460I98.4Very high97.8Very high49 Ų4946.4 Ų46.425%0.25124%0.236SC..Hα-helixtrans-62.6-42.8170.8-66.7166.5000109.9I416 L423 V456 G457 S458 L462 T463 A464I416-I460 HydrophobicContact CG2-CG2 3.86Å; L423-I460 HydrophobicContact CD1-CD1 3.75Å; V456-I460 HydrophobicContact CG1-CD1 4.02Å; V456-I460 WeakPolarHBondContact O-CG1 3.38Å; V456-I460 PolarHBondContact O-N 3.19Å; G457-I460 PolarHBondContact O-N 3.42Å; S458-I460 PolarHBondContact O-N 3.46Å; I460-L462 VanDerWaalsContact C-N 3.29Å; I460-L462 PolarHBondContact O-N 3.43Å; I460-T463 WeakPolarHBondContact O-CB 3.27Å; I460-T463 PolarHBondContact O-N 3.25Å; I460-T463 PolarHBondContact O-OG1 3.22Å; I460-A464 PolarHBondContact O-N 3.3Å
461S97.2Very high97.8Very high17 Ų1742 Ų4212%0.11922%0.219CC..Hα-helixtrans-63.5-34.2178.3-53.10000112.2G420 V421 G457 S458 F459 T463 A464 V465G420-S461 WeakPolarHBondContact CA-OG 3.4Å; V421-S461 PolarHBondContact N-OG 3.31Å; G457-S461 PolarHBondContact O-N 3.13Å; G457-S461 PolarHBondContact O-OG 3.27Å; S458-S461 WeakPolarHBondContact O-CB 3.43Å; S458-S461 PolarHBondContact O-N 3.41Å; S458-S461 VanDerWaalsContact O-N 3.13Å; F459-S461 VanDerWaalsContact C-N 3.32Å; S461-T463 VanDerWaalsContact C-N 3.32Å; S461-T463 PolarHBondContact O-N 3.33Å; S461-A464 WeakPolarHBondContact O-CB 3.45Å; S461-A464 PolarHBondContact O-N 2.96Å; S461-A464 VanDerWaalsContact O-N 3.15Å; S461-V465 PolarHBondContact O-N 3.16Å; S461-V465 VanDerWaalsContact O-N 3.09Å
462L97.4Very high97.8Very high55 Ų5544.5 Ų44.529%0.28823%0.232SC..Hα-helixtrans-59-41.8170.7172.760.5000111.9L35 S458 F459 I460 A464 V465 M466L35-L462 HydrophobicContact CD1-CB 4.19Å; L35-L462 HydrophobicContact CD1-CD1 3.83Å; L35-L462 HydrophobicContact CD1-CD2 3.73Å; L35-L462 HydrophobicContact CD1-CG 4.1Å; L35-L462 HydrophobicContact CD2-CB 4.15Å; L35-L462 HydrophobicContact CD2-CD2 4.37Å; S458-L462 PolarHBondContact O-N 3.36Å; F459-L462 WeakPolarHBondContact O-CB 3.48Å; F459-L462 PolarHBondContact O-N 2.85Å; I460-L462 VanDerWaalsContact C-N 3.29Å; I460-L462 PolarHBondContact O-N 3.43Å; L462-A464 PolarHBondContact O-N 2.79Å; L462-V465 PolarHBondContact O-N 3.22Å; L462-V465 VanDerWaalsContact O-N 3.1Å; L462-M466 HydrophobicContact CD1-CG 4.21Å; L462-M466 HydrophobicContact CD1-SD 4.49Å; L462-M466 WeakPolarHBondContact O-CG 3.43Å; L462-M466 PolarHBondContact O-N 3.34Å
463T97.9Very high97.8Very high74 Ų7448.3 Ų48.345%0.45424%0.241SC..Hα-helixtrans-61.6-33.9177.169.30000112.1I416 F459 I460 S461 M466 L467I416-T463 WeakPolarHBondContact CG2-OG1 3.3Å; F459-T463 PolarHBondContact O-N 3.22Å; I460-T463 WeakPolarHBondContact O-CB 3.27Å; I460-T463 PolarHBondContact O-N 3.25Å; I460-T463 PolarHBondContact O-OG1 3.22Å; S461-T463 VanDerWaalsContact C-N 3.32Å; S461-T463 PolarHBondContact O-N 3.33Å; T463-M466 PolarHBondContact O-N 3.41Å; T463-L467 WeakPolarHBondContact O-CB 3.1Å; T463-L467 PolarHBondContact O-N 3.41Å
464A97.8Very high97.8Very high0 Ų046.9 Ų46.90%023%0.233CC..Hα-helixtrans-66.4-43172.600000112H413 I416 M417 I460 S461 L462 M466 L467 M468H413-A464 PolarHBondContact CD2-O 2.64Å; H413-A464 PolarHBondContact NE2-O 2.75Å; I416-A464 HydrophobicContact CB-CB 4.24Å; I416-A464 HydrophobicContact CG2-CB 3.86Å; M417-A464 HydrophobicContact CB-CB 3.83Å; M417-A464 HydrophobicContact CE-CB 3.7Å; M417-A464 HydrophobicContact SD-CB 4.15Å; I460-A464 PolarHBondContact O-N 3.3Å; S461-A464 WeakPolarHBondContact O-CB 3.45Å; S461-A464 PolarHBondContact O-N 2.96Å; S461-A464 VanDerWaalsContact O-N 3.15Å; L462-A464 PolarHBondContact O-N 2.79Å; A464-M466 VanDerWaalsContact C-N 3.33Å; A464-M466 PolarHBondContact O-N 3.11Å; A464-L467 WeakPolarHBondContact O-CB 3.38Å; A464-L467 PolarHBondContact O-N 3.03Å; A464-L467 VanDerWaalsContact O-N 3.16Å; A464-M468 PolarHBondContact O-N 3.19Å
465V97Very high97.7Very high31 Ų3146.9 Ų46.919%0.18823%0.233CC..Hα-helixtrans-59.7-43.4175.5175.60000111.4T31 M417 S461 L462 L467 M468 I469T31-V465 HydrophobicContact CG2-CG2 4.39Å; M417-V465 HydrophobicContact CE-CG2 4.16Å; S461-V465 PolarHBondContact O-N 3.16Å; S461-V465 VanDerWaalsContact O-N 3.09Å; L462-V465 PolarHBondContact O-N 3.22Å; L462-V465 VanDerWaalsContact O-N 3.1Å; V465-L467 VanDerWaalsContact C-N 3.34Å; V465-L467 PolarHBondContact O-N 3.47Å; V465-M468 WeakPolarHBondContact O-CB 3.36Å; V465-M468 PolarHBondContact O-N 3.19Å; V465-I469 PolarHBondContact O-N 3Å
466M97.7Very high97.6Very high112 Ų11251.1 Ų51.155%0.55225%0.251SS*.Hα-helixtrans-63.8-39.9175.9-64.5-54.4-66.300112L462 T463 A464 M468 I469 F470L462-M466 HydrophobicContact CD1-CG 4.21Å; L462-M466 HydrophobicContact CD1-SD 4.49Å; L462-M466 WeakPolarHBondContact O-CG 3.43Å; L462-M466 PolarHBondContact O-N 3.34Å; T463-M466 PolarHBondContact O-N 3.41Å; A464-M466 VanDerWaalsContact C-N 3.33Å; A464-M466 PolarHBondContact O-N 3.11Å; M466-M468 VanDerWaalsContact C-N 3.32Å; M466-M468 PolarHBondContact O-N 3.32Å; M466-I469 PolarHBondContact O-N 3.03Å; M466-I469 HydrophobicContact SD-CD1 4.4Å; M466-F470 PolarHBondContact O-N 3.44Å
467L98.1Very high97.6Very high30 Ų3050.7 Ų50.716%0.15726%0.255CS..Hα-helixtrans-63.9-36.8175.1-179.159.3000112I412 H413 I416 T463 A464 V465 F470 M471I412-L467 HydrophobicContact CB-CD2 4.27Å; I412-L467 HydrophobicContact CG2-CD2 3.73Å; H413-L467 HydrophobicContact CB-CD2 3.8Å; H413-L467 HydrophobicContact CB-CG 4.19Å; I416-L467 HydrophobicContact CD1-CD2 4.15Å; T463-L467 WeakPolarHBondContact O-CB 3.1Å; T463-L467 PolarHBondContact O-N 3.41Å; A464-L467 WeakPolarHBondContact O-CB 3.38Å; A464-L467 PolarHBondContact O-N 3.03Å; A464-L467 VanDerWaalsContact O-N 3.16Å; V465-L467 VanDerWaalsContact C-N 3.34Å; V465-L467 PolarHBondContact O-N 3.47Å; L467-F470 HydrophobicContact CD1-CD1 3.95Å; L467-F470 WeakPolarHBondContact O-CB 3.21Å; L467-F470 PolarHBondContact O-N 2.94Å; L467-M471 HydrophobicContact CD1-CG 4.42Å; L467-M471 HydrophobicContact CG-CG 4.46Å; L467-M471 HydrophobicContact CG-SD 4.35Å; L467-M471 WeakPolarHBondContact O-CB 3.16Å; L467-M471 VanDerWaalsContact O-CG 3.28Å; L467-M471 WeakPolarHBondContact O-CG 3.25Å; L467-M471 PolarHBondContact O-N 3.19Å
468M97.4Very high97.5Very high17 Ų1753.1 Ų53.18%0.08427%0.271CS..Hα-helixtrans-61-46.8174.2179.960.395.700111.6M390 F393 H413 A464 V465 M466 F470 M471 I472M390-M468 HydrophobicContact CE-CE 4.44Å; M390-M468 HydrophobicContact SD-CE 3.18Å; M390-M468 WeakPolarHBondContact SD-CE 3.4Å; F393-M468 HydrophobicContact CD1-CE 3.93Å; F393-M468 HydrophobicContact CD1-SD 4.18Å; F393-M468 HydrophobicContact CE1-CE 4.22Å; F393-M468 HydrophobicContact CE1-SD 3.85Å; H413-M468 WeakPolarHBondContact CE1-CE 3.3Å; A464-M468 PolarHBondContact O-N 3.19Å; V465-M468 WeakPolarHBondContact O-CB 3.36Å; V465-M468 PolarHBondContact O-N 3.19Å; M466-M468 VanDerWaalsContact C-N 3.32Å; M466-M468 PolarHBondContact O-N 3.32Å; M468-F470 VanDerWaalsContact C-N 3.29Å; M468-F470 PolarHBondContact O-N 3.2Å; M468-M471 PolarHBondContact O-N 3.25Å; M468-I472 HydrophobicContact CG-CD1 4.14Å; M468-I472 WeakPolarHBondContact O-CG1 3.49Å; M468-I472 PolarHBondContact O-N 3.38Å; M468-I472 HydrophobicContact SD-CD1 4.27Å; M468-I472 HydrophobicContact SD-CG1 4.33Å
469I97.5Very high97.3Very high85 Ų8559 Ų5944%0.43630%0.296SS..Hα-helixtrans-59.5-44.4177.3-63.3169.5000110.1V465 M466 I472 W473V465-I469 PolarHBondContact O-N 3Å; M466-I469 PolarHBondContact O-N 3.03Å; M466-I469 HydrophobicContact SD-CD1 4.4Å; I469-I472 PolarHBondContact O-N 3.09Å; I469-W473 PolarHBondContact O-N 2.84Å
470F98.3Very high97.1Very high79 Ų7957.6 Ų57.635%0.34629%0.287SS..Hα-helixtrans-59.7-45.9175.1170.7-96.8000112.3Y409 M466 L467 M468 I472 W473 E474Y409-F470 HydrophobicContact CD2-CE1 4.14Å; Y409-F470 HydrophobicContact CE1-CE1 4.34Å; Y409-F470 AromaticContact CE2-CE1 3.97Å; Y409-F470 HydrophobicContact CE2-CE1 3.97Å; Y409-F470 HydrophobicContact CG-CE1 4.43Å; M466-F470 PolarHBondContact O-N 3.44Å; L467-F470 HydrophobicContact CD1-CD1 3.95Å; L467-F470 WeakPolarHBondContact O-CB 3.21Å; L467-F470 PolarHBondContact O-N 2.94Å; M468-F470 VanDerWaalsContact C-N 3.29Å; M468-F470 PolarHBondContact O-N 3.2Å; F470-I472 VanDerWaalsContact C-N 3.33Å; F470-I472 PolarHBondContact O-N 3.01Å; F470-W473 AromaticContact CD2-CE3 3.86Å; F470-W473 HydrophobicContact CD2-CE3 3.86Å; F470-W473 HydrophobicContact CD2-CZ3 4.05Å; F470-W473 AromaticContact CE2-CE3 3.87Å; F470-W473 HydrophobicContact CE2-CE3 3.87Å; F470-W473 AromaticContact CE2-CZ3 3.61Å; F470-W473 HydrophobicContact CE2-CZ3 3.61Å; F470-W473 HydrophobicContact CZ-CZ3 4.45Å; F470-W473 PolarHBondContact O-N 3.25Å; F470-E474 HydrophobicContact CE1-CB 4.34Å; F470-E474 HydrophobicContact CE1-CG 4.41Å; F470-E474 HydrophobicContact CZ-CB 4.36Å; F470-E474 HydrophobicContact CZ-CG 4.28Å; F470-E474 WeakPolarHBondContact O-CB 3.32Å; F470-E474 PolarHBondContact O-N 3.06Å
471M98Very high96.8Very high3 Ų362.4 Ų62.42%0.01531%0.306CS..Hα-helixtrans-60.1-41.7179.3-77.1173.150.600112.5L405 A410 H413 L467 M468 E474 A475L405-M471 HydrophobicContact CB-CE 4.43Å; L405-M471 HydrophobicContact CD1-CE 4.02Å; L405-M471 HydrophobicContact CD2-CB 4.5Å; L405-M471 HydrophobicContact CD2-CE 4.4Å; A410-M471 HydrophobicContact CB-CE 3.65Å; H413-M471 HydrophobicContact CB-SD 3.62Å; L467-M471 HydrophobicContact CD1-CG 4.42Å; L467-M471 HydrophobicContact CG-CG 4.46Å; L467-M471 HydrophobicContact CG-SD 4.35Å; L467-M471 WeakPolarHBondContact O-CB 3.16Å; L467-M471 VanDerWaalsContact O-CG 3.28Å; L467-M471 WeakPolarHBondContact O-CG 3.25Å; L467-M471 PolarHBondContact O-N 3.19Å; M468-M471 PolarHBondContact O-N 3.25Å; M471-E474 PolarHBondContact O-N 2.85Å; M471-A475 WeakPolarHBondContact O-CB 3.33Å; M471-A475 PolarHBondContact O-N 3.35Å
472I97.2Very high96.5Very high53 Ų5363.3 Ų63.327%0.27231%0.312SS..Hα-helixtrans-64.3-49.2177.5-65.7171.4000109.7F393 M468 I469 F470 E474 A475 F476F393-I472 HydrophobicContact CE1-CD1 4.13Å; F393-I472 HydrophobicContact CE1-CG1 4.07Å; F393-I472 HydrophobicContact CZ-CD1 3.69Å; F393-I472 HydrophobicContact CZ-CG1 3.82Å; M468-I472 HydrophobicContact CG-CD1 4.14Å; M468-I472 WeakPolarHBondContact O-CG1 3.49Å; M468-I472 PolarHBondContact O-N 3.38Å; M468-I472 HydrophobicContact SD-CD1 4.27Å; M468-I472 HydrophobicContact SD-CG1 4.33Å; I469-I472 PolarHBondContact O-N 3.09Å; F470-I472 VanDerWaalsContact C-N 3.33Å; F470-I472 PolarHBondContact O-N 3.01Å; I472-E474 VanDerWaalsContact C-N 3.33Å; I472-E474 PolarHBondContact O-N 3.18Å; I472-A475 PolarHBondContact O-N 3.07Å; I472-F476 HydrophobicContact CG2-CD2 3.89Å; I472-F476 HydrophobicContact CG2-CE2 3.73Å; I472-F476 WeakPolarHBondContact O-CD2 3.38Å; I472-F476 PolarHBondContact O-N 3.21Å
473W97.6Very high95.9Very high163 Ų16369.1 Ų69.162%0.61734%0.342SS*.Hα-helixtrans-57.2-46.8176.3168.781.3000111.8I469 F470 A475 F476 A477I469-W473 PolarHBondContact O-N 2.84Å; F470-W473 AromaticContact CD2-CE3 3.86Å; F470-W473 HydrophobicContact CD2-CE3 3.86Å; F470-W473 HydrophobicContact CD2-CZ3 4.05Å; F470-W473 AromaticContact CE2-CE3 3.87Å; F470-W473 HydrophobicContact CE2-CE3 3.87Å; F470-W473 AromaticContact CE2-CZ3 3.61Å; F470-W473 HydrophobicContact CE2-CZ3 3.61Å; F470-W473 HydrophobicContact CZ-CZ3 4.45Å; F470-W473 PolarHBondContact O-N 3.25Å; W473-A475 VanDerWaalsContact C-N 3.34Å; W473-A475 PolarHBondContact O-N 3.36Å; W473-F476 PolarHBondContact O-N 2.93Å; W473-A477 HydrophobicContact CZ2-CB 4.46Å; W473-A477 WeakPolarHBondContact O-CB 3.31Å; W473-A477 PolarHBondContact O-N 2.97Å
474E97.8Very high95.2Very high30 Ų3073.4 Ų73.414%0.1436%0.359CS..Hα-helixtrans-62.3-40-178.6-170.8-73.5144.900111.4F470 M471 I472 A477 S478 R480F470-E474 HydrophobicContact CE1-CB 4.34Å; F470-E474 HydrophobicContact CE1-CG 4.41Å; F470-E474 HydrophobicContact CZ-CB 4.36Å; F470-E474 HydrophobicContact CZ-CG 4.28Å; F470-E474 WeakPolarHBondContact O-CB 3.32Å; F470-E474 PolarHBondContact O-N 3.06Å; M471-E474 PolarHBondContact O-N 2.85Å; I472-E474 VanDerWaalsContact C-N 3.33Å; I472-E474 PolarHBondContact O-N 3.18Å; E474-A477 PolarHBondContact O-N 3.49Å; E474-S478 VanDerWaalsContact O-CB 3.24Å; E474-S478 WeakPolarHBondContact O-CB 3.27Å; E474-S478 PolarHBondContact O-N 3.27Å; E474-S478 PolarHBondContact O-OG 2.92Å; E474-R480 IonicContact OE1-CZ 3.56Å; E474-R480 IonicContact OE1-NH1 2.67Å; E474-R480 PolarHBondContact OE1-NH1 3.03Å; E474-R480 IonicContact OE1-NH2 3.59Å; E474-R480 IonicContact OE2-CZ 3.42Å; E474-R480 IonicContact OE2-NH1 3.31Å; E474-R480 PolarHBondContact OE2-NH1 3.14Å; E474-R480 IonicContact OE2-NH2 2.68Å; E474-R480 PolarHBondContact OE2-NH2 3.34Å
475A96.9Very high94.5Very high0 Ų074.6 Ų74.60%037%0.366CS..Hα-helixtrans-64.1-41.7176.200000112.7F397 L405 M471 I472 W473 S478 K479F397-A475 HydrophobicContact CE1-CB 3.78Å; F397-A475 HydrophobicContact CZ-CB 3.86Å; L405-A475 HydrophobicContact CD2-CB 3.92Å; M471-A475 WeakPolarHBondContact O-CB 3.33Å; M471-A475 PolarHBondContact O-N 3.35Å; I472-A475 PolarHBondContact O-N 3.07Å; W473-A475 VanDerWaalsContact C-N 3.34Å; W473-A475 PolarHBondContact O-N 3.36Å; A475-S478 PolarHBondContact O-OG 3.12Å; A475-K479 PolarHBondContact O-N 3.24Å
476F96.6Very high93.3Very high95 Ų9578.1 Ų78.142%0.41738%0.38SS..Hα-helixtrans-73.8-30.1176.4-74.1-65.3000113.4F397 Y403 I472 W473 K479F397-F476 HydrophobicContact CE2-CE2 4.42Å; F397-F476 HydrophobicContact CZ-CE2 4.23Å; F397-F476 HydrophobicContact CZ-CZ 4.39Å; Y403-F476 AromaticContact CD2-CD1 3.62Å; Y403-F476 HydrophobicContact CD2-CD1 3.62Å; Y403-F476 AromaticContact CD2-CE1 3.68Å; Y403-F476 HydrophobicContact CD2-CE1 3.68Å; Y403-F476 AromaticContact CE2-CD1 3.65Å; Y403-F476 HydrophobicContact CE2-CD1 3.65Å; Y403-F476 AromaticContact CE2-CE1 3.87Å; Y403-F476 HydrophobicContact CE2-CE1 3.87Å; I472-F476 HydrophobicContact CG2-CD2 3.89Å; I472-F476 HydrophobicContact CG2-CE2 3.73Å; I472-F476 WeakPolarHBondContact O-CD2 3.38Å; I472-F476 PolarHBondContact O-N 3.21Å; W473-F476 PolarHBondContact O-N 2.93Å; F476-K479 WeakPolarHBondContact O-CG 3.33Å
477A97.5Very high91.8Very high60 Ų6078.3 Ų78.350%0.49638%0.38SS..Hα-helixtrans-72.9-44.7175.700000111.8W473 E474W473-A477 HydrophobicContact CZ2-CB 4.46Å; W473-A477 WeakPolarHBondContact O-CB 3.31Å; W473-A477 PolarHBondContact O-N 2.97Å; E474-A477 PolarHBondContact O-N 3.49Å
478S95.6Very high90.1Very high50 Ų5079.2 Ų79.235%0.3539%0.388SS..Hα-helixtrans-75.7-24.9-179.963.40000113.5E474 A475 R480E474-S478 VanDerWaalsContact O-CB 3.24Å; E474-S478 WeakPolarHBondContact O-CB 3.27Å; E474-S478 PolarHBondContact O-N 3.27Å; E474-S478 PolarHBondContact O-OG 2.92Å; A475-S478 PolarHBondContact O-OG 3.12Å; S478-R480 PolarHBondContact O-N 3.07Å; S478-R480 VanDerWaalsContact OG-CZ 3.25Å; S478-R480 PolarHBondContact OG-NH1 2.75Å; S478-R480 VanDerWaalsContact OG-NH1 3.12Å; S478-R480 PolarHBondContact OG-NH2 2.83Å
479K94.1Very high88.5Confident134 Ų13482.9 Ų82.958%0.58342%0.415SS*.THydrogen-bonded Turntrans52.737.1178.5-59.5-179-179175.20113.4Y403 A475 F476 K481Y403-K479 HydrophobicContact CD1-CB 4.34Å; Y403-K479 HydrophobicContact CE1-CB 3.73Å; Y403-K479 HydrophobicContact CE1-CG 4.2Å; A475-K479 PolarHBondContact O-N 3.24Å; F476-K479 WeakPolarHBondContact O-CG 3.33Å; K479-K481 PolarHBondContact O-N 3.28Å
480R93.2Very high87.3Confident72 Ų7282.6 Ų82.627%0.27241%0.413SS..  trans-66.295.4175.8-70.4-175.4-61.5-88.9-11.9110.4Y403 T404 E474 S478Y403-R480 CarbonylContact C-O 3.5Å; Y403-R480 VanDerWaalsContact CA-O 3.22Å; Y403-R480 WeakPolarHBondContact CA-O 3.24Å; T404-R480 PolarHBondContact N-O 3Å; T404-R480 PolarHBondContact O-NE 2.95Å; T404-R480 PolarHBondContact O-NH2 2.91Å; T404-R480 WeakPolarHBondContact OG1-CB 3.43Å; T404-R480 PolarHBondContact OG1-O 2.98Å; E474-R480 IonicContact OE1-CZ 3.56Å; E474-R480 IonicContact OE1-NH1 2.67Å; E474-R480 PolarHBondContact OE1-NH1 3.03Å; E474-R480 IonicContact OE1-NH2 3.59Å; E474-R480 IonicContact OE2-CZ 3.42Å; E474-R480 IonicContact OE2-NH1 3.31Å; E474-R480 PolarHBondContact OE2-NH1 3.14Å; E474-R480 IonicContact OE2-NH2 2.68Å; E474-R480 PolarHBondContact OE2-NH2 3.34Å; S478-R480 PolarHBondContact O-N 3.07Å; S478-R480 VanDerWaalsContact OG-CZ 3.25Å; S478-R480 PolarHBondContact OG-NH1 2.75Å; S478-R480 VanDerWaalsContact OG-NH1 3.12Å; S478-R480 PolarHBondContact OG-NH2 2.83Å
481K93.1Very high86.8Confident150 Ų15080.5 Ų80.565%0.65241%0.405SS*.BIsolated β-bridgetrans-69.9148.3-178.5-66.5-174.6179.7-177.90111.8G402 Y403 K479 L483G402-K481 WeakPolarHBondContact O-CA 3.49Å; Y403-K481 HydrophobicContact CD1-CG 4.25Å; Y403-K481 HydrophobicContact CE1-CG 4.01Å; K479-K481 PolarHBondContact O-N 3.28Å; K481-L483 PolarHBondContact O-N 2.85Å
482V90.9Very high86.4Confident37 Ų3781.5 Ų81.522%0.22441%0.41CS..  trans-65.7121.5169.6-176.80000109.2P398 G402 T404 V485 C498P398-V482 HydrophobicContact CB-CG2 3.61Å; G402-V482 PolarHBondContact O-N 2.65Å; T404-V482 HydrophobicContact CG2-CG2 3.94Å; V482-V485 HydrophobicContact CG1-CG2 4.07Å; V482-C498 HydrophobicContact CB-CB 4.18Å; V482-C498 HydrophobicContact CG1-CB 4.37Å; V482-C498 HydrophobicContact CG2-CB 4.05Å
483L84.8Confident86.1Confident177 Ų17779.3 Ų79.393%0.92740%0.399SS*.  trans-89-44176.6-65.5176.8000111.8K481K481-L483 PolarHBondContact O-N 2.85Å
484M83.1Confident85.8Confident163 Ų16372.2 Ų72.280%0.80337%0.372SS*.  trans-151141.8-179.2-174.3174.9177.900109.1
485V83.1Confident85.4Confident26 Ų2674.6 Ų74.616%0.15839%0.385CS..  trans-95134169-176.60000108.2V482 W494V482-V485 HydrophobicContact CG1-CG2 4.07Å; V485-W494 HydrophobicContact CG1-CB 3.93Å; V485-W494 HydrophobicContact CG1-CD2 3.88Å; V485-W494 HydrophobicContact CG1-CE3 3.83Å; V485-W494 HydrophobicContact CG1-CG 3.92Å; V485-W494 HydrophobicContact CG2-CE3 3.99Å
486E71.4Confident85Confident105 Ų10579.6 Ų79.649%0.49141%0.405SS..SBendtrans-73131.4174.8-62.3-173.3175.600109.4Y260 K333Y260-E486 WeakPolarHBondContact CE2-O 3.29Å; Y260-E486 PolarHBondContact OH-O 3.1Å; K333-E486 IonicContact NZ-OE1 3.81Å; K333-E486 PolarHBondContact NZ-OE1 2.99Å; K333-E486 IonicContact NZ-OE2 2.68Å; K333-E486 PolarHBondContact NZ-OE2 3.41Å
487E66.3Low84.6Confident116 Ų11676.7 Ų76.754%0.54240%0.402SS..  trans49.757.5175-60.9-63155.300116.3S489E487-S489 PolarHBondContact O-N 3.32Å
488P61.8Low84.4Confident49 Ų4975.2 Ų75.232%0.31839%0.387SS..G310 helixtrans-69.3-16-178.730.4-35.7000113.3M490 N491 W494 L495P488-M490 VanDerWaalsContact C-N 3.28Å; P488-M490 PolarHBondContact O-N 3.34Å; P488-N491 PolarHBondContact O-N 3.07Å; P488-W494 HydrophobicContact CB-CB 4.3Å; P488-L495 VanDerWaalsContact O-CD2 3.28Å; P488-L495 WeakPolarHBondContact O-CD2 3.35Å
489S63.2Low84.3Confident93 Ų9376.2 Ų76.265%0.6539%0.393SS*.G310 helixtrans-70.7-20.3-173.7640000114.1E487E487-S489 PolarHBondContact O-N 3.32Å
490M73.9Confident84.2Confident80 Ų8070.3 Ų70.339%0.39437%0.368SS..G310 helixtrans-94.2-16.3-177.8-59.2-171.7-170.600113.5K265 P488K265-M490 HydrophobicContact CB-SD 4.3Å; K265-M490 HydrophobicContact CG-CE 3.85Å; K265-M490 HydrophobicContact CG-SD 3.79Å; P488-M490 VanDerWaalsContact C-N 3.28Å; P488-M490 PolarHBondContact O-N 3.34Å
491N85.9Confident84.2Confident34 Ų3470.3 Ų70.318%0.18238%0.378CS..  trans-132.5110.8-171.2-68.7-59.4000110P488 E493 W494P488-N491 PolarHBondContact O-N 3.07Å; N491-E493 PolarHBondContact O-N 3.41Å; N491-W494 PolarHBondContact O-N 3.15Å
492L89.4Confident84Confident25 Ų2568.6 Ų68.613%0.13137%0.368CS..G310 helixtrans-59-32.3-172.4-66.5-178000113.1L85 M176 W494 L495 V509 M511L85-L492 WeakPolarHBondContact O-CB 3.18Å; M176-L492 HydrophobicContact CE-CD1 4.19Å; L492-W494 PolarHBondContact O-N 3.39Å; L492-L495 HydrophobicContact CB-CD1 4.48Å; L492-L495 HydrophobicContact CD2-CD1 3.57Å; L492-L495 WeakPolarHBondContact O-CB 3.32Å; L492-L495 PolarHBondContact O-N 3.25Å; L492-V509 HydrophobicContact CD2-CG1 3.86Å; L492-M511 HydrophobicContact CD1-SD 4.35Å; L492-M511 HydrophobicContact CD2-SD 4.32Å
493E92.3Very high83.8Confident6 Ų673 Ų733%0.02839%0.386CS..G310 helixtrans-64.6-21.6-176.370.4-84.4-161.800113.5L85 M86 L399 N491L85-E493 HydrophobicContact CB-CB 3.82Å; L85-E493 HydrophobicContact CD1-CB 4.27Å; M86-E493 HydrophobicContact CE-CG 4.41Å; M86-E493 HydrophobicContact CG-CB 4.48Å; L399-E493 WeakPolarHBondContact CD1-O 3.35Å; L399-E493 HydrophobicContact CD2-CB 4.1Å; L399-E493 HydrophobicContact CD2-CG 4.1Å; N491-E493 PolarHBondContact O-N 3.41Å
494W91.8Very high83.9Confident14 Ų1465 Ų655%0.05334%0.344CS..G310 helixtrans-95.3-5.5-178.5-60.3101.3000114.2H395 W396 P398 L399 V485 P488 N491 L492 Y496H395-W494 AromaticContact CE1-CZ2 3.86Å; H395-W494 AromaticContact NE2-CZ2 3.92Å; H395-W494 WeakPolarHBondContact O-CH2 3.46Å; W396-W494 AromaticContact CD1-CZ2 3.48Å; W396-W494 VanDerWaalsContact CD1-CZ2 3.48Å; W396-W494 HydrophobicContact CG-CZ2 4.41Å; W396-W494 AromaticContact NE1-CZ2 3.93Å; P398-W494 HydrophobicContact CB-CZ3 4.39Å; L399-W494 HydrophobicContact CB-CE3 4.22Å; L399-W494 HydrophobicContact CB-CH2 3.69Å; L399-W494 HydrophobicContact CB-CZ2 4.46Å; L399-W494 HydrophobicContact CB-CZ3 3.55Å; L399-W494 HydrophobicContact CD1-CE3 3.99Å; L399-W494 HydrophobicContact CD1-CZ3 4.18Å; L399-W494 HydrophobicContact CG-CZ3 4.39Å; V485-W494 HydrophobicContact CG1-CB 3.93Å; V485-W494 HydrophobicContact CG1-CD2 3.88Å; V485-W494 HydrophobicContact CG1-CE3 3.83Å; V485-W494 HydrophobicContact CG1-CG 3.92Å; V485-W494 HydrophobicContact CG2-CE3 3.99Å; P488-W494 HydrophobicContact CB-CB 4.3Å; N491-W494 PolarHBondContact O-N 3.15Å; L492-W494 PolarHBondContact O-N 3.39Å; W494-Y496 PolarHBondContact O-N 2.91Å
495L88.6Confident84.2Confident80 Ų8057.6 Ų57.642%0.41931%0.307SS..THydrogen-bonded Turntrans-67-37.7-171.6-71.7176.5000113.9P488 L492 G497P488-L495 VanDerWaalsContact O-CD2 3.28Å; P488-L495 WeakPolarHBondContact O-CD2 3.35Å; L492-L495 HydrophobicContact CB-CD1 4.48Å; L492-L495 HydrophobicContact CD2-CD1 3.57Å; L492-L495 WeakPolarHBondContact O-CB 3.32Å; L492-L495 PolarHBondContact O-N 3.25Å; L495-G497 PolarHBondContact O-N 3.46Å
496Y88.4Confident84.2Confident105 Ų10564.7 Ų64.741%0.41234%0.339SS..THydrogen-bonded Turntrans-99.927.8-171.1-67.4-89.8000113.4W494 P500 P501 T504 F505W494-Y496 PolarHBondContact O-N 2.91Å; Y496-P500 WeakPolarHBondContact O-CA 3.25Å; Y496-P501 WeakPolarHBondContact O-CD 3.49Å; Y496-T504 HydrophobicContact CD1-CG2 4.28Å; Y496-T504 HydrophobicContact CD2-CG2 3.3Å; Y496-T504 HydrophobicContact CE2-CG2 3.95Å; Y496-T504 HydrophobicContact CG-CG2 3.49Å; Y496-T504 VanDerWaalsContact CG-CG2 3.49Å; Y496-F505 HydrophobicContact CD2-CE1 4.07Å; Y496-F505 HydrophobicContact CD2-CZ 4.41Å; Y496-F505 AromaticContact CE2-CD1 3.73Å; Y496-F505 HydrophobicContact CE2-CD1 3.73Å; Y496-F505 AromaticContact CE2-CE1 3.42Å; Y496-F505 HydrophobicContact CE2-CE1 3.42Å; Y496-F505 VanDerWaalsContact CE2-CE1 3.42Å; Y496-F505 HydrophobicContact CE2-CZ 4.19Å
497G88.1Confident84.7Confident34 Ų3467.3 Ų67.335%0.35135%0.351SS..  trans81-175.3175.900000114.4L495L495-G497 PolarHBondContact O-N 3.46Å
498C92.6Very high85.3Confident29 Ų2966.6 Ų66.620%0.19636%0.356CS..SBendtrans-134.5104.2-172.6-69.40000109.8P398 G402 V482P398-C498 WeakPolarHBondContact O-CB 3Å; G402-C498 VanDerWaalsContact CA-O 3.23Å; G402-C498 WeakPolarHBondContact CA-O 3.22Å; V482-C498 HydrophobicContact CB-CB 4.18Å; V482-C498 HydrophobicContact CG1-CB 4.37Å; V482-C498 HydrophobicContact CG2-CB 4.05Å
499P93.8Very high86.1Confident72 Ų7265.2 Ų65.247%0.46835%0.347SS..SBendcis-79.7153.9-3.233.7-35.1000113.2L399L399-P499 VanDerWaalsContact O-CA 3.31Å; L399-P499 WeakPolarHBondContact O-CA 3.42Å; L399-P499 WeakPolarHBondContact O-CB 3.39Å
500P93Very high86.6Confident10 Ų1069.6 Ų69.67%0.06535%0.351CS..PPolyproline II helixtrans-70.9147.317726.9-33000112.3K13 W81 L85 L399 Y496 T504K13-P500 PolarHBondContact NZ-O 3.08Å; W81-P500 HydrophobicContact CZ3-CG 4.42Å; L85-P500 HydrophobicContact CD1-CG 4.2Å; L399-P500 HydrophobicContact CD1-CG 4.26Å; Y496-P500 WeakPolarHBondContact O-CA 3.25Å; P500-T504 HydrophobicContact CB-CG2 4.47Å
501P92.3Very high86.4Confident72 Ų7269 Ų6947%0.46835%0.348SS..PPolyproline II helixtrans-55.5152.6179-2332.1000113.2K13 Y496 H503 T504K13-P501 PolarHBondContact NZ-O 3.21Å; Y496-P501 WeakPolarHBondContact O-CD 3.49Å; P501-H503 VanDerWaalsContact C-N 3.29Å; P501-H503 PolarHBondContact O-N 2.83Å; P501-T504 PolarHBondContact O-OG1 3.48Å
502Y88.3Confident85.4Confident113 Ų11375.7 Ų75.744%0.44338%0.375SS..SBendtrans-52.8-44.5-176.8-66.6-72.4000113.6R5 N11R5-Y502 PolarHBondContact NE-OH 2.64Å; R5-Y502 PolarHBondContact NH1-OH 2.67Å; R5-Y502 PolarHBondContact NH2-OH 3.41Å; N11-Y502 PolarHBondContact ND2-O 3.24Å
503H87.3Confident83.6Confident131 Ų13182.5 Ų82.561%0.60643%0.425SS*.SBendtrans-100.2103.7169.5-63.1-67.3000108.7P501P501-H503 VanDerWaalsContact C-N 3.29Å; P501-H503 PolarHBondContact O-N 2.83Å
504T87.9Confident83.2Confident8 Ų886.3 Ų86.35%0.04945%0.445CS..  trans-83.9-52.9-174-43.60000112.4K13 L85 Y496 P500 P501K13-T504 PolarHBondContact NZ-OG1 3.34Å; L85-T504 HydrophobicContact CD2-CG2 4.08Å; Y496-T504 HydrophobicContact CD1-CG2 4.28Å; Y496-T504 HydrophobicContact CD2-CG2 3.3Å; Y496-T504 HydrophobicContact CE2-CG2 3.95Å; Y496-T504 HydrophobicContact CG-CG2 3.49Å; Y496-T504 VanDerWaalsContact CG-CG2 3.49Å; P500-T504 HydrophobicContact CB-CG2 4.47Å; P501-T504 PolarHBondContact O-OG1 3.48Å
505F87.8Confident82.7Confident7 Ų790.1 Ų90.13%0.03147%0.465CS..  trans-108.991.4-172.1-56.1-79.7000109.6L85 A89 Y496 V509L85-F505 HydrophobicContact CD2-CE2 4.05Å; A89-F505 VanDerWaalsContact O-CD2 3.31Å; A89-F505 WeakPolarHBondContact O-CD2 3.49Å; Y496-F505 HydrophobicContact CD2-CE1 4.07Å; Y496-F505 HydrophobicContact CD2-CZ 4.41Å; Y496-F505 AromaticContact CE2-CD1 3.73Å; Y496-F505 HydrophobicContact CE2-CD1 3.73Å; Y496-F505 AromaticContact CE2-CE1 3.42Å; Y496-F505 HydrophobicContact CE2-CE1 3.42Å; Y496-F505 VanDerWaalsContact CE2-CE1 3.42Å; Y496-F505 HydrophobicContact CE2-CZ 4.19Å; F505-V509 HydrophobicContact CD1-CG2 3.21Å; F505-V509 HydrophobicContact CE1-CG2 3.3Å; F505-V509 HydrophobicContact CG-CG2 4.19Å; F505-V509 HydrophobicContact CZ-CG2 4.37Å
506E83.4Confident82.4Confident176 Ų17690.7 Ų90.782%0.82247%0.468SS*.SBendtrans-76.2-31172.9-64.3-174.5173.400111.6
507E81.4Confident82.1Confident159 Ų15989.8 Ų89.874%0.74347%0.471SS*.SBendtrans-116.8147.8174.8-64.4-175.3172.100110.7V509E507-V509 PolarHBondContact O-N 3.03Å
508P79.4Confident81.7Confident101 Ų10193.3 Ų93.366%0.65648%0.479SS*.  trans-58.4130.3175.9-22.933.2000111.7Y510P508-Y510 PolarHBondContact O-N 2.87Å
509V79.3Confident81Confident21 Ų2197.6 Ų97.613%0.12750%0.498CS..  trans-61.4124178.2-176.50000110.4P173 L492 F505 E507 M511P173-V509 HydrophobicContact CG-CB 4.21Å; L492-V509 HydrophobicContact CD2-CG1 3.86Å; F505-V509 HydrophobicContact CD1-CG2 3.21Å; F505-V509 HydrophobicContact CE1-CG2 3.3Å; F505-V509 HydrophobicContact CG-CG2 4.19Å; F505-V509 HydrophobicContact CZ-CG2 4.37Å; E507-V509 PolarHBondContact O-N 3.03Å; V509-M511 HydrophobicContact CG1-CG 4.46Å; V509-M511 HydrophobicContact CG1-SD 4.46Å; V509-M511 PolarHBondContact O-N 3.44Å
510Y73.8Confident80Confident185 Ų18599.4 Ų99.473%0.72550%0.5SS*.  trans-79.8115.3171.2-177.3-102.3000110.3P508 K512P508-Y510 PolarHBondContact O-N 2.87Å; Y510-K512 HydrophobicContact CD1-CG 4.39Å; Y510-K512 HydrophobicContact CE1-CG 3.61Å
511M69.3Low79Confident66 Ų66106.3 Ų106.333%0.32553%0.533SS..  trans-101.3120176.2-65.5-83.3-73.300109.1M176 L492 V509M176-M511 HydrophobicContact CE-CE 3.64Å; M176-M511 HydrophobicContact CE-CG 4.45Å; M176-M511 HydrophobicContact CE-SD 4.18Å; L492-M511 HydrophobicContact CD1-SD 4.35Å; L492-M511 HydrophobicContact CD2-SD 4.32Å; V509-M511 HydrophobicContact CG1-CG 4.46Å; V509-M511 HydrophobicContact CG1-SD 4.46Å; V509-M511 PolarHBondContact O-N 3.44Å
512K64.4Low77.9Confident175 Ų175109.2 Ų109.276%0.76154%0.539SS*.  trans-77.4126.6163.9-80.5-172.5175176.40108.2Y510Y510-K512 HydrophobicContact CD1-CG 4.39Å; Y510-K512 HydrophobicContact CE1-CG 3.61Å
513S52.8Low77Confident168 Ų168108.8 Ų108.8100%1.17555%0.547SS*.  trans-50.6018058.80000113.9

Retrieved 513 of 513 residues in 672.4 ms (Link to these results)